*HEADER    METAL BINDING PROTEIN                   23-FEB-17   5X6T              
*TITLE     N-TERMINAL ZINC FINGER OF SYNAPTOTAGMIN-LIKE PROTEIN 4                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: SYNAPTOTAGMIN-LIKE PROTEIN 4;                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 59-111;                                       
*COMPND   5 SYNONYM: EXOPHILIN-2,GRANUPHILIN;                                    
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606                                                 
*KEYWDS    SYNAPTOTAGMIN, METAL BINDING PROTEIN                                  
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.MIYAMOTO                                                            
*REVDAT   1   11-OCT-17 5X6T    0                                                
# Restraints file 1: Synapto.upl
 48 ALA  HN     49 LYS  HN      3.2            
 46 VAL  HA     49 LYS  HN      4.2           
 47 CYSS HA     49 LYS  HN      4.4           
 48 ALA  QB     49 LYS  HN      3.3           
 12 LEU  HN     13 GLY  HN      3.2           
 12 LEU  HA     13 GLY  HN      3.4           
 12 LEU  HB2    13 GLY  HN      4.53           
 12 LEU  HB3    13 GLY  HN      4.55          
 35 ILE  HN     36 GLN  HN      4.32           
 35 ILE  HA     36 GLN  HN      2.53          
 36 GLN  HN     36 GLN  QG      3.34          
 36 GLN  HN     36 GLN  HB2     3.24     
 36 GLN  HN     36 GLN  HB3     3.52          
 35 ILE  QG2    36 GLN  HN      3.21            
 29 VAL  HA     30 CYSS HN      2.43           
  5 CYSS HA     30 CYSS HN      3.74         
 30 CYSS HN     30 CYSS HB2     3.64      
 30 CYSS HN     30 CYSS HB3     3.22      
 29 VAL  QG1    30 CYSS HN      3.34      
 12 LEU  QD1    30 CYSS HN      3.21         
 30 CYSS HN     33 CYSS HB2     4.15      
 11 SER  HB2    12 LEU  HN      4.70        
 12 LEU  HN     12 LEU  HB2     3.0       
 12 LEU  HN     12 LEU  HB3     3.34    
  4 THR  QG2    12 LEU  HN      4.36    
 12 LEU  HN     12 LEU  QD2     3.13 
 37 GLU  HN     42 TRP  HA      3.3     
 36 GLN  HA     37 GLU  HN      2.45  
 37 GLU  HN     37 GLU  HG3     3.36 
 37 GLU  HN     37 GLU  HG2     3.46    
 37 GLU  HN     37 GLU  HB2     3.24       
 47 CYSS HN     48 ALA  HN      3.27    
 47 CYSS HN     47 CYSS QB      2.34
 46 VAL  HB     47 CYSS HN      3.78     
 43 ARG  HB3    47 CYSS HN      4.78    
 46 VAL  QG2    47 CYSS HN      3.45  
 46 VAL  QG1    47 CYSS HN      4.46
  5 CYSS HN      6 ALA  HN      5.89    
  5 CYSS HN     10 GLU  HN      3.58
  5 CYSS HN     10 GLU  HA      5.11     
  5 CYSS HN     11 SER  HA      5.52       
  5 CYSS HN      9 GLN  HA      4.26         
  5 CYSS HN      5 CYSS HB3     2.49           
  5 CYSS HN      5 CYSS HB2     3.05        
  5 CYSS HN     10 GLU  HB2     4.10          
  4 THR  QG2     5 CYSS HN      3.46          
  5 CYSS HN     12 LEU  QD2     3.65          
 27 HIS  HA     28 LEU  HN      2.53           
 27 HIS  HB2    28 LEU  HN      4.00           
 27 HIS  HB3    28 LEU  HN      3.25     
 28 LEU  HN     28 LEU  HB2     3.03         
 28 LEU  HN     28 LEU  HG      3.34       
  6 ALA  QB     28 LEU  HN      3.38        
 28 LEU  HN     29 VAL  QG2     4.34          
 28 LEU  HN     28 LEU  QD1     4.40      
 28 LEU  HN     28 LEU  QD2     4.16        
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           HN       SER   1   8.385   9.601  12.442
    2    HA   SER   1           HA       SER   1   8.434  10.880   9.981
    3    HB2  SER   1          2HB       SER   1   8.478  11.776  12.492
    4    HB3  SER   1          3HB       SER   1  10.198  11.940  12.138
    5    HG   SER   1           HG       SER   1   8.351  13.633  11.513
    6    H    ASP   2           HN       ASP   2  10.115   8.441  10.092
    7    HA   ASP   2           HA       ASP   2  12.640   9.629   9.144
    8    HB2  ASP   2          2HB       ASP   2  12.238   6.918  10.427
    9    HB3  ASP   2          3HB       ASP   2  13.766   7.544   9.812
   10    H    ARG   3           HN       ARG   3   9.865   8.069   8.227
   11    HA   ARG   3           HA       ARG   3   9.228   7.384   6.124
   12    HB2  ARG   3          2HB       ARG   3  12.077   7.046   5.262
   13    HB3  ARG   3          3HB       ARG   3  10.668   7.471   4.300
   14    HG2  ARG   3          2HG       ARG   3  11.028   9.517   6.214
   15    HG3  ARG   3          3HG       ARG   3  12.601   9.180   5.489
   16    HD2  ARG   3          2HD       ARG   3  11.199   9.215   3.259
   17    HD3  ARG   3          3HD       ARG   3  10.097  10.189   4.231
   18    HE   ARG   3           HE       ARG   3  12.586  11.017   3.140
   19   HH11  ARG   3          1HH1      ARG   3  10.498  11.411   5.896
   20   HH12  ARG   3          2HH1      ARG   3  11.077  13.001   6.272
   21   HH21  ARG   3          1HH2      ARG   3  13.357  13.108   3.624
   22   HH22  ARG   3          2HH2      ARG   3  12.703  13.966   4.978
   23    H    THR   4           HN       THR   4   8.817   5.587   7.773
   24    HA   THR   4           HA       THR   4  10.293   3.169   6.955
   25    HB   THR   4           HB       THR   4   8.827   2.800   9.416
   26    HG1  THR   4          1HG       THR   4  10.961   4.592   9.768
   27   HG21  THR   4          1HG2      THR   4  11.446   2.514  10.050
   28   HG22  THR   4          2HG2      THR   4  11.510   2.320   8.298
   29   HG23  THR   4          3HG2      THR   4  10.479   1.266   9.264
   30    H    CYS   5           HN       CYS   5   9.144   1.380   6.351
   31    HA   CYS   5           HA       CYS   5   6.764   1.546   5.080
   32    HB2  CYS   5          2HB       CYS   5   8.364  -0.446   5.224
   33    HB3  CYS   5          3HB       CYS   5   7.474  -0.915   6.670
   34    H    ALA   6           HN       ALA   6   4.587   0.973   5.558
   35    HA   ALA   6           HA       ALA   6   3.844   1.582   8.332
   36    HB1  ALA   6          1HB       ALA   6   1.757   1.505   6.245
   37    HB2  ALA   6          2HB       ALA   6   2.008   2.652   7.562
   38    HB3  ALA   6          3HB       ALA   6   2.974   2.773   6.091
   39    H    ARG   7           HN       ARG   7   4.455  -1.074   6.636
   40    HA   ARG   7           HA       ARG   7   2.279  -2.602   7.905
   41    HB2  ARG   7          2HB       ARG   7   3.703  -3.382   5.359
   42    HB3  ARG   7          3HB       ARG   7   2.301  -4.163   6.078
   43    HG2  ARG   7          2HG       ARG   7   2.424  -1.452   4.784
   44    HG3  ARG   7          3HG       ARG   7   1.553  -2.881   4.223
   45    HD2  ARG   7          2HD       ARG   7   0.882  -0.965   6.388
   46    HD3  ARG   7          3HD       ARG   7  -0.166  -1.748   5.206
   47    HE   ARG   7           HE       ARG   7   0.543  -3.817   6.732
   48   HH11  ARG   7          1HH1      ARG   7  -0.563  -0.625   7.574
   49   HH12  ARG   7          2HH1      ARG   7  -1.316  -1.134   9.050
   50   HH21  ARG   7          1HH2      ARG   7  -0.446  -4.499   8.672
   51   HH22  ARG   7          2HH2      ARG   7  -1.248  -3.337   9.673
   52    H    CYS   8           HN       CYS   8   5.676  -2.462   7.024
   53    HA   CYS   8           HA       CYS   8   6.192  -4.679   8.898
   54    HB2  CYS   8          2HB       CYS   8   8.175  -5.235   7.580
   55    HB3  CYS   8          3HB       CYS   8   6.730  -5.293   6.576
   56    H    GLN   9           HN       GLN   9   6.576  -1.405   8.303
   57    HA   GLN   9           HA       GLN   9   7.805   0.257   9.255
   58    HB2  GLN   9          2HB       GLN   9   7.594  -1.837  11.342
   59    HB3  GLN   9          3HB       GLN   9   8.800  -0.585  11.611
   60    HG2  GLN   9          2HG       GLN   9   6.309   0.578  10.769
   61    HG3  GLN   9          3HG       GLN   9   6.070  -0.468  12.168
   62   HE21  GLN   9          1HE2      GLN   9   8.674   1.712  11.136
   63   HE22  GLN   9          2HE2      GLN   9   8.718   2.629  12.599
   64    H    GLU  10           HN       GLU  10   9.241  -0.659   7.326
   65    HA   GLU  10           HA       GLU  10  11.913  -1.208   8.440
   66    HB2  GLU  10          2HB       GLU  10  10.528  -2.219   6.002
   67    HB3  GLU  10          3HB       GLU  10  12.268  -1.976   5.923
   68    HG2  GLU  10          2HG       GLU  10  12.544  -3.445   7.872
   69    HG3  GLU  10          3HG       GLU  10  10.803  -3.721   7.889
   70    H    SER  11           HN       SER  11  13.715  -0.193   7.418
   71    HA   SER  11           HA       SER  11  13.398   2.526   6.918
   72    HB2  SER  11          2HB       SER  11  15.774   2.114   5.753
   73    HB3  SER  11          3HB       SER  11  15.567   2.077   7.505
   74    HG   SER  11           HG       SER  11  15.898  -0.047   5.699
   75    H    LEU  12           HN       LEU  12  13.073   3.742   5.140
   76    HA   LEU  12           HA       LEU  12  12.377   2.337   2.678
   77    HB2  LEU  12          2HB       LEU  12  11.828   5.062   3.776
   78    HB3  LEU  12          3HB       LEU  12  11.668   4.763   2.047
   79    HG   LEU  12           HG       LEU  12   9.613   4.584   3.706
   80   HD11  LEU  12          1HD1      LEU  12   9.824   4.171   1.178
   81   HD12  LEU  12          2HD1      LEU  12   8.479   3.424   2.040
   82   HD13  LEU  12          3HD1      LEU  12   9.894   2.463   1.610
   83   HD21  LEU  12          1HD2      LEU  12  10.844   2.811   5.034
   84   HD22  LEU  12          2HD2      LEU  12  10.576   1.734   3.662
   85   HD23  LEU  12          3HD2      LEU  12   9.200   2.414   4.534
   86    H    GLY  13           HN       GLY  13  14.484   4.965   3.797
   87    HA2  GLY  13          1HA       GLY  13  16.155   6.115   2.662
   88    HA3  GLY  13          2HA       GLY  13  16.726   4.472   2.412
   89    H    ARG  14           HN       ARG  14  16.999   3.828   0.381
   90    HA   ARG  14           HA       ARG  14  16.307   5.581  -1.780
   91    HB2  ARG  14          2HB       ARG  14  17.620   2.866  -1.674
   92    HB3  ARG  14          3HB       ARG  14  17.310   3.716  -3.183
   93    HG2  ARG  14          2HG       ARG  14  18.696   5.586  -2.391
   94    HG3  ARG  14          3HG       ARG  14  19.043   4.680  -0.917
   95    HD2  ARG  14          2HD       ARG  14  19.607   2.929  -3.021
   96    HD3  ARG  14          3HD       ARG  14  20.261   4.488  -3.523
   97    HE   ARG  14           HE       ARG  14  21.135   4.214  -0.967
   98   HH11  ARG  14          1HH1      ARG  14  21.318   2.222  -3.816
   99   HH12  ARG  14          2HH1      ARG  14  22.826   1.494  -3.370
  100   HH21  ARG  14          1HH2      ARG  14  23.120   3.264  -0.368
  101   HH22  ARG  14          2HH2      ARG  14  23.850   2.087  -1.408
  102    H    LEU  15           HN       LEU  15  13.941   5.050  -0.730
  103    HA   LEU  15           HA       LEU  15  12.742   2.925  -2.373
  104    HB2  LEU  15          2HB       LEU  15  12.239   3.941   0.315
  105    HB3  LEU  15          3HB       LEU  15  10.776   3.791  -0.657
  106    HG   LEU  15           HG       LEU  15  11.669   1.823   0.878
  107   HD11  LEU  15          1HD1      LEU  15  10.466   1.503  -1.866
  108   HD12  LEU  15          2HD1      LEU  15   9.601   1.747  -0.350
  109   HD13  LEU  15          3HD1      LEU  15  10.492   0.251  -0.625
  110   HD21  LEU  15          1HD2      LEU  15  13.819   1.909  -0.627
  111   HD22  LEU  15          2HD2      LEU  15  12.837   0.923  -1.711
  112   HD23  LEU  15          3HD2      LEU  15  13.167   0.369  -0.068
  113    H    SER  16           HN       SER  16  12.526   6.330  -1.513
  114    HA   SER  16           HA       SER  16  11.779   8.086  -2.802
  115    HB2  SER  16          2HB       SER  16  12.069   6.260  -4.734
  116    HB3  SER  16          3HB       SER  16  10.308   6.353  -4.726
  117    HG   SER  16           HG       SER  16  12.040   8.050  -5.814
  118    HA   PRO  17           HA       PRO  17   7.834   7.342  -0.532
  119    HB2  PRO  17          2HB       PRO  17   7.990   9.629   0.921
  120    HB3  PRO  17          3HB       PRO  17   8.778   8.125   1.411
  121    HG2  PRO  17          2HG       PRO  17   9.946  10.513   0.035
  122    HG3  PRO  17          3HG       PRO  17  10.617   9.548   1.363
  123    HD2  PRO  17          2HD       PRO  17  11.405   9.235  -1.210
  124    HD3  PRO  17          3HD       PRO  17  11.361   7.888  -0.055
  125    H    LYS  18           HN       LYS  18   8.928   9.372  -2.904
  126    HA   LYS  18           HA       LYS  18   6.958  11.408  -2.916
  127    HB2  LYS  18          2HB       LYS  18   9.010  11.699  -4.157
  128    HB3  LYS  18          3HB       LYS  18   8.671  10.275  -5.133
  129    HG2  LYS  18          2HG       LYS  18   7.295  11.389  -6.511
  130    HG3  LYS  18          3HG       LYS  18   6.597  12.352  -5.207
  131    HD2  LYS  18          2HD       LYS  18   8.282  13.946  -5.315
  132    HD3  LYS  18          3HD       LYS  18   9.407  12.848  -6.117
  133    HE2  LYS  18          2HE       LYS  18   8.603  13.322  -8.166
  134    HE3  LYS  18          3HE       LYS  18   6.934  13.398  -7.605
  135    HZ1  LYS  18          1HZ       LYS  18   8.942  15.519  -7.762
  136    HZ2  LYS  18          2HZ       LYS  18   7.826  15.592  -6.494
  137    HZ3  LYS  18          3HZ       LYS  18   7.284  15.574  -8.096
  138    H    THR  19           HN       THR  19   7.071   8.147  -4.179
  139    HA   THR  19           HA       THR  19   4.237   8.394  -4.912
  140    HB   THR  19           HB       THR  19   4.688   8.100  -7.073
  141    HG1  THR  19          1HG       THR  19   5.646   5.950  -7.624
  142   HG21  THR  19          1HG2      THR  19   7.013   7.693  -7.899
  143   HG22  THR  19          2HG2      THR  19   7.531   7.557  -6.218
  144   HG23  THR  19          3HG2      THR  19   6.867   9.077  -6.817
  145    H    ASN  20           HN       ASN  20   6.430   6.939  -2.998
  146    HA   ASN  20           HA       ASN  20   5.316   4.251  -3.120
  147    HB2  ASN  20          2HB       ASN  20   7.520   5.473  -1.452
  148    HB3  ASN  20          3HB       ASN  20   6.978   3.806  -1.272
  149   HD21  ASN  20          1HD2      ASN  20   9.053   3.082  -1.829
  150   HD22  ASN  20          2HD2      ASN  20   9.598   3.087  -3.469
  151    H    THR  21           HN       THR  21   3.426   6.165  -2.447
  152    HA   THR  21           HA       THR  21   2.900   5.497   0.373
  153    HB   THR  21           HB       THR  21   2.241   8.096  -1.024
  154    HG1  THR  21          1HG       THR  21   3.663   8.938   0.594
  155   HG21  THR  21          1HG2      THR  21   1.384   8.791   1.205
  156   HG22  THR  21          2HG2      THR  21   1.559   7.122   1.751
  157   HG23  THR  21          3HG2      THR  21   0.428   7.514   0.456
  158    H    CYS  22           HN       CYS  22   1.351   3.995   0.314
  159    HA   CYS  22           HA       CYS  22  -0.380   3.254  -1.587
  160    HB2  CYS  22          2HB       CYS  22  -0.196   2.250   0.700
  161    HB3  CYS  22          3HB       CYS  22  -1.220   3.549   1.302
  162    H    ARG  23           HN       ARG  23  -1.964   4.126  -2.745
  163    HA   ARG  23           HA       ARG  23  -2.833   6.812  -2.222
  164    HB2  ARG  23          2HB       ARG  23  -4.331   5.285  -4.234
  165    HB3  ARG  23          3HB       ARG  23  -3.495   6.825  -4.378
  166    HG2  ARG  23          2HG       ARG  23  -1.365   5.254  -4.245
  167    HG3  ARG  23          3HG       ARG  23  -2.515   4.076  -4.879
  168    HD2  ARG  23          2HD       ARG  23  -2.092   6.795  -6.098
  169    HD3  ARG  23          3HD       ARG  23  -1.198   5.361  -6.603
  170    HE   ARG  23           HE       ARG  23  -3.937   4.785  -6.695
  171   HH11  ARG  23          1HH1      ARG  23  -1.579   6.774  -8.310
  172   HH12  ARG  23          2HH1      ARG  23  -2.422   6.772  -9.824
  173   HH21  ARG  23          1HH2      ARG  23  -5.055   4.774  -8.683
  174   HH22  ARG  23          2HH2      ARG  23  -4.399   5.634 -10.035
  175    H    GLY  24           HN       GLY  24  -3.724   3.953  -0.892
  176    HA2  GLY  24          1HA       GLY  24  -6.543   4.782  -0.589
  177    HA3  GLY  24          2HA       GLY  24  -5.983   3.121  -0.467
  178    H    CYS  25           HN       CYS  25  -3.591   4.530   1.038
  179    HA   CYS  25           HA       CYS  25  -4.979   4.725   3.630
  180    HB2  CYS  25          2HB       CYS  25  -2.371   3.334   2.999
  181    HB3  CYS  25          3HB       CYS  25  -2.916   3.686   4.635
  182    H    ASN  26           HN       ASN  26  -2.355   5.794   1.575
  183    HA   ASN  26           HA       ASN  26  -1.338   7.853   1.498
  184    HB2  ASN  26          2HB       ASN  26  -2.383   8.630   4.192
  185    HB3  ASN  26          3HB       ASN  26  -2.084   9.635   2.777
  186   HD21  ASN  26          1HD2      ASN  26  -4.430   9.659   4.348
  187   HD22  ASN  26          2HD2      ASN  26  -5.743   9.154   3.345
  188    H    HIS  27           HN       HIS  27  -0.633   5.336   3.174
  189    HA   HIS  27           HA       HIS  27   1.483   6.563   4.809
  190    HB2  HIS  27          2HB       HIS  27   0.336   3.766   4.930
  191    HB3  HIS  27          3HB       HIS  27   1.612   4.388   5.971
  192    HD1  HIS  27          1HD       HIS  27   0.405   7.104   6.731
  193    HD2  HIS  27          2HD       HIS  27  -1.735   3.544   6.679
  194    HE1  HIS  27          1HE       HIS  27  -1.539   7.466   8.285
  195    H    LEU  28           HN       LEU  28   3.515   5.161   4.939
  196    HA   LEU  28           HA       LEU  28   4.469   4.776   2.243
  197    HB2  LEU  28          2HB       LEU  28   5.765   4.647   4.950
  198    HB3  LEU  28          3HB       LEU  28   6.627   4.206   3.477
  199    HG   LEU  28           HG       LEU  28   5.501   6.919   4.165
  200   HD11  LEU  28          1HD1      LEU  28   7.874   5.738   4.935
  201   HD12  LEU  28          2HD1      LEU  28   7.526   7.466   4.906
  202   HD13  LEU  28          3HD1      LEU  28   8.323   6.704   3.530
  203   HD21  LEU  28          1HD2      LEU  28   5.296   7.063   1.921
  204   HD22  LEU  28          2HD2      LEU  28   6.414   5.732   1.622
  205   HD23  LEU  28          3HD2      LEU  28   7.036   7.337   2.001
  206    H    VAL  29           HN       VAL  29   5.370   2.865   1.406
  207    HA   VAL  29           HA       VAL  29   5.144   0.392   2.885
  208    HB   VAL  29           HB       VAL  29   3.814  -0.158   0.434
  209   HG11  VAL  29          1HG1      VAL  29   2.430  -0.108   3.079
  210   HG12  VAL  29          2HG1      VAL  29   2.342  -1.307   1.787
  211   HG13  VAL  29          3HG1      VAL  29   3.772  -1.221   2.817
  212   HG21  VAL  29          1HG2      VAL  29   2.368   1.936   2.047
  213   HG22  VAL  29          2HG2      VAL  29   3.220   2.277   0.540
  214   HG23  VAL  29          3HG2      VAL  29   1.842   1.177   0.544
  215    H    CYS  30           HN       CYS  30   7.054  -0.497   2.472
  216    HA   CYS  30           HA       CYS  30   8.806   0.092   0.445
  217    HB2  CYS  30          2HB       CYS  30   9.962  -1.967   0.978
  218    HB3  CYS  30          3HB       CYS  30   9.343  -1.255   2.465
  219    H    ARG  31           HN       ARG  31   9.609  -1.749  -1.149
  220    HA   ARG  31           HA       ARG  31   7.441  -2.102  -3.030
  221    HB2  ARG  31          2HB       ARG  31   9.230  -2.942  -4.540
  222    HB3  ARG  31          3HB       ARG  31   9.555  -1.336  -3.899
  223    HG2  ARG  31          2HG       ARG  31  11.062  -2.326  -2.230
  224    HG3  ARG  31          3HG       ARG  31  10.764  -3.918  -2.930
  225    HD2  ARG  31          2HD       ARG  31  11.489  -2.132  -5.023
  226    HD3  ARG  31          3HD       ARG  31  12.663  -1.966  -3.718
  227    HE   ARG  31           HE       ARG  31  12.239  -4.691  -4.186
  228   HH11  ARG  31          1HH1      ARG  31  13.615  -1.911  -5.764
  229   HH12  ARG  31          2HH1      ARG  31  14.763  -2.833  -6.677
  230   HH21  ARG  31          1HH2      ARG  31  13.744  -5.917  -5.382
  231   HH22  ARG  31          2HH2      ARG  31  14.835  -5.113  -6.460
  232    H    ASP  32           HN       ASP  32   7.698  -3.701  -0.467
  233    HA   ASP  32           HA       ASP  32   7.477  -6.360  -1.714
  234    HB2  ASP  32          2HB       ASP  32   9.520  -5.936  -0.188
  235    HB3  ASP  32          3HB       ASP  32   8.359  -5.972   1.136
  236    H    CYS  33           HN       CYS  33   6.007  -3.925   0.104
  237    HA   CYS  33           HA       CYS  33   3.979  -5.773   1.165
  238    HB2  CYS  33          2HB       CYS  33   4.757  -2.964   1.945
  239    HB3  CYS  33          3HB       CYS  33   3.268  -3.720   2.506
  240    H    ARG  34           HN       ARG  34   4.455  -4.245  -1.572
  241    HA   ARG  34           HA       ARG  34   1.759  -3.100  -1.797
  242    HB2  ARG  34          2HB       ARG  34   3.433  -2.802  -4.149
  243    HB3  ARG  34          3HB       ARG  34   2.624  -1.572  -3.188
  244    HG2  ARG  34          2HG       ARG  34   4.473  -1.569  -1.607
  245    HG3  ARG  34          3HG       ARG  34   5.281  -2.832  -2.538
  246    HD2  ARG  34          2HD       ARG  34   4.565  -0.097  -3.588
  247    HD3  ARG  34          3HD       ARG  34   6.160  -0.566  -3.000
  248    HE   ARG  34           HE       ARG  34   5.625  -2.409  -4.914
  249   HH11  ARG  34          1HH1      ARG  34   5.598   1.072  -4.845
  250   HH12  ARG  34          2HH1      ARG  34   6.019   1.238  -6.518
  251   HH21  ARG  34          1HH2      ARG  34   6.180  -2.203  -7.117
  252   HH22  ARG  34          2HH2      ARG  34   6.349  -0.625  -7.809
  253    H    ILE  35           HN       ILE  35   0.280  -3.868  -3.249
  254    HA   ILE  35           HA       ILE  35   0.994  -6.380  -4.614
  255    HB   ILE  35           HB       ILE  35  -1.562  -5.492  -3.317
  256   HG12  ILE  35          2HG1      ILE  35  -1.418  -7.761  -2.319
  257   HG13  ILE  35          3HG1      ILE  35   0.085  -8.027  -3.196
  258   HG21  ILE  35          1HG2      ILE  35  -2.562  -7.587  -4.365
  259   HG22  ILE  35          2HG2      ILE  35  -2.375  -6.180  -5.409
  260   HG23  ILE  35          3HG2      ILE  35  -1.226  -7.512  -5.513
  261   HD11  ILE  35          1HD1      ILE  35   0.000  -5.613  -1.521
  262   HD12  ILE  35          2HD1      ILE  35  -0.042  -7.153  -0.664
  263   HD13  ILE  35          3HD1      ILE  35   1.290  -6.791  -1.761
  264    H    GLN  36           HN       GLN  36   1.287  -6.044  -6.715
  265    HA   GLN  36           HA       GLN  36   0.581  -3.883  -8.231
  266    HB2  GLN  36          2HB       GLN  36   1.522  -6.552  -8.733
  267    HB3  GLN  36          3HB       GLN  36   0.340  -6.104  -9.956
  268    HG2  GLN  36          2HG       GLN  36   2.507  -4.183  -9.276
  269    HG3  GLN  36          3HG       GLN  36   2.882  -5.584 -10.279
  270   HE21  GLN  36          1HE2      GLN  36   0.407  -3.054 -10.006
  271   HE22  GLN  36          2HE2      GLN  36   0.284  -2.753 -11.703
  272    H    GLU  37           HN       GLU  37  -1.406  -3.007  -8.201
  273    HA   GLU  37           HA       GLU  37  -3.793  -4.601  -8.195
  274    HB2  GLU  37          2HB       GLU  37  -3.291  -1.635  -8.415
  275    HB3  GLU  37          3HB       GLU  37  -4.905  -2.328  -8.496
  276    HG2  GLU  37          2HG       GLU  37  -3.405  -3.283  -6.204
  277    HG3  GLU  37          3HG       GLU  37  -3.577  -1.529  -6.221
  278    H    SER  38           HN       SER  38  -5.170  -5.043  -9.848
  279    HA   SER  38           HA       SER  38  -4.241  -5.297 -12.434
  280    HB2  SER  38          2HB       SER  38  -6.314  -6.132 -12.943
  281    HB3  SER  38          3HB       SER  38  -6.446  -6.160 -11.184
  282    HG   SER  38           HG       SER  38  -8.173  -5.091 -12.569
  283    H    ASN  39           HN       ASN  39  -5.411  -2.489 -10.847
  284    HA   ASN  39           HA       ASN  39  -6.135  -1.050 -13.228
  285    HB2  ASN  39          2HB       ASN  39  -6.528   0.819 -11.787
  286    HB3  ASN  39          3HB       ASN  39  -7.105  -0.614 -10.942
  287   HD21  ASN  39          1HD2      ASN  39  -6.861   1.101  -9.195
  288   HD22  ASN  39          2HD2      ASN  39  -5.355   1.112  -8.349
  289    H    GLY  40           HN       GLY  40  -4.924   1.460 -12.584
  290    HA2  GLY  40          1HA       GLY  40  -2.240   0.922 -13.641
  291    HA3  GLY  40          2HA       GLY  40  -3.104   2.447 -13.757
  292    H    THR  41           HN       THR  41  -2.438   0.388 -10.941
  293    HA   THR  41           HA       THR  41  -0.407   2.087  -9.896
  294    HB   THR  41           HB       THR  41  -2.634   3.380  -9.545
  295    HG1  THR  41          1HG       THR  41  -0.397   3.428  -8.347
  296   HG21  THR  41          1HG2      THR  41  -4.170   2.597  -8.107
  297   HG22  THR  41          2HG2      THR  41  -2.947   2.032  -6.969
  298   HG23  THR  41          3HG2      THR  41  -3.398   1.031  -8.349
  299    H    TRP  42           HN       TRP  42  -0.929   1.614  -7.137
  300    HA   TRP  42           HA       TRP  42  -1.169  -1.279  -6.875
  301    HB2  TRP  42          2HB       TRP  42   0.966  -1.477  -5.674
  302    HB3  TRP  42          3HB       TRP  42   1.212  -0.933  -7.331
  303    HD1  TRP  42          1HD       TRP  42   2.571   1.239  -7.652
  304    HE1  TRP  42          1HE       TRP  42   3.543   3.026  -6.076
  305    HE3  TRP  42          3HE       TRP  42   0.374  -0.252  -3.283
  306    HZ2  TRP  42          2HZ       TRP  42   3.399   3.712  -3.342
  307    HZ3  TRP  42          3HZ       TRP  42   0.845   1.023  -1.232
  308    HH2  TRP  42          2HH       TRP  42   2.327   2.964  -1.262
  309    H    ARG  43           HN       ARG  43  -1.501  -1.988  -4.710
  310    HA   ARG  43           HA       ARG  43  -1.996   0.127  -2.737
  311    HB2  ARG  43          2HB       ARG  43  -3.944  -1.983  -3.647
  312    HB3  ARG  43          3HB       ARG  43  -4.097  -1.179  -2.090
  313    HG2  ARG  43          2HG       ARG  43  -3.749   0.816  -4.075
  314    HG3  ARG  43          3HG       ARG  43  -4.993  -0.307  -4.629
  315    HD2  ARG  43          2HD       ARG  43  -5.017   0.784  -1.837
  316    HD3  ARG  43          3HD       ARG  43  -5.696   1.705  -3.178
  317    HE   ARG  43           HE       ARG  43  -6.680  -0.991  -3.013
  318   HH11  ARG  43          1HH1      ARG  43  -7.091   2.281  -1.896
  319   HH12  ARG  43          2HH1      ARG  43  -8.766   2.074  -1.505
  320   HH21  ARG  43          1HH2      ARG  43  -8.884  -1.274  -2.504
  321   HH22  ARG  43          2HH2      ARG  43  -9.785   0.052  -1.851
  322    H    CYS  44           HN       CYS  44  -1.379  -0.372  -0.711
  323    HA   CYS  44           HA       CYS  44   0.391  -2.333  -0.095
  324    HB2  CYS  44          2HB       CYS  44   0.000  -1.888   2.205
  325    HB3  CYS  44          3HB       CYS  44  -0.340  -0.383   1.357
  326    H    LYS  45           HN       LYS  45   0.122  -4.207   1.434
  327    HA   LYS  45           HA       LYS  45  -1.581  -6.140   0.268
  328    HB2  LYS  45          2HB       LYS  45  -0.486  -6.608   2.993
  329    HB3  LYS  45          3HB       LYS  45  -0.501  -7.669   1.591
  330    HG2  LYS  45          2HG       LYS  45   1.230  -6.092   0.588
  331    HG3  LYS  45          3HG       LYS  45   1.385  -5.423   2.213
  332    HD2  LYS  45          2HD       LYS  45   2.963  -7.022   2.433
  333    HD3  LYS  45          3HD       LYS  45   1.573  -8.061   2.755
  334    HE2  LYS  45          2HE       LYS  45   1.619  -8.216   0.085
  335    HE3  LYS  45          3HE       LYS  45   3.330  -7.904   0.375
  336    HZ1  LYS  45          1HZ       LYS  45   2.633  -9.820   2.209
  337    HZ2  LYS  45          2HZ       LYS  45   3.515 -10.063   0.787
  338    HZ3  LYS  45          3HZ       LYS  45   1.839 -10.294   0.792
  339    H    VAL  46           HN       VAL  46  -2.070  -3.833   2.744
  340    HA   VAL  46           HA       VAL  46  -4.228  -5.262   4.037
  341    HB   VAL  46           HB       VAL  46  -3.522  -2.348   4.370
  342   HG11  VAL  46          1HG1      VAL  46  -4.593  -2.572   6.526
  343   HG12  VAL  46          2HG1      VAL  46  -5.703  -3.096   5.257
  344   HG13  VAL  46          3HG1      VAL  46  -4.863  -4.292   6.247
  345   HG21  VAL  46          1HG2      VAL  46  -2.544  -4.320   6.337
  346   HG22  VAL  46          2HG2      VAL  46  -1.719  -4.301   4.778
  347   HG23  VAL  46          3HG2      VAL  46  -1.798  -2.832   5.752
  348    H    CYS  47           HN       CYS  47  -3.839  -3.132   1.378
  349    HA   CYS  47           HA       CYS  47  -6.691  -2.454   1.356
  350    HB2  CYS  47          2HB       CYS  47  -4.275  -1.325  -0.021
  351    HB3  CYS  47          3HB       CYS  47  -5.882  -1.033  -0.679
  352    H    ALA  48           HN       ALA  48  -4.173  -3.763  -0.791
  353    HA   ALA  48           HA       ALA  48  -5.931  -4.497  -2.876
  354    HB1  ALA  48          1HB       ALA  48  -3.390  -5.986  -2.411
  355    HB2  ALA  48          2HB       ALA  48  -4.100  -5.411  -3.920
  356    HB3  ALA  48          3HB       ALA  48  -3.325  -4.272  -2.820
  357    H    LYS  49           HN       LYS  49  -5.336  -5.870   0.185
  358    HA   LYS  49           HA       LYS  49  -5.685  -8.588  -0.227
  359    HB2  LYS  49          2HB       LYS  49  -5.657  -6.822   1.983
  360    HB3  LYS  49          3HB       LYS  49  -7.117  -7.791   2.129
  361    HG2  LYS  49          2HG       LYS  49  -5.179  -9.641   1.470
  362    HG3  LYS  49          3HG       LYS  49  -4.346  -8.525   2.555
  363    HD2  LYS  49          2HD       LYS  49  -6.289  -8.779   4.135
  364    HD3  LYS  49          3HD       LYS  49  -6.873 -10.077   3.091
  365    HE2  LYS  49          2HE       LYS  49  -4.228  -9.986   4.539
  366    HE3  LYS  49          3HE       LYS  49  -5.615 -10.992   4.954
  367    HZ1  LYS  49          1HZ       LYS  49  -4.979 -12.511   3.490
  368    HZ2  LYS  49          2HZ       LYS  49  -3.542 -11.648   3.269
  369    HZ3  LYS  49          3HZ       LYS  49  -4.859 -11.372   2.244
  370    H    GLU  50           HN       GLU  50  -7.719  -9.801   0.604
  371    HA   GLU  50           HA       GLU  50  -9.909  -8.979  -1.112
  372    HB2  GLU  50          2HB       GLU  50  -9.267 -11.297  -1.216
  373    HB3  GLU  50          3HB       GLU  50  -9.433 -11.470   0.526
  374    HG2  GLU  50          2HG       GLU  50 -11.842 -11.082   0.327
  375    HG3  GLU  50          3HG       GLU  50 -11.666 -10.942  -1.421
  376    H    ILE  51           HN       ILE  51 -10.764  -7.193  -0.020
  377    HA   ILE  51           HA       ILE  51 -12.780  -7.775   1.876
  378    HB   ILE  51           HB       ILE  51 -10.840  -7.857   3.410
  379   HG12  ILE  51          2HG1      ILE  51 -12.566  -5.422   3.897
  380   HG13  ILE  51          3HG1      ILE  51 -13.116  -7.077   4.129
  381   HG21  ILE  51          1HG2      ILE  51  -9.469  -6.208   2.135
  382   HG22  ILE  51          2HG2      ILE  51 -10.493  -4.930   2.790
  383   HG23  ILE  51          3HG2      ILE  51  -9.517  -5.920   3.874
  384   HD11  ILE  51          1HD1      ILE  51 -12.517  -6.483   6.257
  385   HD12  ILE  51          2HD1      ILE  51 -11.031  -7.242   5.684
  386   HD13  ILE  51          3HD1      ILE  51 -11.168  -5.485   5.716
  387    H    GLU  52           HN       GLU  52 -14.228  -6.085   2.120
  388    HA   GLU  52           HA       GLU  52 -13.580  -3.621   0.639
  389    HB2  GLU  52          2HB       GLU  52 -16.010  -3.525   0.042
  390    HB3  GLU  52          3HB       GLU  52 -15.134  -4.862  -0.690
  391    HG2  GLU  52          2HG       GLU  52 -16.054  -6.406   0.906
  392    HG3  GLU  52          3HG       GLU  52 -16.831  -5.089   1.783
  393    H    LEU  53           HN       LEU  53 -15.497  -1.952   1.200
  394    HA   LEU  53           HA       LEU  53 -16.334  -0.512   2.747
  395    HB2  LEU  53          2HB       LEU  53 -17.686  -2.466   3.377
  396    HB3  LEU  53          3HB       LEU  53 -16.425  -2.962   4.502
  397    HG   LEU  53           HG       LEU  53 -16.968  -1.337   6.038
  398   HD11  LEU  53          1HD1      LEU  53 -18.299   0.218   3.826
  399   HD12  LEU  53          2HD1      LEU  53 -16.738   0.574   4.563
  400   HD13  LEU  53          3HD1      LEU  53 -18.214   0.709   5.518
  401   HD21  LEU  53          1HD2      LEU  53 -19.719  -1.308   5.010
  402   HD22  LEU  53          2HD2      LEU  53 -19.090  -1.859   6.564
  403   HD23  LEU  53          3HD2      LEU  53 -18.993  -2.910   5.150
  Start of MODEL    2
    1    H1   SER   1           HN       SER   1   8.939  10.529  12.534
    2    HA   SER   1           HA       SER   1   7.742  10.287  10.404
    3    HB2  SER   1          2HB       SER   1   7.668  12.396   8.985
    4    HB3  SER   1          3HB       SER   1   6.586  12.372  10.377
    5    HG   SER   1           HG       SER   1   9.151  13.439  10.701
    6    H    ASP   2           HN       ASP   2   9.510   9.011   9.953
    7    HA   ASP   2           HA       ASP   2  11.842  10.404   8.808
    8    HB2  ASP   2          2HB       ASP   2  11.787   8.551  10.903
    9    HB3  ASP   2          3HB       ASP   2  12.357   7.638   9.509
   10    H    ARG   3           HN       ARG   3   9.165   8.598   8.076
   11    HA   ARG   3           HA       ARG   3   8.465   7.827   6.024
   12    HB2  ARG   3          2HB       ARG   3  11.286   7.745   5.006
   13    HB3  ARG   3          3HB       ARG   3   9.792   7.990   4.111
   14    HG2  ARG   3          2HG       ARG   3  10.042  10.115   5.966
   15    HG3  ARG   3          3HG       ARG   3  11.588   9.929   5.135
   16    HD2  ARG   3          2HD       ARG   3  10.692  10.409   3.073
   17    HD3  ARG   3          3HD       ARG   3   9.075   9.876   3.536
   18    HE   ARG   3           HE       ARG   3  10.110  12.510   3.724
   19   HH11  ARG   3          1HH1      ARG   3   8.022  10.242   5.340
   20   HH12  ARG   3          2HH1      ARG   3   7.047  11.468   6.080
   21   HH21  ARG   3          1HH2      ARG   3   8.834  14.133   4.692
   22   HH22  ARG   3          2HH2      ARG   3   7.509  13.680   5.710
   23    H    THR   4           HN       THR   4   8.166   5.982   7.526
   24    HA   THR   4           HA       THR   4   9.902   3.721   6.771
   25    HB   THR   4           HB       THR   4   8.378   3.278   9.208
   26    HG1  THR   4          1HG       THR   4   8.690   5.363   9.781
   27   HG21  THR   4          1HG2      THR   4  10.274   1.905   8.387
   28   HG22  THR   4          2HG2      THR   4  10.516   2.499  10.029
   29   HG23  THR   4          3HG2      THR   4  11.350   3.270   8.680
   30    H    CYS   5           HN       CYS   5   8.926   1.745   6.318
   31    HA   CYS   5           HA       CYS   5   6.502   1.771   4.981
   32    HB2  CYS   5          2HB       CYS   5   8.271   0.014   4.783
   33    HB3  CYS   5          3HB       CYS   5   7.741  -0.634   6.332
   34    H    ALA   6           HN       ALA   6   4.418   1.066   5.476
   35    HA   ALA   6           HA       ALA   6   3.695   1.376   8.283
   36    HB1  ALA   6          1HB       ALA   6   1.853   2.337   7.500
   37    HB2  ALA   6          2HB       ALA   6   2.503   2.146   5.872
   38    HB3  ALA   6          3HB       ALA   6   1.449   0.905   6.552
   39    H    ARG   7           HN       ARG   7   4.787  -1.125   6.660
   40    HA   ARG   7           HA       ARG   7   2.955  -3.022   7.969
   41    HB2  ARG   7          2HB       ARG   7   4.421  -3.707   5.438
   42    HB3  ARG   7          3HB       ARG   7   3.018  -4.494   6.145
   43    HG2  ARG   7          2HG       ARG   7   3.086  -1.800   4.806
   44    HG3  ARG   7          3HG       ARG   7   2.362  -3.281   4.176
   45    HD2  ARG   7          2HD       ARG   7   1.356  -1.381   6.187
   46    HD3  ARG   7          3HD       ARG   7   0.476  -2.397   5.045
   47    HE   ARG   7           HE       ARG   7   1.006  -2.980   7.766
   48   HH11  ARG   7          1HH1      ARG   7   0.785  -4.471   4.627
   49   HH12  ARG   7          2HH1      ARG   7   0.339  -6.024   5.253
   50   HH21  ARG   7          1HH2      ARG   7   0.421  -5.019   8.602
   51   HH22  ARG   7          2HH2      ARG   7   0.132  -6.335   7.514
   52    H    CYS   8           HN       CYS   8   6.229  -2.482   6.719
   53    HA   CYS   8           HA       CYS   8   7.236  -4.588   8.494
   54    HB2  CYS   8          2HB       CYS   8   8.867  -3.093   6.452
   55    HB3  CYS   8          3HB       CYS   8   9.175  -4.678   7.153
   56    H    GLN   9           HN       GLN   9   7.129  -1.172   8.082
   57    HA   GLN   9           HA       GLN   9   7.839   0.550   9.390
   58    HB2  GLN   9          2HB       GLN   9   7.867  -1.759  11.181
   59    HB3  GLN   9          3HB       GLN   9   9.026  -0.521  11.643
   60    HG2  GLN   9          2HG       GLN   9   7.430   0.785  12.448
   61    HG3  GLN   9          3HG       GLN   9   6.482   0.650  10.967
   62   HE21  GLN   9          1HE2      GLN   9   5.164  -1.304  10.733
   63   HE22  GLN   9          2HE2      GLN   9   4.451  -1.993  12.147
   64    H    GLU  10           HN       GLU  10   9.587  -0.754   7.446
   65    HA   GLU  10           HA       GLU  10  12.233  -0.290   8.635
   66    HB2  GLU  10          2HB       GLU  10  11.222  -1.975   6.416
   67    HB3  GLU  10          3HB       GLU  10  12.806  -1.247   6.182
   68    HG2  GLU  10          2HG       GLU  10  13.616  -2.275   8.215
   69    HG3  GLU  10          3HG       GLU  10  12.017  -2.943   8.540
   70    H    SER  11           HN       SER  11  13.620   1.237   7.844
   71    HA   SER  11           HA       SER  11  12.701   3.605   6.848
   72    HB2  SER  11          2HB       SER  11  14.992   3.169   7.789
   73    HB3  SER  11          3HB       SER  11  15.444   2.490   6.225
   74    HG   SER  11           HG       SER  11  16.034   4.633   6.228
   75    H    LEU  12           HN       LEU  12  12.422   4.553   4.864
   76    HA   LEU  12           HA       LEU  12  12.063   2.725   2.634
   77    HB2  LEU  12          2HB       LEU  12  11.258   5.543   3.215
   78    HB3  LEU  12          3HB       LEU  12  11.236   4.948   1.556
   79    HG   LEU  12           HG       LEU  12   9.077   4.896   3.044
   80   HD11  LEU  12          1HD1      LEU  12   8.909   4.117   0.862
   81   HD12  LEU  12          2HD1      LEU  12   8.459   2.712   1.830
   82   HD13  LEU  12          3HD1      LEU  12  10.074   2.820   1.129
   83   HD21  LEU  12          1HD2      LEU  12  10.126   2.167   3.691
   84   HD22  LEU  12          2HD2      LEU  12   8.758   3.032   4.391
   85   HD23  LEU  12          3HD2      LEU  12  10.408   3.523   4.783
   86    H    GLY  13           HN       GLY  13  14.766   3.521   3.590
   87    HA2  GLY  13          1HA       GLY  13  16.004   5.368   1.911
   88    HA3  GLY  13          2HA       GLY  13  16.806   3.989   2.648
   89    H    ARG  14           HN       ARG  14  17.205   5.178   0.004
   90    HA   ARG  14           HA       ARG  14  17.264   4.624  -2.228
   91    HB2  ARG  14          2HB       ARG  14  18.343   2.449  -0.591
   92    HB3  ARG  14          3HB       ARG  14  17.871   1.937  -2.206
   93    HG2  ARG  14          2HG       ARG  14  19.737   2.781  -3.034
   94    HG3  ARG  14          3HG       ARG  14  19.303   4.380  -2.428
   95    HD2  ARG  14          2HD       ARG  14  20.358   2.474  -0.437
   96    HD3  ARG  14          3HD       ARG  14  21.502   3.030  -1.657
   97    HE   ARG  14           HE       ARG  14  20.057   5.195  -0.504
   98   HH11  ARG  14          1HH1      ARG  14  22.699   2.995   0.043
   99   HH12  ARG  14          2HH1      ARG  14  23.545   4.070   1.107
  100   HH21  ARG  14          1HH2      ARG  14  21.161   6.619   0.894
  101   HH22  ARG  14          2HH2      ARG  14  22.669   6.131   1.592
  102    H    LEU  15           HN       LEU  15  14.615   4.327  -0.958
  103    HA   LEU  15           HA       LEU  15  13.492   2.257  -2.730
  104    HB2  LEU  15          2HB       LEU  15  13.206   2.548   0.024
  105    HB3  LEU  15          3HB       LEU  15  11.694   3.152  -0.651
  106    HG   LEU  15           HG       LEU  15  12.708   0.512  -1.585
  107   HD11  LEU  15          1HD1      LEU  15  11.366   0.979   1.073
  108   HD12  LEU  15          2HD1      LEU  15  12.985   0.332   0.808
  109   HD13  LEU  15          3HD1      LEU  15  11.572  -0.593   0.301
  110   HD21  LEU  15          1HD2      LEU  15   9.923   1.436  -0.913
  111   HD22  LEU  15          2HD2      LEU  15  10.402   0.045  -1.886
  112   HD23  LEU  15          3HD2      LEU  15  10.670   1.680  -2.493
  113    H    SER  16           HN       SER  16  13.754   5.550  -2.170
  114    HA   SER  16           HA       SER  16  12.758   7.393  -3.058
  115    HB2  SER  16          2HB       SER  16  12.326   5.260  -5.035
  116    HB3  SER  16          3HB       SER  16  11.184   6.597  -5.159
  117    HG   SER  16           HG       SER  16  14.016   6.818  -5.136
  118    HA   PRO  17           HA       PRO  17   8.836   6.388  -0.791
  119    HB2  PRO  17          2HB       PRO  17   9.104   8.387   1.026
  120    HB3  PRO  17          3HB       PRO  17   9.830   6.790   1.242
  121    HG2  PRO  17          2HG       PRO  17  11.090   9.326   0.272
  122    HG3  PRO  17          3HG       PRO  17  11.728   8.122   1.407
  123    HD2  PRO  17          2HD       PRO  17  12.481   8.218  -1.193
  124    HD3  PRO  17          3HD       PRO  17  12.388   6.698  -0.282
  125    H    LYS  18           HN       LYS  18  10.014   8.767  -2.780
  126    HA   LYS  18           HA       LYS  18   8.335  10.947  -2.473
  127    HB2  LYS  18          2HB       LYS  18   9.935  11.348  -4.064
  128    HB3  LYS  18          3HB       LYS  18   9.805   9.737  -4.758
  129    HG2  LYS  18          2HG       LYS  18   8.214  10.351  -6.228
  130    HG3  LYS  18          3HG       LYS  18   7.448  11.471  -5.098
  131    HD2  LYS  18          2HD       LYS  18   8.326  12.896  -6.700
  132    HD3  LYS  18          3HD       LYS  18   9.581  12.901  -5.459
  133    HE2  LYS  18          2HE       LYS  18  10.837  11.226  -6.723
  134    HE3  LYS  18          3HE       LYS  18   9.579  11.211  -7.959
  135    HZ1  LYS  18          1HZ       LYS  18  10.204  13.239  -8.754
  136    HZ2  LYS  18          2HZ       LYS  18  11.709  12.677  -8.227
  137    HZ3  LYS  18          3HZ       LYS  18  10.835  13.770  -7.277
  138    H    THR  19           HN       THR  19   7.748   7.897  -4.162
  139    HA   THR  19           HA       THR  19   4.880   8.521  -4.142
  140    HB   THR  19           HB       THR  19   5.366   8.980  -6.395
  141    HG1  THR  19          1HG       THR  19   3.951   7.609  -7.181
  142   HG21  THR  19          1HG2      THR  19   7.360   8.345  -7.181
  143   HG22  THR  19          2HG2      THR  19   6.629   6.776  -7.517
  144   HG23  THR  19          3HG2      THR  19   7.487   7.042  -6.000
  145    H    ASN  20           HN       ASN  20   5.471   7.062  -2.181
  146    HA   ASN  20           HA       ASN  20   4.895   4.300  -2.990
  147    HB2  ASN  20          2HB       ASN  20   6.918   5.129  -0.896
  148    HB3  ASN  20          3HB       ASN  20   6.394   3.474  -1.191
  149   HD21  ASN  20          1HD2      ASN  20   9.043   4.250  -1.334
  150   HD22  ASN  20          2HD2      ASN  20   9.580   4.121  -2.971
  151    H    THR  21           HN       THR  21   3.592   6.811  -1.653
  152    HA   THR  21           HA       THR  21   2.685   5.659   0.859
  153    HB   THR  21           HB       THR  21   1.903   8.273  -0.448
  154    HG1  THR  21          1HG       THR  21   3.627   7.917   1.780
  155   HG21  THR  21          1HG2      THR  21   1.003   8.880   1.717
  156   HG22  THR  21          2HG2      THR  21   1.509   7.333   2.395
  157   HG23  THR  21          3HG2      THR  21   0.246   7.386   1.166
  158    H    CYS  22           HN       CYS  22   1.201   4.098   0.666
  159    HA   CYS  22           HA       CYS  22  -0.475   3.488  -1.374
  160    HB2  CYS  22          2HB       CYS  22  -0.179   2.191   0.757
  161    HB3  CYS  22          3HB       CYS  22  -1.295   3.313   1.530
  162    H    ARG  23           HN       ARG  23  -2.296   4.253  -2.274
  163    HA   ARG  23           HA       ARG  23  -3.265   6.835  -1.408
  164    HB2  ARG  23          2HB       ARG  23  -4.738   5.508  -3.564
  165    HB3  ARG  23          3HB       ARG  23  -3.979   7.093  -3.529
  166    HG2  ARG  23          2HG       ARG  23  -1.770   5.903  -3.821
  167    HG3  ARG  23          3HG       ARG  23  -2.709   4.446  -4.160
  168    HD2  ARG  23          2HD       ARG  23  -2.758   7.047  -5.684
  169    HD3  ARG  23          3HD       ARG  23  -2.124   5.498  -6.240
  170    HE   ARG  23           HE       ARG  23  -4.773   5.058  -5.614
  171   HH11  ARG  23          1HH1      ARG  23  -2.981   7.085  -7.806
  172   HH12  ARG  23          2HH1      ARG  23  -4.234   7.123  -9.002
  173   HH21  ARG  23          1HH2      ARG  23  -6.430   5.101  -7.182
  174   HH22  ARG  23          2HH2      ARG  23  -6.196   5.995  -8.645
  175    H    GLY  24           HN       GLY  24  -3.908   3.777  -0.443
  176    HA2  GLY  24          1HA       GLY  24  -6.804   4.123  -0.193
  177    HA3  GLY  24          2HA       GLY  24  -5.900   2.663   0.176
  178    H    CYS  25           HN       CYS  25  -3.942   3.725   1.862
  179    HA   CYS  25           HA       CYS  25  -5.588   4.524   4.170
  180    HB2  CYS  25          2HB       CYS  25  -3.627   3.529   5.499
  181    HB3  CYS  25          3HB       CYS  25  -4.700   2.406   4.670
  182    H    ASN  26           HN       ASN  26  -2.999   5.414   2.127
  183    HA   ASN  26           HA       ASN  26  -1.873   7.406   1.979
  184    HB2  ASN  26          2HB       ASN  26  -2.844   8.252   4.689
  185    HB3  ASN  26          3HB       ASN  26  -2.463   9.246   3.287
  186   HD21  ASN  26          1HD2      ASN  26  -4.788   9.586   4.706
  187   HD22  ASN  26          2HD2      ASN  26  -6.132   9.108   3.731
  188    H    HIS  27           HN       HIS  27  -0.982   4.927   3.344
  189    HA   HIS  27           HA       HIS  27   1.110   6.081   5.068
  190    HB2  HIS  27          2HB       HIS  27   0.019   3.258   5.051
  191    HB3  HIS  27          3HB       HIS  27   1.304   3.851   6.100
  192    HD1  HIS  27          1HD       HIS  27   0.110   6.448   7.116
  193    HD2  HIS  27          2HD       HIS  27  -2.066   2.928   6.748
  194    HE1  HIS  27          1HE       HIS  27  -1.823   6.682   8.708
  195    H    LEU  28           HN       LEU  28   3.233   5.067   4.948
  196    HA   LEU  28           HA       LEU  28   4.054   4.703   2.233
  197    HB2  LEU  28          2HB       LEU  28   5.384   4.858   4.880
  198    HB3  LEU  28          3HB       LEU  28   6.265   4.069   3.573
  199    HG   LEU  28           HG       LEU  28   5.201   6.892   3.484
  200   HD11  LEU  28          1HD1      LEU  28   7.910   7.072   3.388
  201   HD12  LEU  28          2HD1      LEU  28   7.687   5.743   4.526
  202   HD13  LEU  28          3HD1      LEU  28   6.936   7.307   4.839
  203   HD21  LEU  28          1HD2      LEU  28   6.517   5.105   1.529
  204   HD22  LEU  28          2HD2      LEU  28   7.075   6.778   1.580
  205   HD23  LEU  28          3HD2      LEU  28   5.373   6.423   1.275
  206    H    VAL  29           HN       VAL  29   5.043   2.873   1.309
  207    HA   VAL  29           HA       VAL  29   4.993   0.352   2.734
  208    HB   VAL  29           HB       VAL  29   3.657  -0.081   0.214
  209   HG11  VAL  29          1HG1      VAL  29   2.644  -1.697   1.397
  210   HG12  VAL  29          2HG1      VAL  29   3.830  -1.299   2.640
  211   HG13  VAL  29          3HG1      VAL  29   2.211  -0.603   2.710
  212   HG21  VAL  29          1HG2      VAL  29   2.723   2.122   0.484
  213   HG22  VAL  29          2HG2      VAL  29   1.480   0.924   0.848
  214   HG23  VAL  29          3HG2      VAL  29   2.294   1.777   2.160
  215    H    CYS  30           HN       CYS  30   6.837  -0.611   2.232
  216    HA   CYS  30           HA       CYS  30   8.631   0.178   0.296
  217    HB2  CYS  30          2HB       CYS  30   9.721  -2.016   0.615
  218    HB3  CYS  30          3HB       CYS  30   9.266  -1.272   2.146
  219    H    ARG  31           HN       ARG  31   9.465  -1.665  -1.365
  220    HA   ARG  31           HA       ARG  31   7.350  -1.807  -3.342
  221    HB2  ARG  31          2HB       ARG  31   9.185  -2.637  -4.832
  222    HB3  ARG  31          3HB       ARG  31   9.479  -1.050  -4.134
  223    HG2  ARG  31          2HG       ARG  31  11.259  -1.751  -2.953
  224    HG3  ARG  31          3HG       ARG  31  10.540  -3.323  -2.600
  225    HD2  ARG  31          2HD       ARG  31  10.965  -3.926  -5.012
  226    HD3  ARG  31          3HD       ARG  31  11.916  -2.446  -5.128
  227    HE   ARG  31           HE       ARG  31  13.016  -3.693  -3.007
  228   HH11  ARG  31          1HH1      ARG  31  12.264  -4.740  -6.242
  229   HH12  ARG  31          2HH1      ARG  31  13.563  -5.885  -6.313
  230   HH21  ARG  31          1HH2      ARG  31  14.729  -5.197  -3.089
  231   HH22  ARG  31          2HH2      ARG  31  14.964  -6.143  -4.518
  232    H    ASP  32           HN       ASP  32   7.668  -3.608  -0.848
  233    HA   ASP  32           HA       ASP  32   7.307  -6.154  -2.287
  234    HB2  ASP  32          2HB       ASP  32   9.395  -6.012  -0.864
  235    HB3  ASP  32          3HB       ASP  32   8.339  -5.894   0.539
  236    H    CYS  33           HN       CYS  33   5.969  -3.829  -0.220
  237    HA   CYS  33           HA       CYS  33   3.926  -5.684   0.778
  238    HB2  CYS  33          2HB       CYS  33   4.700  -2.887   1.609
  239    HB3  CYS  33          3HB       CYS  33   3.260  -3.700   2.213
  240    H    ARG  34           HN       ARG  34   4.328  -4.142  -1.940
  241    HA   ARG  34           HA       ARG  34   1.698  -2.859  -2.068
  242    HB2  ARG  34          2HB       ARG  34   3.509  -2.897  -4.425
  243    HB3  ARG  34          3HB       ARG  34   2.463  -1.614  -3.830
  244    HG2  ARG  34          2HG       ARG  34   4.029  -1.046  -2.112
  245    HG3  ARG  34          3HG       ARG  34   5.032  -2.443  -2.503
  246    HD2  ARG  34          2HD       ARG  34   5.697  -1.516  -4.564
  247    HD3  ARG  34          3HD       ARG  34   4.428  -0.293  -4.512
  248    HE   ARG  34           HE       ARG  34   5.991   0.188  -2.309
  249   HH11  ARG  34          1HH1      ARG  34   6.497   0.015  -5.748
  250   HH12  ARG  34          2HH1      ARG  34   7.798   1.161  -5.746
  251   HH21  ARG  34          1HH2      ARG  34   7.701   1.697  -2.292
  252   HH22  ARG  34          2HH2      ARG  34   8.482   2.116  -3.779
  253    H    ILE  35           HN       ILE  35   0.047  -3.627  -3.288
  254    HA   ILE  35           HA       ILE  35   0.478  -6.232  -4.591
  255    HB   ILE  35           HB       ILE  35  -1.827  -5.086  -3.088
  256   HG12  ILE  35          2HG1      ILE  35  -1.933  -7.555  -2.398
  257   HG13  ILE  35          3HG1      ILE  35  -0.401  -7.738  -3.245
  258   HG21  ILE  35          1HG2      ILE  35  -2.036  -6.922  -5.446
  259   HG22  ILE  35          2HG2      ILE  35  -3.208  -6.992  -4.131
  260   HG23  ILE  35          3HG2      ILE  35  -3.005  -5.503  -5.053
  261   HD11  ILE  35          1HD1      ILE  35  -0.457  -7.285  -0.682
  262   HD12  ILE  35          2HD1      ILE  35   0.752  -6.500  -1.699
  263   HD13  ILE  35          3HD1      ILE  35  -0.679  -5.609  -1.183
  264    H    GLN  36           HN       GLN  36   0.766  -5.932  -6.710
  265    HA   GLN  36           HA       GLN  36   0.011  -3.797  -8.265
  266    HB2  GLN  36          2HB       GLN  36   0.430  -6.695  -8.959
  267    HB3  GLN  36          3HB       GLN  36   0.050  -5.498 -10.189
  268    HG2  GLN  36          2HG       GLN  36   2.440  -5.896 -10.055
  269    HG3  GLN  36          3HG       GLN  36   2.044  -4.238  -9.605
  270   HE21  GLN  36          1HE2      GLN  36   1.852  -3.812  -7.266
  271   HE22  GLN  36          2HE2      GLN  36   2.929  -4.637  -6.197
  272    H    GLU  37           HN       GLU  37  -1.964  -2.954  -8.413
  273    HA   GLU  37           HA       GLU  37  -4.339  -4.556  -8.198
  274    HB2  GLU  37          2HB       GLU  37  -3.935  -1.633  -8.847
  275    HB3  GLU  37          3HB       GLU  37  -5.509  -2.388  -8.646
  276    HG2  GLU  37          2HG       GLU  37  -3.493  -2.634  -6.469
  277    HG3  GLU  37          3HG       GLU  37  -4.372  -1.119  -6.670
  278    H    SER  38           HN       SER  38  -2.229  -4.158 -10.658
  279    HA   SER  38           HA       SER  38  -2.321  -4.247 -12.945
  280    HB2  SER  38          2HB       SER  38  -4.319  -6.224 -11.930
  281    HB3  SER  38          3HB       SER  38  -4.223  -5.944 -13.668
  282    HG   SER  38           HG       SER  38  -1.850  -6.283 -13.294
  283    H    ASN  39           HN       ASN  39  -3.022  -1.962 -12.976
  284    HA   ASN  39           HA       ASN  39  -5.162  -1.584 -14.768
  285    HB2  ASN  39          2HB       ASN  39  -6.441  -1.972 -12.628
  286    HB3  ASN  39          3HB       ASN  39  -5.712  -0.496 -12.002
  287   HD21  ASN  39          1HD2      ASN  39  -6.668   1.376 -12.425
  288   HD22  ASN  39          2HD2      ASN  39  -7.962   1.608 -13.546
  289    H    GLY  40           HN       GLY  40  -2.947  -0.239 -12.411
  290    HA2  GLY  40          1HA       GLY  40  -1.531   1.459 -13.890
  291    HA3  GLY  40          2HA       GLY  40  -3.009   2.385 -13.677
  292    H    THR  41           HN       THR  41  -3.146   0.896 -10.944
  293    HA   THR  41           HA       THR  41  -1.206   2.621  -9.550
  294    HB   THR  41           HB       THR  41  -3.600   3.451  -9.433
  295    HG1  THR  41          1HG       THR  41  -3.322   3.311  -6.881
  296   HG21  THR  41          1HG2      THR  41  -4.794   1.380  -9.239
  297   HG22  THR  41          2HG2      THR  41  -5.026   2.282  -7.740
  298   HG23  THR  41          3HG2      THR  41  -3.888   0.936  -7.793
  299    H    TRP  42           HN       TRP  42  -1.932   1.775  -6.951
  300    HA   TRP  42           HA       TRP  42  -1.760  -1.092  -6.807
  301    HB2  TRP  42          2HB       TRP  42   0.434  -1.170  -5.699
  302    HB3  TRP  42          3HB       TRP  42   0.568  -0.563  -7.347
  303    HD1  TRP  42          1HD       TRP  42   1.543   1.840  -7.678
  304    HE1  TRP  42          1HE       TRP  42   2.537   3.597  -6.080
  305    HE3  TRP  42          3HE       TRP  42   0.153  -0.241  -3.219
  306    HZ2  TRP  42          2HZ       TRP  42   2.708   4.042  -3.298
  307    HZ3  TRP  42          3HZ       TRP  42   0.771   0.914  -1.136
  308    HH2  TRP  42          2HH       TRP  42   2.024   3.010  -1.177
  309    H    ARG  43           HN       ARG  43  -1.717  -1.871  -4.571
  310    HA   ARG  43           HA       ARG  43  -2.317   0.121  -2.525
  311    HB2  ARG  43          2HB       ARG  43  -4.234  -1.964  -3.521
  312    HB3  ARG  43          3HB       ARG  43  -4.310  -1.409  -1.853
  313    HG2  ARG  43          2HG       ARG  43  -4.252   0.665  -3.964
  314    HG3  ARG  43          3HG       ARG  43  -5.725  -0.295  -3.804
  315    HD2  ARG  43          2HD       ARG  43  -5.016   0.377  -1.195
  316    HD3  ARG  43          3HD       ARG  43  -4.721   1.840  -2.136
  317    HE   ARG  43           HE       ARG  43  -6.974   2.126  -2.146
  318   HH11  ARG  43          1HH1      ARG  43  -6.317  -1.291  -2.024
  319   HH12  ARG  43          2HH1      ARG  43  -7.990  -1.744  -2.007
  320   HH21  ARG  43          1HH2      ARG  43  -9.179   1.542  -2.124
  321   HH22  ARG  43          2HH2      ARG  43  -9.617  -0.132  -2.064
  322    H    CYS  44           HN       CYS  44  -1.539  -0.431  -0.575
  323    HA   CYS  44           HA       CYS  44   0.302  -2.401  -0.172
  324    HB2  CYS  44          2HB       CYS  44   0.071  -2.032   2.189
  325    HB3  CYS  44          3HB       CYS  44  -0.200  -0.494   1.376
  326    H    LYS  45           HN       LYS  45   0.093  -4.238   1.494
  327    HA   LYS  45           HA       LYS  45  -1.754  -6.145   0.428
  328    HB2  LYS  45          2HB       LYS  45  -0.354  -6.789   2.951
  329    HB3  LYS  45          3HB       LYS  45  -0.475  -7.714   1.459
  330    HG2  LYS  45          2HG       LYS  45   1.121  -5.913   0.504
  331    HG3  LYS  45          3HG       LYS  45   1.465  -5.569   2.200
  332    HD2  LYS  45          2HD       LYS  45   3.054  -7.156   1.858
  333    HD3  LYS  45          3HD       LYS  45   1.711  -8.227   2.259
  334    HE2  LYS  45          2HE       LYS  45   1.222  -8.435  -0.163
  335    HE3  LYS  45          3HE       LYS  45   2.655  -7.466  -0.503
  336    HZ1  LYS  45          1HZ       LYS  45   4.004  -9.189  -0.115
  337    HZ2  LYS  45          2HZ       LYS  45   2.629 -10.146  -0.338
  338    HZ3  LYS  45          3HZ       LYS  45   3.125  -9.730   1.225
  339    H    VAL  46           HN       VAL  46  -2.023  -3.782   2.786
  340    HA   VAL  46           HA       VAL  46  -3.941  -5.250   4.423
  341    HB   VAL  46           HB       VAL  46  -3.208  -2.344   4.720
  342   HG11  VAL  46          1HG1      VAL  46  -5.102  -2.895   6.015
  343   HG12  VAL  46          2HG1      VAL  46  -4.399  -4.428   6.532
  344   HG13  VAL  46          3HG1      VAL  46  -3.739  -2.905   7.132
  345   HG21  VAL  46          1HG2      VAL  46  -1.785  -4.749   5.853
  346   HG22  VAL  46          2HG2      VAL  46  -1.127  -3.565   4.725
  347   HG23  VAL  46          3HG2      VAL  46  -1.521  -3.086   6.376
  348    H    CYS  47           HN       CYS  47  -3.866  -3.063   1.777
  349    HA   CYS  47           HA       CYS  47  -6.686  -2.348   2.138
  350    HB2  CYS  47          2HB       CYS  47  -4.481  -1.252   0.408
  351    HB3  CYS  47          3HB       CYS  47  -6.169  -0.871   0.084
  352    H    ALA  48           HN       ALA  48  -4.482  -3.823  -0.212
  353    HA   ALA  48           HA       ALA  48  -6.467  -4.417  -2.144
  354    HB1  ALA  48          1HB       ALA  48  -4.177  -6.229  -2.104
  355    HB2  ALA  48          2HB       ALA  48  -4.750  -5.149  -3.376
  356    HB3  ALA  48          3HB       ALA  48  -3.733  -4.522  -2.078
  357    H    LYS  49           HN       LYS  49  -5.472  -5.958   0.788
  358    HA   LYS  49           HA       LYS  49  -6.211  -8.595   0.357
  359    HB2  LYS  49          2HB       LYS  49  -5.562  -6.957   2.589
  360    HB3  LYS  49          3HB       LYS  49  -7.031  -7.838   2.988
  361    HG2  LYS  49          2HG       LYS  49  -5.391  -9.749   1.834
  362    HG3  LYS  49          3HG       LYS  49  -4.299  -8.769   2.816
  363    HD2  LYS  49          2HD       LYS  49  -6.472  -9.097   4.465
  364    HD3  LYS  49          3HD       LYS  49  -6.381 -10.648   3.630
  365    HE2  LYS  49          2HE       LYS  49  -4.395 -11.198   4.582
  366    HE3  LYS  49          3HE       LYS  49  -3.835  -9.527   4.637
  367    HZ1  LYS  49          1HZ       LYS  49  -4.192  -9.944   6.838
  368    HZ2  LYS  49          2HZ       LYS  49  -5.486 -10.996   6.564
  369    HZ3  LYS  49          3HZ       LYS  49  -5.709  -9.326   6.419
  370    H    GLU  50           HN       GLU  50  -8.239  -6.038   1.810
  371    HA   GLU  50           HA       GLU  50 -10.543  -6.660   0.343
  372    HB2  GLU  50          2HB       GLU  50 -10.205  -8.721   1.926
  373    HB3  GLU  50          3HB       GLU  50 -10.857  -7.646   3.155
  374    HG2  GLU  50          2HG       GLU  50 -12.876  -7.335   1.831
  375    HG3  GLU  50          3HG       GLU  50 -12.222  -8.388   0.577
  376    H    ILE  51           HN       ILE  51  -9.835  -4.282   0.573
  377    HA   ILE  51           HA       ILE  51 -10.115  -2.719   2.789
  378    HB   ILE  51           HB       ILE  51 -10.049  -2.257   0.017
  379   HG12  ILE  51          2HG1      ILE  51  -8.610  -1.160   1.622
  380   HG13  ILE  51          3HG1      ILE  51  -9.507   0.070   0.738
  381   HG21  ILE  51          1HG2      ILE  51 -11.676  -0.497  -0.330
  382   HG22  ILE  51          2HG2      ILE  51 -12.495  -1.996   0.108
  383   HG23  ILE  51          3HG2      ILE  51 -12.298  -0.718   1.305
  384   HD11  ILE  51          1HD1      ILE  51 -10.974  -0.657   3.070
  385   HD12  ILE  51          2HD1      ILE  51  -9.310  -0.278   3.517
  386   HD13  ILE  51          3HD1      ILE  51 -10.276   0.901   2.631
  387    H    GLU  52           HN       GLU  52 -12.639  -4.319   1.002
  388    HA   GLU  52           HA       GLU  52 -14.518  -4.049   3.084
  389    HB2  GLU  52          2HB       GLU  52 -14.414  -1.846   1.252
  390    HB3  GLU  52          3HB       GLU  52 -15.941  -2.693   1.047
  391    HG2  GLU  52          2HG       GLU  52 -15.826  -2.554   3.735
  392    HG3  GLU  52          3HG       GLU  52 -14.956  -1.084   3.300
  393    H    LEU  53           HN       LEU  53 -16.643  -4.967   2.504
  394    HA   LEU  53           HA       LEU  53 -16.295  -7.073   0.515
  395    HB2  LEU  53          2HB       LEU  53 -18.207  -8.130   1.560
  396    HB3  LEU  53          3HB       LEU  53 -16.995  -7.701   2.766
  397    HG   LEU  53           HG       LEU  53 -18.598  -5.539   2.917
  398   HD11  LEU  53          1HD1      LEU  53 -20.247  -7.791   1.862
  399   HD12  LEU  53          2HD1      LEU  53 -20.324  -6.068   1.490
  400   HD13  LEU  53          3HD1      LEU  53 -20.943  -6.666   3.030
  401   HD21  LEU  53          1HD2      LEU  53 -19.815  -7.156   4.707
  402   HD22  LEU  53          2HD2      LEU  53 -18.232  -6.419   4.956
  403   HD23  LEU  53          3HD2      LEU  53 -18.351  -8.081   4.375
  Start of MODEL    3
    1    H1   SER   1           HN       SER   1   8.117   9.422  11.456
    2    HA   SER   1           HA       SER   1   8.284  11.731   9.672
    3    HB2  SER   1          2HB       SER   1   8.529  12.911  11.560
    4    HB3  SER   1          3HB       SER   1   8.341  11.416  12.477
    5    HG   SER   1           HG       SER   1  10.303  12.455  12.982
    6    H    ASP   2           HN       ASP   2   9.763   8.846   9.867
    7    HA   ASP   2           HA       ASP   2  12.351   9.938   8.976
    8    HB2  ASP   2          2HB       ASP   2  11.723   7.555  10.687
    9    HB3  ASP   2          3HB       ASP   2  13.189   7.575   9.712
   10    H    ARG   3           HN       ARG   3   9.593   8.334   8.052
   11    HA   ARG   3           HA       ARG   3   9.029   7.527   5.972
   12    HB2  ARG   3          2HB       ARG   3  11.917   7.164   5.248
   13    HB3  ARG   3          3HB       ARG   3  10.543   7.479   4.197
   14    HG2  ARG   3          2HG       ARG   3  10.747   9.681   5.937
   15    HG3  ARG   3          3HG       ARG   3  12.378   9.322   5.368
   16    HD2  ARG   3          2HD       ARG   3  11.202   9.149   3.037
   17    HD3  ARG   3          3HD       ARG   3   9.956  10.121   3.818
   18    HE   ARG   3           HE       ARG   3  12.500  11.015   2.919
   19   HH11  ARG   3          1HH1      ARG   3  10.104  11.489   5.400
   20   HH12  ARG   3          2HH1      ARG   3  10.552  13.136   5.701
   21   HH21  ARG   3          1HH2      ARG   3  13.098  13.183   3.306
   22   HH22  ARG   3          2HH2      ARG   3  12.254  14.099   4.508
   23    H    THR   4           HN       THR   4   8.555   5.826   7.701
   24    HA   THR   4           HA       THR   4  10.100   3.380   7.140
   25    HB   THR   4           HB       THR   4   8.369   3.162   9.454
   26    HG1  THR   4          1HG       THR   4  10.207   5.317   9.328
   27   HG21  THR   4          1HG2      THR   4  11.366   2.975   9.123
   28   HG22  THR   4          2HG2      THR   4  10.222   1.645   8.938
   29   HG23  THR   4          3HG2      THR   4  10.443   2.406  10.513
   30    H    CYS   5           HN       CYS   5   9.014   1.487   6.652
   31    HA   CYS   5           HA       CYS   5   6.658   1.671   5.182
   32    HB2  CYS   5          2HB       CYS   5   8.379  -0.179   5.092
   33    HB3  CYS   5          3HB       CYS   5   7.645  -0.832   6.553
   34    H    ALA   6           HN       ALA   6   4.520   1.184   5.594
   35    HA   ALA   6           HA       ALA   6   3.701   1.485   8.364
   36    HB1  ALA   6          1HB       ALA   6   2.531   2.010   5.764
   37    HB2  ALA   6          2HB       ALA   6   1.405   1.196   6.849
   38    HB3  ALA   6          3HB       ALA   6   2.156   2.715   7.336
   39    H    ARG   7           HN       ARG   7   4.603  -1.076   6.577
   40    HA   ARG   7           HA       ARG   7   2.714  -2.879   7.941
   41    HB2  ARG   7          2HB       ARG   7   4.095  -3.568   5.357
   42    HB3  ARG   7          3HB       ARG   7   2.706  -4.352   6.097
   43    HG2  ARG   7          2HG       ARG   7   2.788  -1.657   4.764
   44    HG3  ARG   7          3HG       ARG   7   1.942  -3.107   4.218
   45    HD2  ARG   7          2HD       ARG   7   1.239  -1.185   6.369
   46    HD3  ARG   7          3HD       ARG   7   0.205  -1.985   5.187
   47    HE   ARG   7           HE       ARG   7   0.936  -4.040   6.724
   48   HH11  ARG   7          1HH1      ARG   7  -0.214  -0.859   7.550
   49   HH12  ARG   7          2HH1      ARG   7  -0.965  -1.371   9.025
   50   HH21  ARG   7          1HH2      ARG   7  -0.050  -4.726   8.663
   51   HH22  ARG   7          2HH2      ARG   7  -0.871  -3.570   9.657
   52    H    CYS   8           HN       CYS   8   6.010  -2.300   6.877
   53    HA   CYS   8           HA       CYS   8   6.928  -4.613   8.438
   54    HB2  CYS   8          2HB       CYS   8   8.466  -2.928   6.451
   55    HB3  CYS   8          3HB       CYS   8   9.037  -4.400   7.231
   56    H    GLN   9           HN       GLN   9   6.955  -1.154   8.298
   57    HA   GLN   9           HA       GLN   9   7.696   0.439   9.743
   58    HB2  GLN   9          2HB       GLN   9   7.510  -1.989  11.428
   59    HB3  GLN   9          3HB       GLN   9   8.480  -0.671  12.070
   60    HG2  GLN   9          2HG       GLN   9   6.662   0.409  12.706
   61    HG3  GLN   9          3HG       GLN   9   6.030   0.383  11.061
   62   HE21  GLN   9          1HE2      GLN   9   4.832  -1.518  10.402
   63   HE22  GLN   9          2HE2      GLN   9   3.920  -2.393  11.579
   64    H    GLU  10           HN       GLU  10   9.525  -0.711   7.888
   65    HA   GLU  10           HA       GLU  10  12.056  -0.515   9.383
   66    HB2  GLU  10          2HB       GLU  10  11.162  -2.299   7.241
   67    HB3  GLU  10          3HB       GLU  10  12.722  -1.555   6.920
   68    HG2  GLU  10          2HG       GLU  10  12.718  -2.448   9.610
   69    HG3  GLU  10          3HG       GLU  10  12.118  -3.758   8.593
   70    H    SER  11           HN       SER  11  13.801   0.630   8.386
   71    HA   SER  11           HA       SER  11  13.164   3.139   7.419
   72    HB2  SER  11          2HB       SER  11  15.322   3.000   8.261
   73    HB3  SER  11          3HB       SER  11  15.674   1.503   7.399
   74    HG   SER  11           HG       SER  11  16.497   3.773   6.664
   75    H    LEU  12           HN       LEU  12  12.953   4.069   5.435
   76    HA   LEU  12           HA       LEU  12  12.484   2.255   3.209
   77    HB2  LEU  12          2HB       LEU  12  11.843   5.121   3.769
   78    HB3  LEU  12          3HB       LEU  12  11.787   4.509   2.117
   79    HG   LEU  12           HG       LEU  12   9.681   4.554   3.829
   80   HD11  LEU  12          1HD1      LEU  12   8.537   3.405   2.178
   81   HD12  LEU  12          2HD1      LEU  12   9.910   2.363   1.805
   82   HD13  LEU  12          3HD1      LEU  12   9.923   4.054   1.303
   83   HD21  LEU  12          1HD2      LEU  12  10.670   1.710   3.876
   84   HD22  LEU  12          2HD2      LEU  12   9.235   2.370   4.660
   85   HD23  LEU  12          3HD2      LEU  12  10.840   2.825   5.231
   86    H    GLY  13           HN       GLY  13  14.643   4.871   4.139
   87    HA2  GLY  13          1HA       GLY  13  16.472   5.793   3.073
   88    HA3  GLY  13          2HA       GLY  13  16.844   4.109   2.737
   89    H    ARG  14           HN       ARG  14  17.371   3.847   0.680
   90    HA   ARG  14           HA       ARG  14  16.440   5.665  -1.352
   91    HB2  ARG  14          2HB       ARG  14  18.554   3.704  -1.067
   92    HB3  ARG  14          3HB       ARG  14  17.726   3.525  -2.607
   93    HG2  ARG  14          2HG       ARG  14  18.065   6.201  -2.543
   94    HG3  ARG  14          3HG       ARG  14  19.485   5.668  -1.642
   95    HD2  ARG  14          2HD       ARG  14  19.535   3.932  -3.708
   96    HD3  ARG  14          3HD       ARG  14  18.804   5.333  -4.489
   97    HE   ARG  14           HE       ARG  14  21.520   5.032  -3.792
   98   HH11  ARG  14          1HH1      ARG  14  18.964   7.396  -3.808
   99   HH12  ARG  14          2HH1      ARG  14  20.036   8.747  -3.966
  100   HH21  ARG  14          1HH2      ARG  14  22.943   6.803  -4.000
  101   HH22  ARG  14          2HH2      ARG  14  22.299   8.409  -4.076
  102    H    LEU  15           HN       LEU  15  14.144   5.126  -1.042
  103    HA   LEU  15           HA       LEU  15  13.402   2.766  -2.637
  104    HB2  LEU  15          2HB       LEU  15  12.757   3.307   0.065
  105    HB3  LEU  15          3HB       LEU  15  11.279   3.498  -0.877
  106    HG   LEU  15           HG       LEU  15  12.901   1.039  -1.299
  107   HD11  LEU  15          1HD1      LEU  15  12.202   1.802   1.281
  108   HD12  LEU  15          2HD1      LEU  15  12.633   0.182   0.733
  109   HD13  LEU  15          3HD1      LEU  15  10.940   0.672   0.789
  110   HD21  LEU  15          1HD2      LEU  15  10.960   0.180  -2.100
  111   HD22  LEU  15          2HD2      LEU  15  10.618   1.887  -2.380
  112   HD23  LEU  15          3HD2      LEU  15   9.959   1.077  -0.958
  113    H    SER  16           HN       SER  16  12.816   6.097  -1.797
  114    HA   SER  16           HA       SER  16  11.924   7.766  -3.106
  115    HB2  SER  16          2HB       SER  16  12.350   5.913  -5.007
  116    HB3  SER  16          3HB       SER  16  10.588   5.923  -5.016
  117    HG   SER  16           HG       SER  16  12.252   7.687  -6.107
  118    HA   PRO  17           HA       PRO  17   8.048   6.729  -0.832
  119    HB2  PRO  17          2HB       PRO  17   8.010   9.043   0.588
  120    HB3  PRO  17          3HB       PRO  17   8.919   7.615   1.100
  121    HG2  PRO  17          2HG       PRO  17   9.887  10.073  -0.309
  122    HG3  PRO  17          3HG       PRO  17  10.633   9.187   1.033
  123    HD2  PRO  17          2HD       PRO  17  11.451   8.904  -1.532
  124    HD3  PRO  17          3HD       PRO  17  11.517   7.575  -0.358
  125    H    LYS  18           HN       LYS  18   9.058   9.050  -3.073
  126    HA   LYS  18           HA       LYS  18   6.781  10.737  -3.141
  127    HB2  LYS  18          2HB       LYS  18   8.991  11.295  -4.150
  128    HB3  LYS  18          3HB       LYS  18   8.691  10.088  -5.393
  129    HG2  LYS  18          2HG       LYS  18   8.220  12.414  -6.105
  130    HG3  LYS  18          3HG       LYS  18   6.835  11.329  -6.246
  131    HD2  LYS  18          2HD       LYS  18   5.810  12.238  -4.312
  132    HD3  LYS  18          3HD       LYS  18   7.281  13.100  -3.853
  133    HE2  LYS  18          2HE       LYS  18   7.066  14.551  -5.783
  134    HE3  LYS  18          3HE       LYS  18   5.653  13.650  -6.332
  135    HZ1  LYS  18          1HZ       LYS  18   4.343  14.810  -4.990
  136    HZ2  LYS  18          2HZ       LYS  18   5.644  15.852  -4.709
  137    HZ3  LYS  18          3HZ       LYS  18   5.346  14.567  -3.650
  138    H    THR  19           HN       THR  19   7.086   7.509  -3.855
  139    HA   THR  19           HA       THR  19   4.531   7.499  -5.241
  140    HB   THR  19           HB       THR  19   5.184   6.691  -7.235
  141    HG1  THR  19          1HG       THR  19   7.500   5.356  -6.607
  142   HG21  THR  19          1HG2      THR  19   7.505   7.305  -7.910
  143   HG22  THR  19          2HG2      THR  19   7.852   7.676  -6.221
  144   HG23  THR  19          3HG2      THR  19   6.636   8.606  -7.097
  145    H    ASN  20           HN       ASN  20   6.045   6.534  -2.706
  146    HA   ASN  20           HA       ASN  20   5.115   3.740  -2.822
  147    HB2  ASN  20          2HB       ASN  20   7.152   4.873  -0.896
  148    HB3  ASN  20          3HB       ASN  20   6.751   3.177  -1.153
  149   HD21  ASN  20          1HD2      ASN  20   9.284   3.608  -1.297
  150   HD22  ASN  20          2HD2      ASN  20   9.871   3.682  -2.921
  151    H    THR  21           HN       THR  21   3.571   6.195  -2.211
  152    HA   THR  21           HA       THR  21   2.853   5.654   0.593
  153    HB   THR  21           HB       THR  21   2.248   8.093  -1.091
  154    HG1  THR  21          1HG       THR  21   3.738   9.087   0.344
  155   HG21  THR  21          1HG2      THR  21   1.468   9.056   1.073
  156   HG22  THR  21          2HG2      THR  21   1.605   7.450   1.788
  157   HG23  THR  21          3HG2      THR  21   0.458   7.737   0.480
  158    H    CYS  22           HN       CYS  22   1.320   4.113   0.589
  159    HA   CYS  22           HA       CYS  22  -0.459   3.365  -1.307
  160    HB2  CYS  22          2HB       CYS  22  -0.174   2.274   0.913
  161    HB3  CYS  22          3HB       CYS  22  -1.129   3.564   1.636
  162    H    ARG  23           HN       ARG  23  -2.216   4.156  -2.284
  163    HA   ARG  23           HA       ARG  23  -3.042   6.854  -1.701
  164    HB2  ARG  23          2HB       ARG  23  -4.650   5.307  -3.617
  165    HB3  ARG  23          3HB       ARG  23  -3.879   6.877  -3.801
  166    HG2  ARG  23          2HG       ARG  23  -1.683   5.490  -3.911
  167    HG3  ARG  23          3HG       ARG  23  -2.769   4.153  -4.298
  168    HD2  ARG  23          2HD       ARG  23  -2.336   4.928  -6.403
  169    HD3  ARG  23          3HD       ARG  23  -3.754   5.899  -6.008
  170    HE   ARG  23           HE       ARG  23  -2.425   7.778  -5.943
  171   HH11  ARG  23          1HH1      ARG  23  -0.438   4.924  -6.105
  172   HH12  ARG  23          2HH1      ARG  23   1.024   5.800  -6.413
  173   HH21  ARG  23          1HH2      ARG  23  -0.506   8.943  -6.348
  174   HH22  ARG  23          2HH2      ARG  23   0.985   8.087  -6.550
  175    H    GLY  24           HN       GLY  24  -3.960   3.785  -0.642
  176    HA2  GLY  24          1HA       GLY  24  -6.712   4.630  -0.052
  177    HA3  GLY  24          2HA       GLY  24  -6.099   2.986   0.050
  178    H    CYS  25           HN       CYS  25  -3.676   4.478   1.421
  179    HA   CYS  25           HA       CYS  25  -4.933   4.683   4.076
  180    HB2  CYS  25          2HB       CYS  25  -2.344   3.292   3.362
  181    HB3  CYS  25          3HB       CYS  25  -2.861   3.631   5.010
  182    H    ASN  26           HN       ASN  26  -2.394   5.702   1.892
  183    HA   ASN  26           HA       ASN  26  -1.369   7.752   1.738
  184    HB2  ASN  26          2HB       ASN  26  -3.477   8.372   3.360
  185    HB3  ASN  26          3HB       ASN  26  -2.114   8.743   4.411
  186   HD21  ASN  26          1HD2      ASN  26  -2.773   9.102   0.941
  187   HD22  ASN  26          2HD2      ASN  26  -2.357  10.777   0.864
  188    H    HIS  27           HN       HIS  27  -0.514   5.265   3.274
  189    HA   HIS  27           HA       HIS  27   1.641   6.505   4.854
  190    HB2  HIS  27          2HB       HIS  27   0.481   3.719   5.070
  191    HB3  HIS  27          3HB       HIS  27   1.820   4.339   6.031
  192    HD1  HIS  27          1HD       HIS  27   0.746   7.039   6.901
  193    HD2  HIS  27          2HD       HIS  27  -1.551   3.578   6.855
  194    HE1  HIS  27          1HE       HIS  27  -1.120   7.450   8.536
  195    H    LEU  28           HN       LEU  28   3.724   5.326   4.824
  196    HA   LEU  28           HA       LEU  28   4.525   4.829   2.121
  197    HB2  LEU  28          2HB       LEU  28   5.958   4.722   4.761
  198    HB3  LEU  28          3HB       LEU  28   6.746   4.289   3.245
  199    HG   LEU  28           HG       LEU  28   5.612   6.992   3.963
  200   HD11  LEU  28          1HD1      LEU  28   7.873   6.043   4.925
  201   HD12  LEU  28          2HD1      LEU  28   7.742   7.709   4.365
  202   HD13  LEU  28          3HD1      LEU  28   8.471   6.485   3.326
  203   HD21  LEU  28          1HD2      LEU  28   6.700   7.695   1.833
  204   HD22  LEU  28          2HD2      LEU  28   5.303   6.639   1.618
  205   HD23  LEU  28          3HD2      LEU  28   6.934   5.990   1.448
  206    H    VAL  29           HN       VAL  29   5.443   2.915   1.278
  207    HA   VAL  29           HA       VAL  29   5.239   0.453   2.787
  208    HB   VAL  29           HB       VAL  29   3.916  -0.111   0.330
  209   HG11  VAL  29          1HG1      VAL  29   2.537  -1.335   1.671
  210   HG12  VAL  29          2HG1      VAL  29   3.882  -1.103   2.789
  211   HG13  VAL  29          3HG1      VAL  29   2.448  -0.083   2.909
  212   HG21  VAL  29          1HG2      VAL  29   3.337   2.365   0.541
  213   HG22  VAL  29          2HG2      VAL  29   1.995   1.238   0.347
  214   HG23  VAL  29          3HG2      VAL  29   2.369   1.898   1.939
  215    H    CYS  30           HN       CYS  30   7.055  -0.591   2.346
  216    HA   CYS  30           HA       CYS  30   8.901   0.017   0.409
  217    HB2  CYS  30          2HB       CYS  30   9.869  -2.204   0.803
  218    HB3  CYS  30          3HB       CYS  30   9.384  -1.446   2.316
  219    H    ARG  31           HN       ARG  31   9.655  -1.710  -1.297
  220    HA   ARG  31           HA       ARG  31   7.513  -1.864  -3.233
  221    HB2  ARG  31          2HB       ARG  31   9.357  -2.743  -4.727
  222    HB3  ARG  31          3HB       ARG  31   9.594  -1.119  -4.097
  223    HG2  ARG  31          2HG       ARG  31  11.158  -1.919  -2.463
  224    HG3  ARG  31          3HG       ARG  31  10.829  -3.593  -2.912
  225    HD2  ARG  31          2HD       ARG  31  11.524  -2.299  -5.292
  226    HD3  ARG  31          3HD       ARG  31  12.659  -1.701  -4.084
  227    HE   ARG  31           HE       ARG  31  12.722  -4.228  -5.288
  228   HH11  ARG  31          1HH1      ARG  31  12.993  -2.777  -2.135
  229   HH12  ARG  31          2HH1      ARG  31  14.023  -4.022  -1.508
  230   HH21  ARG  31          1HH2      ARG  31  14.078  -5.871  -4.474
  231   HH22  ARG  31          2HH2      ARG  31  14.640  -5.780  -2.840
  232    H    ASP  32           HN       ASP  32   7.730  -3.656  -0.774
  233    HA   ASP  32           HA       ASP  32   7.383  -6.200  -2.217
  234    HB2  ASP  32          2HB       ASP  32   9.488  -6.144  -0.860
  235    HB3  ASP  32          3HB       ASP  32   8.498  -5.920   0.580
  236    H    CYS  33           HN       CYS  33   5.988  -3.843  -0.314
  237    HA   CYS  33           HA       CYS  33   3.969  -5.699   0.754
  238    HB2  CYS  33          2HB       CYS  33   4.799  -2.932   1.627
  239    HB3  CYS  33          3HB       CYS  33   3.335  -3.715   2.212
  240    H    ARG  34           HN       ARG  34   4.383  -4.133  -1.945
  241    HA   ARG  34           HA       ARG  34   1.718  -2.899  -2.046
  242    HB2  ARG  34          2HB       ARG  34   3.555  -2.628  -4.351
  243    HB3  ARG  34          3HB       ARG  34   2.486  -1.442  -3.616
  244    HG2  ARG  34          2HG       ARG  34   4.041  -0.923  -1.933
  245    HG3  ARG  34          3HG       ARG  34   5.011  -2.357  -2.278
  246    HD2  ARG  34          2HD       ARG  34   5.782  -1.447  -4.329
  247    HD3  ARG  34          3HD       ARG  34   4.601  -0.139  -4.269
  248    HE   ARG  34           HE       ARG  34   6.055   0.271  -2.038
  249   HH11  ARG  34          1HH1      ARG  34   6.926  -0.235  -5.370
  250   HH12  ARG  34          2HH1      ARG  34   8.369   0.718  -5.273
  251   HH21  ARG  34          1HH2      ARG  34   7.952   1.529  -1.898
  252   HH22  ARG  34          2HH2      ARG  34   8.952   1.721  -3.298
  253    H    ILE  35           HN       ILE  35   0.159  -3.640  -3.402
  254    HA   ILE  35           HA       ILE  35   0.778  -6.109  -4.880
  255    HB   ILE  35           HB       ILE  35  -1.734  -5.156  -3.538
  256   HG12  ILE  35          2HG1      ILE  35  -1.644  -7.518  -2.652
  257   HG13  ILE  35          3HG1      ILE  35  -0.079  -7.683  -3.440
  258   HG21  ILE  35          1HG2      ILE  35  -1.485  -7.180  -5.745
  259   HG22  ILE  35          2HG2      ILE  35  -2.827  -7.180  -4.601
  260   HG23  ILE  35          3HG2      ILE  35  -2.563  -5.789  -5.651
  261   HD11  ILE  35          1HD1      ILE  35  -0.517  -5.418  -1.562
  262   HD12  ILE  35          2HD1      ILE  35  -0.244  -7.039  -0.920
  263   HD13  ILE  35          3HD1      ILE  35   0.965  -6.286  -1.959
  264    H    GLN  36           HN       GLN  36   1.173  -5.596  -6.945
  265    HA   GLN  36           HA       GLN  36   0.335  -3.386  -8.357
  266    HB2  GLN  36          2HB       GLN  36   1.438  -6.014  -9.022
  267    HB3  GLN  36          3HB       GLN  36   0.452  -5.328 -10.306
  268    HG2  GLN  36          2HG       GLN  36   2.752  -3.916  -8.976
  269    HG3  GLN  36          3HG       GLN  36   2.853  -4.792 -10.503
  270   HE21  GLN  36          1HE2      GLN  36   1.783  -1.928  -8.907
  271   HE22  GLN  36          2HE2      GLN  36   1.314  -1.056 -10.323
  272    H    GLU  37           HN       GLU  37  -1.580  -2.690  -9.020
  273    HA   GLU  37           HA       GLU  37  -3.795  -4.616  -9.184
  274    HB2  GLU  37          2HB       GLU  37  -3.855  -1.609  -8.871
  275    HB3  GLU  37          3HB       GLU  37  -5.272  -2.645  -8.964
  276    HG2  GLU  37          2HG       GLU  37  -3.374  -3.455  -6.906
  277    HG3  GLU  37          3HG       GLU  37  -4.029  -1.837  -6.669
  278    H    SER  38           HN       SER  38  -4.531  -5.165 -11.118
  279    HA   SER  38           HA       SER  38  -3.519  -4.496 -13.536
  280    HB2  SER  38          2HB       SER  38  -5.505  -6.128 -12.782
  281    HB3  SER  38          3HB       SER  38  -6.474  -4.833 -13.484
  282    HG   SER  38           HG       SER  38  -5.224  -6.755 -14.760
  283    H    ASN  39           HN       ASN  39  -6.122  -2.793 -11.847
  284    HA   ASN  39           HA       ASN  39  -7.070  -1.040 -13.652
  285    HB2  ASN  39          2HB       ASN  39  -6.494  -0.855 -10.759
  286    HB3  ASN  39          3HB       ASN  39  -6.724   0.685 -11.583
  287   HD21  ASN  39          1HD2      ASN  39  -8.444  -0.176  -9.622
  288   HD22  ASN  39          2HD2      ASN  39  -9.982  -0.535 -10.325
  289    H    GLY  40           HN       GLY  40  -3.909  -0.822 -12.079
  290    HA2  GLY  40          1HA       GLY  40  -2.229   0.064 -13.814
  291    HA3  GLY  40          2HA       GLY  40  -3.261   1.485 -13.790
  292    H    THR  41           HN       THR  41  -3.547   0.594 -10.761
  293    HA   THR  41           HA       THR  41  -1.129   2.039  -9.893
  294    HB   THR  41           HB       THR  41  -3.319   3.244  -9.557
  295    HG1  THR  41          1HG       THR  41  -1.419   3.627  -8.252
  296   HG21  THR  41          1HG2      THR  41  -4.830   2.527  -7.856
  297   HG22  THR  41          2HG2      THR  41  -3.760   1.209  -7.375
  298   HG23  THR  41          3HG2      THR  41  -4.582   1.154  -8.934
  299    H    TRP  42           HN       TRP  42  -1.543   1.621  -7.127
  300    HA   TRP  42           HA       TRP  42  -1.578  -1.257  -6.721
  301    HB2  TRP  42          2HB       TRP  42   0.628  -1.347  -5.711
  302    HB3  TRP  42          3HB       TRP  42   0.761  -0.739  -7.359
  303    HD1  TRP  42          1HD       TRP  42   1.966   1.525  -7.674
  304    HE1  TRP  42          1HE       TRP  42   2.926   3.308  -6.086
  305    HE3  TRP  42          3HE       TRP  42   0.116  -0.249  -3.251
  306    HZ2  TRP  42          2HZ       TRP  42   2.902   3.887  -3.324
  307    HZ3  TRP  42          3HZ       TRP  42   0.630   0.978  -1.181
  308    HH2  TRP  42          2HH       TRP  42   1.996   3.002  -1.218
  309    H    ARG  43           HN       ARG  43  -1.677  -1.866  -4.484
  310    HA   ARG  43           HA       ARG  43  -2.077   0.285  -2.553
  311    HB2  ARG  43          2HB       ARG  43  -4.182  -1.700  -3.382
  312    HB3  ARG  43          3HB       ARG  43  -4.212  -0.940  -1.797
  313    HG2  ARG  43          2HG       ARG  43  -3.856   1.083  -3.768
  314    HG3  ARG  43          3HG       ARG  43  -5.213   0.057  -4.237
  315    HD2  ARG  43          2HD       ARG  43  -5.034   0.935  -1.403
  316    HD3  ARG  43          3HD       ARG  43  -5.510   2.129  -2.610
  317    HE   ARG  43           HE       ARG  43  -7.108   0.017  -1.590
  318   HH11  ARG  43          1HH1      ARG  43  -6.440   1.827  -4.488
  319   HH12  ARG  43          2HH1      ARG  43  -8.015   1.578  -5.164
  320   HH21  ARG  43          1HH2      ARG  43  -9.186  -0.320  -2.470
  321   HH22  ARG  43          2HH2      ARG  43  -9.576   0.358  -4.015
  322    H    CYS  44           HN       CYS  44  -1.337  -0.226  -0.581
  323    HA   CYS  44           HA       CYS  44   0.349  -2.236  -0.001
  324    HB2  CYS  44          2HB       CYS  44   0.074  -1.767   2.287
  325    HB3  CYS  44          3HB       CYS  44  -0.392  -0.273   1.481
  326    H    LYS  45           HN       LYS  45   0.201  -4.221   1.229
  327    HA   LYS  45           HA       LYS  45  -1.611  -6.057   0.164
  328    HB2  LYS  45          2HB       LYS  45  -0.406  -6.610   2.832
  329    HB3  LYS  45          3HB       LYS  45  -0.523  -7.649   1.418
  330    HG2  LYS  45          2HG       LYS  45   1.177  -6.023   0.362
  331    HG3  LYS  45          3HG       LYS  45   1.475  -5.510   2.024
  332    HD2  LYS  45          2HD       LYS  45   3.045  -7.173   1.801
  333    HD3  LYS  45          3HD       LYS  45   1.685  -8.092   2.451
  334    HE2  LYS  45          2HE       LYS  45   1.068  -8.478  -0.030
  335    HE3  LYS  45          3HE       LYS  45   2.730  -7.987  -0.356
  336    HZ1  LYS  45          1HZ       LYS  45   3.575  -9.831   0.682
  337    HZ2  LYS  45          2HZ       LYS  45   2.161 -10.475   0.014
  338    HZ3  LYS  45          3HZ       LYS  45   2.211 -10.067   1.655
  339    H    VAL  46           HN       VAL  46  -1.914  -3.900   2.834
  340    HA   VAL  46           HA       VAL  46  -4.062  -5.326   4.120
  341    HB   VAL  46           HB       VAL  46  -3.458  -2.419   4.566
  342   HG11  VAL  46          1HG1      VAL  46  -4.318  -4.602   6.460
  343   HG12  VAL  46          2HG1      VAL  46  -4.214  -2.875   6.806
  344   HG13  VAL  46          3HG1      VAL  46  -5.414  -3.476   5.661
  345   HG21  VAL  46          1HG2      VAL  46  -1.293  -3.243   4.725
  346   HG22  VAL  46          2HG2      VAL  46  -1.872  -3.346   6.387
  347   HG23  VAL  46          3HG2      VAL  46  -1.822  -4.793   5.379
  348    H    CYS  47           HN       CYS  47  -3.757  -3.097   1.531
  349    HA   CYS  47           HA       CYS  47  -6.591  -2.366   1.659
  350    HB2  CYS  47          2HB       CYS  47  -4.205  -1.255   0.234
  351    HB3  CYS  47          3HB       CYS  47  -5.811  -0.952  -0.421
  352    H    ALA  48           HN       ALA  48  -4.225  -3.676  -0.656
  353    HA   ALA  48           HA       ALA  48  -6.091  -4.317  -2.665
  354    HB1  ALA  48          1HB       ALA  48  -3.268  -4.774  -2.158
  355    HB2  ALA  48          2HB       ALA  48  -4.035  -6.130  -2.987
  356    HB3  ALA  48          3HB       ALA  48  -4.117  -4.511  -3.682
  357    H    LYS  49           HN       LYS  49  -5.180  -5.920   0.269
  358    HA   LYS  49           HA       LYS  49  -6.798  -8.259  -0.505
  359    HB2  LYS  49          2HB       LYS  49  -4.206  -8.087   0.654
  360    HB3  LYS  49          3HB       LYS  49  -5.286  -8.763   1.867
  361    HG2  LYS  49          2HG       LYS  49  -5.037 -10.731   0.887
  362    HG3  LYS  49          3HG       LYS  49  -5.921 -10.093  -0.503
  363    HD2  LYS  49          2HD       LYS  49  -4.000  -9.677  -1.701
  364    HD3  LYS  49          3HD       LYS  49  -3.005  -9.515  -0.253
  365    HE2  LYS  49          2HE       LYS  49  -3.928 -12.133  -0.174
  366    HE3  LYS  49          3HE       LYS  49  -3.556 -11.851  -1.875
  367    HZ1  LYS  49          1HZ       LYS  49  -1.360 -10.952  -1.049
  368    HZ2  LYS  49          2HZ       LYS  49  -1.582 -12.624  -0.915
  369    HZ3  LYS  49          3HZ       LYS  49  -1.739 -11.638   0.451
  370    H    GLU  50           HN       GLU  50  -8.687  -8.498   0.485
  371    HA   GLU  50           HA       GLU  50  -9.029  -7.599   3.234
  372    HB2  GLU  50          2HB       GLU  50  -9.683  -5.643   1.932
  373    HB3  GLU  50          3HB       GLU  50 -10.776  -6.626   0.968
  374    HG2  GLU  50          2HG       GLU  50 -11.477  -7.020   3.670
  375    HG3  GLU  50          3HG       GLU  50 -11.264  -5.286   3.431
  376    H    ILE  51           HN       ILE  51  -9.152  -9.860   3.627
  377    HA   ILE  51           HA       ILE  51 -11.094 -11.519   2.369
  378    HB   ILE  51           HB       ILE  51  -9.184 -12.578   3.340
  379   HG12  ILE  51          2HG1      ILE  51 -11.378 -13.298   5.261
  380   HG13  ILE  51          3HG1      ILE  51 -11.558 -13.620   3.540
  381   HG21  ILE  51          1HG2      ILE  51  -9.626 -10.728   5.461
  382   HG22  ILE  51          2HG2      ILE  51  -9.589 -12.361   6.126
  383   HG23  ILE  51          3HG2      ILE  51  -8.231 -11.767   5.170
  384   HD11  ILE  51          1HD1      ILE  51 -10.437 -15.502   3.795
  385   HD12  ILE  51          2HD1      ILE  51  -9.024 -14.588   4.324
  386   HD13  ILE  51          3HD1      ILE  51 -10.206 -15.147   5.507
  387    H    GLU  52           HN       GLU  52 -13.133 -12.063   2.976
  388    HA   GLU  52           HA       GLU  52 -14.682 -10.275   4.439
  389    HB2  GLU  52          2HB       GLU  52 -15.128 -13.119   3.576
  390    HB3  GLU  52          3HB       GLU  52 -16.336 -12.261   4.523
  391    HG2  GLU  52          2HG       GLU  52 -17.113 -11.278   2.705
  392    HG3  GLU  52          3HG       GLU  52 -15.523 -10.606   2.350
  393    H    LEU  53           HN       LEU  53 -14.731  -9.871   6.540
  394    HA   LEU  53           HA       LEU  53 -14.440 -10.077   8.790
  395    HB2  LEU  53          2HB       LEU  53 -16.401 -11.692   8.114
  396    HB3  LEU  53          3HB       LEU  53 -15.258 -12.938   8.616
  397    HG   LEU  53           HG       LEU  53 -16.906 -12.274  10.365
  398   HD11  LEU  53          1HD1      LEU  53 -14.157 -11.529  11.281
  399   HD12  LEU  53          2HD1      LEU  53 -14.512 -13.168  10.736
  400   HD13  LEU  53          3HD1      LEU  53 -15.390 -12.485  12.103
  401   HD21  LEU  53          1HD2      LEU  53 -17.181 -10.166  11.061
  402   HD22  LEU  53          2HD2      LEU  53 -16.372  -9.715   9.559
  403   HD23  LEU  53          3HD2      LEU  53 -15.448  -9.838  11.057
  Start of MODEL    4
    1    H1   SER   1           HN       SER   1   9.963  12.734  11.423
    2    HA   SER   1           HA       SER   1   8.683  10.312  11.047
    3    HB2  SER   1          2HB       SER   1   8.146  12.269   8.802
    4    HB3  SER   1          3HB       SER   1   7.918  10.525   8.670
    5    HG   SER   1           HG       SER   1   6.111  12.120   9.410
    6    H    ASP   2           HN       ASP   2   9.904   8.869   9.820
    7    HA   ASP   2           HA       ASP   2  12.407   9.971   8.720
    8    HB2  ASP   2          2HB       ASP   2  12.098   7.256  10.012
    9    HB3  ASP   2          3HB       ASP   2  13.595   8.044   9.519
   10    H    ARG   3           HN       ARG   3   9.576   8.421   7.980
   11    HA   ARG   3           HA       ARG   3   8.838   7.615   5.961
   12    HB2  ARG   3          2HB       ARG   3  11.664   7.329   4.985
   13    HB3  ARG   3          3HB       ARG   3  10.197   7.603   4.054
   14    HG2  ARG   3          2HG       ARG   3  10.674   9.766   5.902
   15    HG3  ARG   3          3HG       ARG   3  12.061   9.502   4.844
   16    HD2  ARG   3          2HD       ARG   3  10.976  10.288   3.054
   17    HD3  ARG   3          3HD       ARG   3   9.514   9.378   3.437
   18    HE   ARG   3           HE       ARG   3   8.639  11.311   4.250
   19   HH11  ARG   3          1HH1      ARG   3  12.108  11.509   4.471
   20   HH12  ARG   3          2HH1      ARG   3  12.106  13.127   5.094
   21   HH21  ARG   3          1HH2      ARG   3   8.623  13.439   5.070
   22   HH22  ARG   3          2HH2      ARG   3  10.123  14.222   5.436
   23    H    THR   4           HN       THR   4   8.532   5.871   7.674
   24    HA   THR   4           HA       THR   4  10.093   3.471   6.978
   25    HB   THR   4           HB       THR   4   8.421   3.221   9.354
   26    HG1  THR   4          1HG       THR   4   9.879   4.605  10.604
   27   HG21  THR   4          1HG2      THR   4  10.214   1.659   8.691
   28   HG22  THR   4          2HG2      THR   4  10.472   2.327  10.304
   29   HG23  THR   4          3HG2      THR   4  11.399   2.942   8.934
   30    H    CYS   5           HN       CYS   5   9.023   1.527   6.568
   31    HA   CYS   5           HA       CYS   5   6.651   1.665   5.120
   32    HB2  CYS   5          2HB       CYS   5   8.375  -0.170   5.023
   33    HB3  CYS   5          3HB       CYS   5   7.697  -0.799   6.522
   34    H    ALA   6           HN       ALA   6   4.523   1.108   5.560
   35    HA   ALA   6           HA       ALA   6   3.731   1.460   8.337
   36    HB1  ALA   6          1HB       ALA   6   2.018   2.544   7.440
   37    HB2  ALA   6          2HB       ALA   6   2.613   2.148   5.828
   38    HB3  ALA   6          3HB       ALA   6   1.484   1.065   6.642
   39    H    ARG   7           HN       ARG   7   4.666  -1.111   6.611
   40    HA   ARG   7           HA       ARG   7   2.775  -2.914   7.974
   41    HB2  ARG   7          2HB       ARG   7   4.218  -3.606   5.422
   42    HB3  ARG   7          3HB       ARG   7   2.853  -4.435   6.158
   43    HG2  ARG   7          2HG       ARG   7   2.849  -1.763   4.780
   44    HG3  ARG   7          3HG       ARG   7   2.049  -3.248   4.263
   45    HD2  ARG   7          2HD       ARG   7   1.273  -1.291   6.350
   46    HD3  ARG   7          3HD       ARG   7   0.270  -2.186   5.209
   47    HE   ARG   7           HE       ARG   7   1.098  -4.138   6.828
   48   HH11  ARG   7          1HH1      ARG   7  -0.190  -0.979   7.523
   49   HH12  ARG   7          2HH1      ARG   7  -0.912  -1.461   9.022
   50   HH21  ARG   7          1HH2      ARG   7   0.151  -4.784   8.800
   51   HH22  ARG   7          2HH2      ARG   7  -0.717  -3.624   9.749
   52    H    CYS   8           HN       CYS   8   6.085  -2.420   6.852
   53    HA   CYS   8           HA       CYS   8   6.989  -4.632   8.554
   54    HB2  CYS   8          2HB       CYS   8   8.621  -3.062   6.555
   55    HB3  CYS   8          3HB       CYS   8   9.047  -4.592   7.316
   56    H    GLN   9           HN       GLN   9   7.010  -1.190   8.257
   57    HA   GLN   9           HA       GLN   9   7.719   0.461   9.653
   58    HB2  GLN   9          2HB       GLN   9   7.338  -1.821  11.347
   59    HB3  GLN   9          3HB       GLN   9   8.741  -0.917  11.903
   60    HG2  GLN   9          2HG       GLN   9   6.425   0.746  11.257
   61    HG3  GLN   9          3HG       GLN   9   6.159  -0.391  12.577
   62   HE21  GLN   9          1HE2      GLN   9   8.890   1.607  11.499
   63   HE22  GLN   9          2HE2      GLN   9   9.174   2.348  13.033
   64    H    GLU  10           HN       GLU  10   9.530  -0.897   7.794
   65    HA   GLU  10           HA       GLU  10  12.108  -0.536   9.158
   66    HB2  GLU  10          2HB       GLU  10  11.161  -2.303   7.018
   67    HB3  GLU  10          3HB       GLU  10  12.704  -1.537   6.670
   68    HG2  GLU  10          2HG       GLU  10  13.143  -2.354   9.195
   69    HG3  GLU  10          3HG       GLU  10  12.011  -3.594   8.657
   70    H    SER  11           HN       SER  11  13.779   0.669   8.121
   71    HA   SER  11           HA       SER  11  12.998   3.156   7.151
   72    HB2  SER  11          2HB       SER  11  15.154   3.023   8.103
   73    HB3  SER  11          3HB       SER  11  15.626   1.683   7.058
   74    HG   SER  11           HG       SER  11  14.923   4.131   5.891
   75    H    LEU  12           HN       LEU  12  12.790   4.053   5.146
   76    HA   LEU  12           HA       LEU  12  12.400   2.202   2.948
   77    HB2  LEU  12          2HB       LEU  12  11.820   5.113   3.373
   78    HB3  LEU  12          3HB       LEU  12  11.708   4.384   1.772
   79    HG   LEU  12           HG       LEU  12   9.639   4.617   3.497
   80   HD11  LEU  12          1HD1      LEU  12   8.751   2.550   2.126
   81   HD12  LEU  12          2HD1      LEU  12  10.246   2.800   1.223
   82   HD13  LEU  12          3HD1      LEU  12   9.063   4.102   1.348
   83   HD21  LEU  12          1HD2      LEU  12  10.625   1.787   3.824
   84   HD22  LEU  12          2HD2      LEU  12   9.152   2.489   4.496
   85   HD23  LEU  12          3HD2      LEU  12  10.730   3.033   5.069
   86    H    GLY  13           HN       GLY  13  14.527   4.877   3.819
   87    HA2  GLY  13          1HA       GLY  13  16.467   5.659   2.867
   88    HA3  GLY  13          2HA       GLY  13  16.724   3.988   2.389
   89    H    ARG  14           HN       ARG  14  17.123   3.783   0.300
   90    HA   ARG  14           HA       ARG  14  16.266   5.837  -1.561
   91    HB2  ARG  14          2HB       ARG  14  18.552   4.460  -1.428
   92    HB3  ARG  14          3HB       ARG  14  17.664   3.388  -2.502
   93    HG2  ARG  14          2HG       ARG  14  17.506   6.212  -3.241
   94    HG3  ARG  14          3HG       ARG  14  19.136   5.535  -3.290
   95    HD2  ARG  14          2HD       ARG  14  18.539   3.915  -4.869
   96    HD3  ARG  14          3HD       ARG  14  16.817   4.112  -4.550
   97    HE   ARG  14           HE       ARG  14  18.035   6.485  -5.588
   98   HH11  ARG  14          1HH1      ARG  14  16.643   3.410  -6.437
   99   HH12  ARG  14          2HH1      ARG  14  16.194   3.906  -8.035
  100   HH21  ARG  14          1HH2      ARG  14  17.449   7.152  -7.689
  101   HH22  ARG  14          2HH2      ARG  14  16.655   6.035  -8.746
  102    H    LEU  15           HN       LEU  15  13.975   4.965  -0.876
  103    HA   LEU  15           HA       LEU  15  13.183   2.882  -2.802
  104    HB2  LEU  15          2HB       LEU  15  12.627   3.187  -0.033
  105    HB3  LEU  15          3HB       LEU  15  11.116   3.391  -0.918
  106    HG   LEU  15           HG       LEU  15  12.854   1.028  -1.494
  107   HD11  LEU  15          1HD1      LEU  15  10.752   0.749   0.575
  108   HD12  LEU  15          2HD1      LEU  15  12.285   1.466   1.066
  109   HD13  LEU  15          3HD1      LEU  15  12.256  -0.146   0.353
  110   HD21  LEU  15          1HD2      LEU  15  10.708   0.003  -2.014
  111   HD22  LEU  15          2HD2      LEU  15  10.916   1.505  -2.914
  112   HD23  LEU  15          3HD2      LEU  15   9.868   1.464  -1.496
  113    H    SER  16           HN       SER  16  12.690   6.133  -1.709
  114    HA   SER  16           HA       SER  16  11.719   7.895  -2.820
  115    HB2  SER  16          2HB       SER  16  12.098   6.373  -4.903
  116    HB3  SER  16          3HB       SER  16  10.372   6.037  -4.759
  117    HG   SER  16           HG       SER  16  11.374   8.677  -4.798
  118    HA   PRO  17           HA       PRO  17   7.978   6.708  -0.396
  119    HB2  PRO  17          2HB       PRO  17   8.050   8.908   1.194
  120    HB3  PRO  17          3HB       PRO  17   8.974   7.441   1.541
  121    HG2  PRO  17          2HG       PRO  17   9.880   9.994   0.265
  122    HG3  PRO  17          3HG       PRO  17  10.696   9.003   1.488
  123    HD2  PRO  17          2HD       PRO  17  11.353   8.911  -1.137
  124    HD3  PRO  17          3HD       PRO  17  11.478   7.496  -0.071
  125    H    LYS  18           HN       LYS  18   8.866   9.167  -2.529
  126    HA   LYS  18           HA       LYS  18   6.554  10.827  -2.323
  127    HB2  LYS  18          2HB       LYS  18   9.002  10.941  -3.663
  128    HB3  LYS  18          3HB       LYS  18   7.799  10.849  -4.943
  129    HG2  LYS  18          2HG       LYS  18   7.021  12.916  -4.540
  130    HG3  LYS  18          3HG       LYS  18   7.181  12.749  -2.790
  131    HD2  LYS  18          2HD       LYS  18   9.750  12.850  -3.342
  132    HD3  LYS  18          3HD       LYS  18   9.183  13.650  -4.810
  133    HE2  LYS  18          2HE       LYS  18   7.844  15.171  -3.271
  134    HE3  LYS  18          3HE       LYS  18   8.801  14.500  -1.951
  135    HZ1  LYS  18          1HZ       LYS  18  10.809  15.222  -3.191
  136    HZ2  LYS  18          2HZ       LYS  18   9.831  16.501  -2.673
  137    HZ3  LYS  18          3HZ       LYS  18   9.803  16.017  -4.295
  138    H    THR  19           HN       THR  19   7.250   7.825  -3.858
  139    HA   THR  19           HA       THR  19   4.584   7.872  -5.104
  140    HB   THR  19           HB       THR  19   5.296   7.028  -7.114
  141    HG1  THR  19          1HG       THR  19   6.392   5.215  -6.604
  142   HG21  THR  19          1HG2      THR  19   7.818   8.441  -6.243
  143   HG22  THR  19          2HG2      THR  19   6.337   9.262  -6.735
  144   HG23  THR  19          3HG2      THR  19   7.213   8.259  -7.889
  145    H    ASN  20           HN       ASN  20   5.921   6.710  -2.593
  146    HA   ASN  20           HA       ASN  20   5.115   3.910  -3.030
  147    HB2  ASN  20          2HB       ASN  20   7.044   5.025  -0.980
  148    HB3  ASN  20          3HB       ASN  20   6.584   3.332  -1.132
  149   HD21  ASN  20          1HD2      ASN  20   9.061   3.398  -1.254
  150   HD22  ASN  20          2HD2      ASN  20   9.726   3.436  -2.848
  151    H    THR  21           HN       THR  21   3.856   6.632  -1.952
  152    HA   THR  21           HA       THR  21   2.835   5.721   0.607
  153    HB   THR  21           HB       THR  21   2.165   8.224  -0.953
  154    HG1  THR  21          1HG       THR  21   3.575   9.185   0.645
  155   HG21  THR  21          1HG2      THR  21   0.428   7.524   0.672
  156   HG22  THR  21          2HG2      THR  21   1.205   9.046   1.111
  157   HG23  THR  21          3HG2      THR  21   1.647   7.556   1.946
  158    H    CYS  22           HN       CYS  22   1.457   4.032   0.304
  159    HA   CYS  22           HA       CYS  22  -0.234   3.397  -1.686
  160    HB2  CYS  22          2HB       CYS  22   0.031   2.111   0.423
  161    HB3  CYS  22          3HB       CYS  22  -1.002   3.281   1.237
  162    H    ARG  23           HN       ARG  23  -1.929   4.252  -2.697
  163    HA   ARG  23           HA       ARG  23  -2.942   6.813  -1.887
  164    HB2  ARG  23          2HB       ARG  23  -4.414   5.394  -3.994
  165    HB3  ARG  23          3HB       ARG  23  -3.681   6.992  -4.011
  166    HG2  ARG  23          2HG       ARG  23  -1.446   5.661  -4.149
  167    HG3  ARG  23          3HG       ARG  23  -2.487   4.354  -4.714
  168    HD2  ARG  23          2HD       ARG  23  -1.586   5.641  -6.584
  169    HD3  ARG  23          3HD       ARG  23  -3.340   5.789  -6.491
  170    HE   ARG  23           HE       ARG  23  -3.083   8.030  -6.153
  171   HH11  ARG  23          1HH1      ARG  23  -0.072   6.437  -5.437
  172   HH12  ARG  23          2HH1      ARG  23   0.805   7.914  -5.205
  173   HH21  ARG  23          1HH2      ARG  23  -1.941   9.980  -5.851
  174   HH22  ARG  23          2HH2      ARG  23  -0.260   9.929  -5.441
  175    H    GLY  24           HN       GLY  24  -3.526   3.979  -0.565
  176    HA2  GLY  24          1HA       GLY  24  -6.449   4.275  -0.415
  177    HA3  GLY  24          2HA       GLY  24  -5.546   2.838   0.040
  178    H    CYS  25           HN       CYS  25  -3.630   3.820   1.708
  179    HA   CYS  25           HA       CYS  25  -5.249   4.830   3.946
  180    HB2  CYS  25          2HB       CYS  25  -3.237   3.893   5.297
  181    HB3  CYS  25          3HB       CYS  25  -4.409   2.765   4.625
  182    H    ASN  26           HN       ASN  26  -2.614   5.551   1.882
  183    HA   ASN  26           HA       ASN  26  -1.444   7.504   1.629
  184    HB2  ASN  26          2HB       ASN  26  -2.456   8.570   4.242
  185    HB3  ASN  26          3HB       ASN  26  -2.051   9.442   2.767
  186   HD21  ASN  26          1HD2      ASN  26  -4.527   8.477   4.663
  187   HD22  ASN  26          2HD2      ASN  26  -5.810   8.486   3.506
  188    H    HIS  27           HN       HIS  27  -0.481   5.157   2.981
  189    HA   HIS  27           HA       HIS  27   1.536   6.389   4.741
  190    HB2  HIS  27          2HB       HIS  27   0.354   3.611   4.923
  191    HB3  HIS  27          3HB       HIS  27   1.688   4.202   5.908
  192    HD1  HIS  27          1HD       HIS  27   0.620   6.935   6.739
  193    HD2  HIS  27          2HD       HIS  27  -1.682   3.476   6.712
  194    HE1  HIS  27          1HE       HIS  27  -1.258   7.364   8.357
  195    H    LEU  28           HN       LEU  28   3.627   5.234   4.777
  196    HA   LEU  28           HA       LEU  28   4.507   4.710   2.102
  197    HB2  LEU  28          2HB       LEU  28   5.869   4.702   4.778
  198    HB3  LEU  28          3HB       LEU  28   6.706   4.225   3.303
  199    HG   LEU  28           HG       LEU  28   5.522   6.937   3.893
  200   HD11  LEU  28          1HD1      LEU  28   8.408   6.340   3.392
  201   HD12  LEU  28          2HD1      LEU  28   7.721   6.131   5.002
  202   HD13  LEU  28          3HD1      LEU  28   7.674   7.713   4.223
  203   HD21  LEU  28          1HD2      LEU  28   6.920   5.864   1.449
  204   HD22  LEU  28          2HD2      LEU  28   6.657   7.579   1.767
  205   HD23  LEU  28          3HD2      LEU  28   5.278   6.498   1.554
  206    H    VAL  29           HN       VAL  29   5.284   2.802   1.233
  207    HA   VAL  29           HA       VAL  29   5.196   0.362   2.809
  208    HB   VAL  29           HB       VAL  29   3.825  -0.212   0.361
  209   HG11  VAL  29          1HG1      VAL  29   2.461  -0.318   2.997
  210   HG12  VAL  29          2HG1      VAL  29   2.540  -1.525   1.712
  211   HG13  VAL  29          3HG1      VAL  29   3.921  -1.284   2.783
  212   HG21  VAL  29          1HG2      VAL  29   1.810   1.036   0.589
  213   HG22  VAL  29          2HG2      VAL  29   2.357   1.761   2.100
  214   HG23  VAL  29          3HG2      VAL  29   3.141   2.193   0.581
  215    H    CYS  30           HN       CYS  30   7.029  -0.645   2.354
  216    HA   CYS  30           HA       CYS  30   8.825  -0.052   0.375
  217    HB2  CYS  30          2HB       CYS  30   9.826  -2.260   0.779
  218    HB3  CYS  30          3HB       CYS  30   9.366  -1.479   2.289
  219    H    ARG  31           HN       ARG  31   9.572  -1.797  -1.319
  220    HA   ARG  31           HA       ARG  31   7.403  -1.997  -3.219
  221    HB2  ARG  31          2HB       ARG  31   9.118  -2.671  -4.810
  222    HB3  ARG  31          3HB       ARG  31   9.635  -1.239  -3.929
  223    HG2  ARG  31          2HG       ARG  31  11.226  -2.412  -2.707
  224    HG3  ARG  31          3HG       ARG  31  10.468  -3.971  -3.038
  225    HD2  ARG  31          2HD       ARG  31  11.209  -2.682  -5.496
  226    HD3  ARG  31          3HD       ARG  31  12.598  -2.769  -4.412
  227    HE   ARG  31           HE       ARG  31  11.312  -4.952  -5.754
  228   HH11  ARG  31          1HH1      ARG  31  13.198  -4.035  -2.975
  229   HH12  ARG  31          2HH1      ARG  31  13.868  -5.616  -2.744
  230   HH21  ARG  31          1HH2      ARG  31  12.187  -7.038  -5.461
  231   HH22  ARG  31          2HH2      ARG  31  13.293  -7.324  -4.160
  232    H    ASP  32           HN       ASP  32   7.649  -3.746  -0.739
  233    HA   ASP  32           HA       ASP  32   7.336  -6.323  -2.134
  234    HB2  ASP  32          2HB       ASP  32   9.415  -6.133  -0.688
  235    HB3  ASP  32          3HB       ASP  32   8.333  -6.034   0.700
  236    H    CYS  33           HN       CYS  33   5.957  -3.958  -0.160
  237    HA   CYS  33           HA       CYS  33   3.916  -5.806   0.865
  238    HB2  CYS  33          2HB       CYS  33   4.658  -2.988   1.667
  239    HB3  CYS  33          3HB       CYS  33   3.241  -3.829   2.288
  240    H    ARG  34           HN       ARG  34   4.349  -4.271  -1.862
  241    HA   ARG  34           HA       ARG  34   1.695  -3.035  -2.025
  242    HB2  ARG  34          2HB       ARG  34   3.504  -2.960  -4.367
  243    HB3  ARG  34          3HB       ARG  34   2.487  -1.698  -3.688
  244    HG2  ARG  34          2HG       ARG  34   4.094  -1.242  -1.970
  245    HG3  ARG  34          3HG       ARG  34   5.077  -2.622  -2.465
  246    HD2  ARG  34          2HD       ARG  34   5.731  -1.581  -4.460
  247    HD3  ARG  34          3HD       ARG  34   4.440  -0.385  -4.359
  248    HE   ARG  34           HE       ARG  34   5.877   0.188  -2.180
  249   HH11  ARG  34          1HH1      ARG  34   6.825  -0.386  -5.480
  250   HH12  ARG  34          2HH1      ARG  34   8.208   0.654  -5.402
  251   HH21  ARG  34          1HH2      ARG  34   7.696   1.560  -2.064
  252   HH22  ARG  34          2HH2      ARG  34   8.703   1.759  -3.457
  253    H    ILE  35           HN       ILE  35   0.097  -3.829  -3.298
  254    HA   ILE  35           HA       ILE  35   0.612  -6.423  -4.581
  255    HB   ILE  35           HB       ILE  35  -1.850  -5.216  -3.368
  256   HG12  ILE  35          2HG1      ILE  35  -1.944  -7.498  -2.318
  257   HG13  ILE  35          3HG1      ILE  35  -0.406  -7.857  -3.095
  258   HG21  ILE  35          1HG2      ILE  35  -2.731  -5.915  -5.426
  259   HG22  ILE  35          2HG2      ILE  35  -1.718  -7.357  -5.466
  260   HG23  ILE  35          3HG2      ILE  35  -3.055  -7.252  -4.322
  261   HD11  ILE  35          1HD1      ILE  35  -0.311  -7.141  -0.682
  262   HD12  ILE  35          2HD1      ILE  35   0.732  -6.257  -1.797
  263   HD13  ILE  35          3HD1      ILE  35  -0.774  -5.532  -1.235
  264    H    GLN  36           HN       GLN  36   1.102  -6.095  -6.668
  265    HA   GLN  36           HA       GLN  36   0.493  -4.006  -8.309
  266    HB2  GLN  36          2HB       GLN  36   1.049  -6.889  -8.792
  267    HB3  GLN  36          3HB       GLN  36   0.440  -5.944 -10.144
  268    HG2  GLN  36          2HG       GLN  36   2.666  -4.749  -8.630
  269    HG3  GLN  36          3HG       GLN  36   3.041  -6.203  -9.553
  270   HE21  GLN  36          1HE2      GLN  36   0.960  -3.380 -10.102
  271   HE22  GLN  36          2HE2      GLN  36   1.621  -2.979 -11.647
  272    H    GLU  37           HN       GLU  37  -1.383  -3.099  -8.799
  273    HA   GLU  37           HA       GLU  37  -3.812  -4.727  -8.831
  274    HB2  GLU  37          2HB       GLU  37  -3.361  -1.743  -8.796
  275    HB3  GLU  37          3HB       GLU  37  -4.949  -2.471  -8.988
  276    HG2  GLU  37          2HG       GLU  37  -3.199  -3.144  -6.654
  277    HG3  GLU  37          3HG       GLU  37  -4.235  -1.717  -6.652
  278    H    SER  38           HN       SER  38  -5.478  -4.002 -10.528
  279    HA   SER  38           HA       SER  38  -4.148  -4.121 -13.134
  280    HB2  SER  38          2HB       SER  38  -6.828  -4.964 -12.108
  281    HB3  SER  38          3HB       SER  38  -6.658  -4.587 -13.822
  282    HG   SER  38           HG       SER  38  -4.619  -6.091 -13.284
  283    H    ASN  39           HN       ASN  39  -5.129  -1.759 -11.199
  284    HA   ASN  39           HA       ASN  39  -6.524  -0.178 -13.227
  285    HB2  ASN  39          2HB       ASN  39  -7.439  -0.204 -10.932
  286    HB3  ASN  39          3HB       ASN  39  -5.929   0.477 -10.332
  287   HD21  ASN  39          1HD2      ASN  39  -6.707   2.375  -9.582
  288   HD22  ASN  39          2HD2      ASN  39  -7.405   3.597 -10.584
  289    H    GLY  40           HN       GLY  40  -3.541  -0.919 -13.074
  290    HA2  GLY  40          1HA       GLY  40  -1.662   0.123 -13.925
  291    HA3  GLY  40          2HA       GLY  40  -2.593   1.607 -14.056
  292    H    THR  41           HN       THR  41  -2.760   0.233 -10.971
  293    HA   THR  41           HA       THR  41  -0.497   1.830  -9.996
  294    HB   THR  41           HB       THR  41  -2.625   3.131  -9.749
  295    HG1  THR  41          1HG       THR  41  -1.430   3.896  -8.182
  296   HG21  THR  41          1HG2      THR  41  -4.424   1.919  -9.162
  297   HG22  THR  41          2HG2      THR  41  -3.808   2.074  -7.517
  298   HG23  THR  41          3HG2      THR  41  -3.443   0.632  -8.464
  299    H    TRP  42           HN       TRP  42  -1.048   1.422  -7.255
  300    HA   TRP  42           HA       TRP  42  -1.159  -1.466  -6.885
  301    HB2  TRP  42          2HB       TRP  42   0.956  -1.514  -5.633
  302    HB3  TRP  42          3HB       TRP  42   1.213  -1.018  -7.304
  303    HD1  TRP  42          1HD       TRP  42   2.330   1.297  -7.708
  304    HE1  TRP  42          1HE       TRP  42   3.233   3.149  -6.164
  305    HE3  TRP  42          3HE       TRP  42   0.445  -0.366  -3.256
  306    HZ2  TRP  42          2HZ       TRP  42   3.157   3.816  -3.423
  307    HZ3  TRP  42          3HZ       TRP  42   0.907   0.936  -1.220
  308    HH2  TRP  42          2HH       TRP  42   2.234   2.983  -1.303
  309    H    ARG  43           HN       ARG  43  -1.371  -2.097  -4.640
  310    HA   ARG  43           HA       ARG  43  -1.997   0.042  -2.754
  311    HB2  ARG  43          2HB       ARG  43  -3.950  -1.969  -3.811
  312    HB3  ARG  43          3HB       ARG  43  -4.110  -1.387  -2.160
  313    HG2  ARG  43          2HG       ARG  43  -3.751   0.749  -4.114
  314    HG3  ARG  43          3HG       ARG  43  -5.201  -0.220  -4.376
  315    HD2  ARG  43          2HD       ARG  43  -4.772   0.460  -1.576
  316    HD3  ARG  43          3HD       ARG  43  -4.945   1.878  -2.608
  317    HE   ARG  43           HE       ARG  43  -7.010   0.140  -1.795
  318   HH11  ARG  43          1HH1      ARG  43  -5.884   1.901  -4.580
  319   HH12  ARG  43          2HH1      ARG  43  -7.463   2.069  -5.274
  320   HH21  ARG  43          1HH2      ARG  43  -9.094   0.357  -2.698
  321   HH22  ARG  43          2HH2      ARG  43  -9.288   1.192  -4.202
  322    H    CYS  44           HN       CYS  44  -1.277  -0.414  -0.773
  323    HA   CYS  44           HA       CYS  44   0.381  -2.445  -0.107
  324    HB2  CYS  44          2HB       CYS  44   0.008  -1.928   2.204
  325    HB3  CYS  44          3HB       CYS  44  -0.155  -0.428   1.295
  326    H    LYS  45           HN       LYS  45   0.086  -4.284   1.408
  327    HA   LYS  45           HA       LYS  45  -1.851  -6.094   0.387
  328    HB2  LYS  45          2HB       LYS  45  -0.543  -6.740   2.961
  329    HB3  LYS  45          3HB       LYS  45  -0.689  -7.704   1.498
  330    HG2  LYS  45          2HG       LYS  45   1.015  -5.996   0.525
  331    HG3  LYS  45          3HG       LYS  45   1.363  -5.664   2.224
  332    HD2  LYS  45          2HD       LYS  45   2.897  -7.328   1.676
  333    HD3  LYS  45          3HD       LYS  45   1.588  -8.223   2.450
  334    HE2  LYS  45          2HE       LYS  45   0.667  -8.715   0.196
  335    HE3  LYS  45          3HE       LYS  45   2.078  -7.930  -0.512
  336    HZ1  LYS  45          1HZ       LYS  45   3.232  -9.788  -0.271
  337    HZ2  LYS  45          2HZ       LYS  45   1.841 -10.574   0.281
  338    HZ3  LYS  45          3HZ       LYS  45   2.898  -9.852   1.386
  339    H    VAL  46           HN       VAL  46  -2.142  -3.637   2.597
  340    HA   VAL  46           HA       VAL  46  -4.167  -4.991   4.221
  341    HB   VAL  46           HB       VAL  46  -3.338  -2.123   4.555
  342   HG11  VAL  46          1HG1      VAL  46  -5.142  -3.841   5.861
  343   HG12  VAL  46          2HG1      VAL  46  -3.788  -3.597   6.966
  344   HG13  VAL  46          3HG1      VAL  46  -4.669  -2.208   6.330
  345   HG21  VAL  46          1HG2      VAL  46  -1.279  -3.425   4.496
  346   HG22  VAL  46          2HG2      VAL  46  -1.612  -2.856   6.132
  347   HG23  VAL  46          3HG2      VAL  46  -1.933  -4.536   5.701
  348    H    CYS  47           HN       CYS  47  -3.870  -2.893   1.537
  349    HA   CYS  47           HA       CYS  47  -6.676  -2.045   1.781
  350    HB2  CYS  47          2HB       CYS  47  -4.344  -0.935   0.228
  351    HB3  CYS  47          3HB       CYS  47  -6.003  -0.475  -0.138
  352    H    ALA  48           HN       ALA  48  -4.401  -3.782  -0.229
  353    HA   ALA  48           HA       ALA  48  -6.247  -4.147  -2.408
  354    HB1  ALA  48          1HB       ALA  48  -4.432  -5.902  -3.057
  355    HB2  ALA  48          2HB       ALA  48  -4.069  -4.178  -3.158
  356    HB3  ALA  48          3HB       ALA  48  -3.494  -5.121  -1.783
  357    H    LYS  49           HN       LYS  49  -5.174  -5.997   0.385
  358    HA   LYS  49           HA       LYS  49  -7.277  -7.973  -0.204
  359    HB2  LYS  49          2HB       LYS  49  -5.139  -9.026  -0.626
  360    HB3  LYS  49          3HB       LYS  49  -4.522  -8.486   0.929
  361    HG2  LYS  49          2HG       LYS  49  -5.626 -10.097   2.087
  362    HG3  LYS  49          3HG       LYS  49  -6.964 -10.164   0.938
  363    HD2  LYS  49          2HD       LYS  49  -5.608 -12.212   0.894
  364    HD3  LYS  49          3HD       LYS  49  -5.569 -11.361  -0.652
  365    HE2  LYS  49          2HE       LYS  49  -3.357 -11.184  -0.551
  366    HE3  LYS  49          3HE       LYS  49  -3.452 -10.413   1.031
  367    HZ1  LYS  49          1HZ       LYS  49  -2.141 -12.440   1.107
  368    HZ2  LYS  49          2HZ       LYS  49  -3.454 -13.341   0.539
  369    HZ3  LYS  49          3HZ       LYS  49  -3.533 -12.597   2.056
  370    H    GLU  50           HN       GLU  50  -8.785  -8.050   1.318
  371    HA   GLU  50           HA       GLU  50  -8.343  -6.735   3.862
  372    HB2  GLU  50          2HB       GLU  50 -10.747  -7.923   2.501
  373    HB3  GLU  50          3HB       GLU  50 -10.801  -7.463   4.198
  374    HG2  GLU  50          2HG       GLU  50  -9.939  -5.541   2.066
  375    HG3  GLU  50          3HG       GLU  50 -11.636  -5.779   2.482
  376    H    ILE  51           HN       ILE  51  -8.706  -7.724   5.905
  377    HA   ILE  51           HA       ILE  51  -8.944 -10.594   6.084
  378    HB   ILE  51           HB       ILE  51  -6.506 -10.203   5.609
  379   HG12  ILE  51          2HG1      ILE  51  -6.930 -11.319   8.377
  380   HG13  ILE  51          3HG1      ILE  51  -7.520 -12.148   6.940
  381   HG21  ILE  51          1HG2      ILE  51  -5.207  -9.422   7.677
  382   HG22  ILE  51          2HG2      ILE  51  -5.992  -8.195   6.683
  383   HG23  ILE  51          3HG2      ILE  51  -6.733  -8.708   8.198
  384   HD11  ILE  51          1HD1      ILE  51  -5.000 -11.795   6.186
  385   HD12  ILE  51          2HD1      ILE  51  -4.761 -11.797   7.933
  386   HD13  ILE  51          3HD1      ILE  51  -5.521 -13.179   7.146
  387    H    GLU  52           HN       GLU  52  -9.389 -11.326   8.187
  388    HA   GLU  52           HA       GLU  52 -10.578 -11.094  10.139
  389    HB2  GLU  52          2HB       GLU  52  -7.898 -10.050  10.414
  390    HB3  GLU  52          3HB       GLU  52  -8.991  -9.247  11.533
  391    HG2  GLU  52          2HG       GLU  52  -8.919 -12.231  11.298
  392    HG3  GLU  52          3HG       GLU  52  -7.779 -11.356  12.321
  393    H    LEU  53           HN       LEU  53 -12.392  -9.991   9.215
  394    HA   LEU  53           HA       LEU  53 -13.906  -8.302   9.002
  395    HB2  LEU  53          2HB       LEU  53 -12.594  -7.915  11.623
  396    HB3  LEU  53          3HB       LEU  53 -13.559  -6.568  11.021
  397    HG   LEU  53           HG       LEU  53 -15.542  -7.875  11.025
  398   HD11  LEU  53          1HD1      LEU  53 -15.597 -10.238  11.534
  399   HD12  LEU  53          2HD1      LEU  53 -13.845 -10.263  11.737
  400   HD13  LEU  53          3HD1      LEU  53 -14.544  -9.947  10.149
  401   HD21  LEU  53          1HD2      LEU  53 -15.587  -8.707  13.409
  402   HD22  LEU  53          2HD2      LEU  53 -15.082  -7.032  13.186
  403   HD23  LEU  53          3HD2      LEU  53 -13.878  -8.284  13.498
  Start of MODEL    5
    1    H1   SER   1           HN       SER   1   7.869  11.259  12.516
    2    HA   SER   1           HA       SER   1   7.727  10.022  10.606
    3    HB2  SER   1          2HB       SER   1   7.918  11.425   8.385
    4    HB3  SER   1          3HB       SER   1   6.473  11.545   9.390
    5    HG   SER   1           HG       SER   1   7.593  13.391  10.397
    6    H    ASP   2           HN       ASP   2   9.274   8.720   9.882
    7    HA   ASP   2           HA       ASP   2  11.913   9.878   9.270
    8    HB2  ASP   2          2HB       ASP   2  11.344   7.239  10.637
    9    HB3  ASP   2          3HB       ASP   2  12.940   7.818  10.168
   10    H    ARG   3           HN       ARG   3   9.283   8.234   8.091
   11    HA   ARG   3           HA       ARG   3   8.921   7.442   5.960
   12    HB2  ARG   3          2HB       ARG   3  11.860   7.119   5.479
   13    HB3  ARG   3          3HB       ARG   3  10.578   7.461   4.326
   14    HG2  ARG   3          2HG       ARG   3  10.697   9.600   6.195
   15    HG3  ARG   3          3HG       ARG   3  12.328   9.274   5.602
   16    HD2  ARG   3          2HD       ARG   3  11.797   9.815   3.441
   17    HD3  ARG   3          3HD       ARG   3  10.102   9.373   3.633
   18    HE   ARG   3           HE       ARG   3  11.312  11.937   4.198
   19   HH11  ARG   3          1HH1      ARG   3   8.575   9.842   4.686
   20   HH12  ARG   3          2HH1      ARG   3   7.491  11.134   5.078
   21   HH21  ARG   3          1HH2      ARG   3   9.894  13.647   4.713
   22   HH22  ARG   3          2HH2      ARG   3   8.241  13.298   5.093
   23    H    THR   4           HN       THR   4   8.370   5.728   7.692
   24    HA   THR   4           HA       THR   4   9.975   3.305   7.201
   25    HB   THR   4           HB       THR   4   8.114   3.022   9.396
   26    HG1  THR   4          1HG       THR   4   9.585   4.528  10.710
   27   HG21  THR   4          1HG2      THR   4  11.133   3.002   9.393
   28   HG22  THR   4          2HG2      THR   4  10.135   1.635   8.896
   29   HG23  THR   4          3HG2      THR   4  10.058   2.225  10.555
   30    H    CYS   5           HN       CYS   5   8.936   1.386   6.671
   31    HA   CYS   5           HA       CYS   5   6.679   1.553   5.042
   32    HB2  CYS   5          2HB       CYS   5   8.399  -0.271   5.001
   33    HB3  CYS   5          3HB       CYS   5   7.668  -0.927   6.462
   34    H    ALA   6           HN       ALA   6   4.532   0.889   5.311
   35    HA   ALA   6           HA       ALA   6   3.520   1.249   8.014
   36    HB1  ALA   6          1HB       ALA   6   1.942   2.342   6.900
   37    HB2  ALA   6          2HB       ALA   6   2.529   1.726   5.355
   38    HB3  ALA   6          3HB       ALA   6   1.368   0.789   6.293
   39    H    ARG   7           HN       ARG   7   4.731  -1.307   6.512
   40    HA   ARG   7           HA       ARG   7   2.810  -3.159   7.755
   41    HB2  ARG   7          2HB       ARG   7   4.383  -3.883   5.297
   42    HB3  ARG   7          3HB       ARG   7   2.964  -4.678   5.964
   43    HG2  ARG   7          2HG       ARG   7   3.001  -1.959   4.672
   44    HG3  ARG   7          3HG       ARG   7   2.447  -3.456   3.918
   45    HD2  ARG   7          2HD       ARG   7   1.124  -1.722   5.888
   46    HD3  ARG   7          3HD       ARG   7   0.430  -2.774   4.654
   47    HE   ARG   7           HE       ARG   7   0.823  -3.398   7.401
   48   HH11  ARG   7          1HH1      ARG   7   0.824  -4.779   4.205
   49   HH12  ARG   7          2HH1      ARG   7   0.420  -6.373   4.752
   50   HH21  ARG   7          1HH2      ARG   7   0.292  -5.491   8.133
   51   HH22  ARG   7          2HH2      ARG   7   0.117  -6.777   6.987
   52    H    CYS   8           HN       CYS   8   6.143  -2.567   6.758
   53    HA   CYS   8           HA       CYS   8   7.053  -4.722   8.530
   54    HB2  CYS   8          2HB       CYS   8   8.741  -3.127   6.600
   55    HB3  CYS   8          3HB       CYS   8   9.135  -4.664   7.363
   56    H    GLN   9           HN       GLN   9   6.868  -1.306   8.255
   57    HA   GLN   9           HA       GLN   9   7.532   0.405   9.598
   58    HB2  GLN   9          2HB       GLN   9   7.332  -1.926  11.392
   59    HB3  GLN   9          3HB       GLN   9   8.316  -0.602  12.002
   60    HG2  GLN   9          2HG       GLN   9   6.549   0.767  12.282
   61    HG3  GLN   9          3HG       GLN   9   5.702   0.146  10.867
   62   HE21  GLN   9          1HE2      GLN   9   4.444  -1.724  11.065
   63   HE22  GLN   9          2HE2      GLN   9   3.893  -2.287  12.603
   64    H    GLU  10           HN       GLU  10   9.476  -0.859   7.885
   65    HA   GLU  10           HA       GLU  10  11.945  -0.451   9.437
   66    HB2  GLU  10          2HB       GLU  10  11.197  -2.325   7.297
   67    HB3  GLU  10          3HB       GLU  10  12.769  -1.566   7.080
   68    HG2  GLU  10          2HG       GLU  10  13.201  -2.269   9.518
   69    HG3  GLU  10          3HG       GLU  10  11.829  -3.350   9.287
   70    H    SER  11           HN       SER  11  13.530   0.929   8.680
   71    HA   SER  11           HA       SER  11  12.894   3.296   7.549
   72    HB2  SER  11          2HB       SER  11  15.117   2.674   8.547
   73    HB3  SER  11          3HB       SER  11  15.529   1.908   7.012
   74    HG   SER  11           HG       SER  11  16.020   3.804   6.284
   75    H    LEU  12           HN       LEU  12  12.797   4.219   5.525
   76    HA   LEU  12           HA       LEU  12  12.384   2.338   3.326
   77    HB2  LEU  12          2HB       LEU  12  11.502   5.114   3.927
   78    HB3  LEU  12          3HB       LEU  12  11.625   4.624   2.238
   79    HG   LEU  12           HG       LEU  12   9.368   4.417   3.616
   80   HD11  LEU  12          1HD1      LEU  12  10.000   2.089   1.874
   81   HD12  LEU  12          2HD1      LEU  12  10.096   3.711   1.192
   82   HD13  LEU  12          3HD1      LEU  12   8.582   3.138   1.891
   83   HD21  LEU  12          1HD2      LEU  12  10.578   1.691   4.019
   84   HD22  LEU  12          2HD2      LEU  12   9.017   2.285   4.585
   85   HD23  LEU  12          3HD2      LEU  12  10.508   2.912   5.289
   86    H    GLY  13           HN       GLY  13  14.450   4.975   4.322
   87    HA2  GLY  13          1HA       GLY  13  16.168   6.070   3.196
   88    HA3  GLY  13          2HA       GLY  13  16.696   4.405   2.992
   89    H    ARG  14           HN       ARG  14  17.201   3.905   0.977
   90    HA   ARG  14           HA       ARG  14  16.463   5.571  -1.220
   91    HB2  ARG  14          2HB       ARG  14  18.143   3.168  -0.809
   92    HB3  ARG  14          3HB       ARG  14  17.488   3.386  -2.426
   93    HG2  ARG  14          2HG       ARG  14  19.815   4.378  -1.781
   94    HG3  ARG  14          3HG       ARG  14  18.708   5.281  -2.818
   95    HD2  ARG  14          2HD       ARG  14  18.453   5.694   0.102
   96    HD3  ARG  14          3HD       ARG  14  19.896   6.349  -0.673
   97    HE   ARG  14           HE       ARG  14  17.887   7.218  -2.263
   98   HH11  ARG  14          1HH1      ARG  14  18.470   7.377   1.166
   99   HH12  ARG  14          2HH1      ARG  14  17.620   8.872   1.373
  100   HH21  ARG  14          1HH2      ARG  14  16.765   9.187  -2.003
  101   HH22  ARG  14          2HH2      ARG  14  16.649   9.901  -0.430
  102    H    LEU  15           HN       LEU  15  14.083   5.233  -0.645
  103    HA   LEU  15           HA       LEU  15  13.052   2.925  -2.162
  104    HB2  LEU  15          2HB       LEU  15  12.308   4.031   0.450
  105    HB3  LEU  15          3HB       LEU  15  10.945   3.709  -0.619
  106    HG   LEU  15           HG       LEU  15  11.910   1.908   1.100
  107   HD11  LEU  15          1HD1      LEU  15   9.910   1.502  -0.067
  108   HD12  LEU  15          2HD1      LEU  15  10.977   0.164  -0.493
  109   HD13  LEU  15          3HD1      LEU  15  10.727   1.489  -1.630
  110   HD21  LEU  15          1HD2      LEU  15  13.257   1.042  -1.429
  111   HD22  LEU  15          2HD2      LEU  15  13.482   0.450   0.216
  112   HD23  LEU  15          3HD2      LEU  15  14.115   2.030  -0.246
  113    H    SER  16           HN       SER  16  12.699   6.341  -1.407
  114    HA   SER  16           HA       SER  16  11.986   8.044  -2.784
  115    HB2  SER  16          2HB       SER  16  12.498   6.302  -4.670
  116    HB3  SER  16          3HB       SER  16  10.746   6.106  -4.711
  117    HG   SER  16           HG       SER  16  10.749   8.510  -4.883
  118    HA   PRO  17           HA       PRO  17   7.934   7.261  -0.725
  119    HB2  PRO  17          2HB       PRO  17   7.951   9.591   0.669
  120    HB3  PRO  17          3HB       PRO  17   8.745   8.120   1.246
  121    HG2  PRO  17          2HG       PRO  17   9.934  10.500  -0.129
  122    HG3  PRO  17          3HG       PRO  17  10.549   9.588   1.262
  123    HD2  PRO  17          2HD       PRO  17  11.492   9.226  -1.251
  124    HD3  PRO  17          3HD       PRO  17  11.414   7.911  -0.061
  125    H    LYS  18           HN       LYS  18   9.139   9.306  -3.054
  126    HA   LYS  18           HA       LYS  18   7.214  11.326  -3.268
  127    HB2  LYS  18          2HB       LYS  18   9.193  11.523  -4.566
  128    HB3  LYS  18          3HB       LYS  18   8.943   9.954  -5.322
  129    HG2  LYS  18          2HG       LYS  18   8.470  11.840  -6.831
  130    HG3  LYS  18          3HG       LYS  18   7.066  10.801  -6.570
  131    HD2  LYS  18          2HD       LYS  18   6.036  12.372  -5.151
  132    HD3  LYS  18          3HD       LYS  18   7.529  13.293  -4.954
  133    HE2  LYS  18          2HE       LYS  18   6.746  13.081  -7.736
  134    HE3  LYS  18          3HE       LYS  18   5.477  13.810  -6.752
  135    HZ1  LYS  18          1HZ       LYS  18   7.201  15.356  -7.739
  136    HZ2  LYS  18          2HZ       LYS  18   8.285  14.726  -6.605
  137    HZ3  LYS  18          3HZ       LYS  18   6.890  15.530  -6.086
  138    H    THR  19           HN       THR  19   7.214   7.997  -4.406
  139    HA   THR  19           HA       THR  19   4.354   8.275  -5.013
  140    HB   THR  19           HB       THR  19   5.140   8.264  -7.197
  141    HG1  THR  19          1HG       THR  19   4.335   6.399  -7.932
  142   HG21  THR  19          1HG2      THR  19   6.965   6.616  -7.917
  143   HG22  THR  19          2HG2      THR  19   7.296   6.424  -6.196
  144   HG23  THR  19          3HG2      THR  19   7.462   8.007  -6.954
  145    H    ASN  20           HN       ASN  20   6.618   6.814  -3.187
  146    HA   ASN  20           HA       ASN  20   5.535   4.123  -3.243
  147    HB2  ASN  20          2HB       ASN  20   7.689   5.428  -1.572
  148    HB3  ASN  20          3HB       ASN  20   7.184   3.754  -1.363
  149   HD21  ASN  20          1HD2      ASN  20   9.351   3.168  -1.861
  150   HD22  ASN  20          2HD2      ASN  20   9.887   3.112  -3.502
  151    H    THR  21           HN       THR  21   3.781   6.334  -2.505
  152    HA   THR  21           HA       THR  21   3.162   5.566   0.274
  153    HB   THR  21           HB       THR  21   2.507   8.159  -1.140
  154    HG1  THR  21          1HG       THR  21   4.534   8.442  -0.473
  155   HG21  THR  21          1HG2      THR  21   2.097   7.703   1.783
  156   HG22  THR  21          2HG2      THR  21   0.878   7.128   0.645
  157   HG23  THR  21          3HG2      THR  21   1.297   8.840   0.699
  158    H    CYS  22           HN       CYS  22   1.683   3.977   0.075
  159    HA   CYS  22           HA       CYS  22  -0.086   3.363  -1.845
  160    HB2  CYS  22          2HB       CYS  22   0.166   2.119   0.285
  161    HB3  CYS  22          3HB       CYS  22  -0.775   3.362   1.102
  162    H    ARG  23           HN       ARG  23  -1.755   4.272  -2.851
  163    HA   ARG  23           HA       ARG  23  -2.670   6.879  -2.037
  164    HB2  ARG  23          2HB       ARG  23  -4.164   5.561  -4.186
  165    HB3  ARG  23          3HB       ARG  23  -3.337   7.114  -4.175
  166    HG2  ARG  23          2HG       ARG  23  -1.178   5.715  -4.329
  167    HG3  ARG  23          3HG       ARG  23  -2.252   4.407  -4.830
  168    HD2  ARG  23          2HD       ARG  23  -2.674   5.348  -6.838
  169    HD3  ARG  23          3HD       ARG  23  -2.675   6.986  -6.185
  170    HE   ARG  23           HE       ARG  23  -0.419   5.540  -7.275
  171   HH11  ARG  23          1HH1      ARG  23  -1.503   8.237  -5.361
  172   HH12  ARG  23          2HH1      ARG  23  -0.043   9.146  -5.578
  173   HH21  ARG  23          1HH2      ARG  23   1.507   6.727  -7.569
  174   HH22  ARG  23          2HH2      ARG  23   1.668   8.286  -6.835
  175    H    GLY  24           HN       GLY  24  -3.347   4.111  -0.693
  176    HA2  GLY  24          1HA       GLY  24  -6.270   4.476  -0.615
  177    HA3  GLY  24          2HA       GLY  24  -5.421   3.005  -0.164
  178    H    CYS  25           HN       CYS  25  -3.504   3.893   1.548
  179    HA   CYS  25           HA       CYS  25  -5.125   4.918   3.776
  180    HB2  CYS  25          2HB       CYS  25  -3.199   3.920   5.163
  181    HB3  CYS  25          3HB       CYS  25  -4.313   2.801   4.383
  182    H    ASN  26           HN       ASN  26  -2.443   5.612   1.758
  183    HA   ASN  26           HA       ASN  26  -1.261   7.568   1.539
  184    HB2  ASN  26          2HB       ASN  26  -2.283   8.544   4.191
  185    HB3  ASN  26          3HB       ASN  26  -1.788   9.481   2.785
  186   HD21  ASN  26          1HD2      ASN  26  -3.282   7.647   0.997
  187   HD22  ASN  26          2HD2      ASN  26  -4.939   8.107   1.165
  188    H    HIS  27           HN       HIS  27  -0.367   5.152   2.866
  189    HA   HIS  27           HA       HIS  27   1.711   6.305   4.612
  190    HB2  HIS  27          2HB       HIS  27   0.426   3.572   4.770
  191    HB3  HIS  27          3HB       HIS  27   1.815   4.076   5.727
  192    HD1  HIS  27          1HD       HIS  27   0.911   6.835   6.652
  193    HD2  HIS  27          2HD       HIS  27  -1.566   3.500   6.610
  194    HE1  HIS  27          1HE       HIS  27  -0.897   7.319   8.331
  195    H    LEU  28           HN       LEU  28   3.778   5.142   4.588
  196    HA   LEU  28           HA       LEU  28   4.598   4.597   1.898
  197    HB2  LEU  28          2HB       LEU  28   6.067   4.447   4.524
  198    HB3  LEU  28          3HB       LEU  28   6.823   4.183   2.954
  199    HG   LEU  28           HG       LEU  28   5.513   6.759   3.821
  200   HD11  LEU  28          1HD1      LEU  28   8.457   6.287   3.494
  201   HD12  LEU  28          2HD1      LEU  28   7.643   6.034   5.037
  202   HD13  LEU  28          3HD1      LEU  28   7.630   7.629   4.286
  203   HD21  LEU  28          1HD2      LEU  28   6.610   7.685   1.842
  204   HD22  LEU  28          2HD2      LEU  28   5.474   6.407   1.410
  205   HD23  LEU  28          3HD2      LEU  28   7.208   6.080   1.420
  206    H    VAL  29           HN       VAL  29   5.533   2.669   1.106
  207    HA   VAL  29           HA       VAL  29   5.346   0.242   2.670
  208    HB   VAL  29           HB       VAL  29   4.006  -0.332   0.201
  209   HG11  VAL  29          1HG1      VAL  29   2.645  -1.601   1.545
  210   HG12  VAL  29          2HG1      VAL  29   4.068  -1.448   2.578
  211   HG13  VAL  29          3HG1      VAL  29   2.659  -0.424   2.857
  212   HG21  VAL  29          1HG2      VAL  29   2.630   1.736   1.914
  213   HG22  VAL  29          2HG2      VAL  29   3.284   2.018   0.300
  214   HG23  VAL  29          3HG2      VAL  29   1.938   0.900   0.524
  215    H    CYS  30           HN       CYS  30   7.152  -0.821   2.238
  216    HA   CYS  30           HA       CYS  30   9.007  -0.246   0.309
  217    HB2  CYS  30          2HB       CYS  30   9.923  -2.509   0.690
  218    HB3  CYS  30          3HB       CYS  30   9.496  -1.707   2.198
  219    H    ARG  31           HN       ARG  31   9.751  -1.951  -1.407
  220    HA   ARG  31           HA       ARG  31   7.624  -2.082  -3.355
  221    HB2  ARG  31          2HB       ARG  31   9.424  -2.918  -4.869
  222    HB3  ARG  31          3HB       ARG  31   9.780  -1.362  -4.131
  223    HG2  ARG  31          2HG       ARG  31  11.511  -2.173  -2.920
  224    HG3  ARG  31          3HG       ARG  31  10.768  -3.760  -2.716
  225    HD2  ARG  31          2HD       ARG  31  11.249  -3.528  -5.453
  226    HD3  ARG  31          3HD       ARG  31  12.685  -2.858  -4.679
  227    HE   ARG  31           HE       ARG  31  11.969  -5.308  -3.464
  228   HH11  ARG  31          1HH1      ARG  31  13.375  -4.004  -6.370
  229   HH12  ARG  31          2HH1      ARG  31  14.320  -5.418  -6.703
  230   HH21  ARG  31          1HH2      ARG  31  13.207  -7.175  -3.892
  231   HH22  ARG  31          2HH2      ARG  31  14.223  -7.222  -5.293
  232    H    ASP  32           HN       ASP  32   7.900  -3.905  -0.877
  233    HA   ASP  32           HA       ASP  32   7.468  -6.429  -2.336
  234    HB2  ASP  32          2HB       ASP  32   9.588  -6.279  -0.895
  235    HB3  ASP  32          3HB       ASP  32   8.503  -6.300   0.491
  236    H    CYS  33           HN       CYS  33   6.173  -4.073  -0.318
  237    HA   CYS  33           HA       CYS  33   4.120  -5.899   0.731
  238    HB2  CYS  33          2HB       CYS  33   5.024  -3.155   1.598
  239    HB3  CYS  33          3HB       CYS  33   3.528  -3.878   2.178
  240    H    ARG  34           HN       ARG  34   4.488  -4.424  -1.992
  241    HA   ARG  34           HA       ARG  34   1.877  -3.078  -2.056
  242    HB2  ARG  34          2HB       ARG  34   3.565  -2.968  -4.465
  243    HB3  ARG  34          3HB       ARG  34   2.685  -1.686  -3.645
  244    HG2  ARG  34          2HG       ARG  34   4.438  -1.431  -2.030
  245    HG3  ARG  34          3HG       ARG  34   5.288  -2.839  -2.672
  246    HD2  ARG  34          2HD       ARG  34   5.912  -1.728  -4.620
  247    HD3  ARG  34          3HD       ARG  34   4.661  -0.499  -4.431
  248    HE   ARG  34           HE       ARG  34   6.206  -0.036  -2.298
  249   HH11  ARG  34          1HH1      ARG  34   6.990  -0.526  -5.654
  250   HH12  ARG  34          2HH1      ARG  34   8.402   0.475  -5.605
  251   HH21  ARG  34          1HH2      ARG  34   8.066   1.285  -2.221
  252   HH22  ARG  34          2HH2      ARG  34   9.015   1.504  -3.651
  253    H    ILE  35           HN       ILE  35   0.242  -3.783  -3.343
  254    HA   ILE  35           HA       ILE  35   0.672  -6.361  -4.693
  255    HB   ILE  35           HB       ILE  35  -1.723  -5.161  -3.353
  256   HG12  ILE  35          2HG1      ILE  35  -1.831  -7.457  -2.373
  257   HG13  ILE  35          3HG1      ILE  35  -0.366  -7.863  -3.261
  258   HG21  ILE  35          1HG2      ILE  35  -1.702  -6.910  -5.727
  259   HG22  ILE  35          2HG2      ILE  35  -2.787  -7.385  -4.421
  260   HG23  ILE  35          3HG2      ILE  35  -2.934  -5.787  -5.153
  261   HD11  ILE  35          1HD1      ILE  35  -0.342  -5.501  -1.457
  262   HD12  ILE  35          2HD1      ILE  35  -0.263  -7.120  -0.761
  263   HD13  ILE  35          3HD1      ILE  35   0.967  -6.593  -1.910
  264    H    GLN  36           HN       GLN  36   0.768  -6.296  -6.831
  265    HA   GLN  36           HA       GLN  36   0.263  -4.050  -8.400
  266    HB2  GLN  36          2HB       GLN  36   0.379  -6.972  -9.151
  267    HB3  GLN  36          3HB       GLN  36   0.301  -5.667 -10.327
  268    HG2  GLN  36          2HG       GLN  36   2.590  -6.718  -9.637
  269    HG3  GLN  36          3HG       GLN  36   2.441  -4.986  -9.929
  270   HE21  GLN  36          1HE2      GLN  36   2.529  -3.562  -8.202
  271   HE22  GLN  36          2HE2      GLN  36   3.105  -4.035  -6.643
  272    H    GLU  37           HN       GLU  37  -1.642  -3.075  -8.604
  273    HA   GLU  37           HA       GLU  37  -4.102  -4.635  -8.576
  274    HB2  GLU  37          2HB       GLU  37  -3.676  -1.642  -8.681
  275    HB3  GLU  37          3HB       GLU  37  -5.230  -2.447  -8.503
  276    HG2  GLU  37          2HG       GLU  37  -2.957  -2.699  -6.549
  277    HG3  GLU  37          3HG       GLU  37  -4.294  -1.561  -6.387
  278    H    SER  38           HN       SER  38  -5.688  -4.500 -10.222
  279    HA   SER  38           HA       SER  38  -4.533  -4.232 -12.878
  280    HB2  SER  38          2HB       SER  38  -6.867  -5.620 -11.701
  281    HB3  SER  38          3HB       SER  38  -7.080  -5.023 -13.347
  282    HG   SER  38           HG       SER  38  -5.824  -7.206 -12.580
  283    H    ASN  39           HN       ASN  39  -5.430  -1.960 -11.002
  284    HA   ASN  39           HA       ASN  39  -7.366  -0.648 -12.773
  285    HB2  ASN  39          2HB       ASN  39  -7.109  -0.730  -9.979
  286    HB3  ASN  39          3HB       ASN  39  -6.644   0.904 -10.444
  287   HD21  ASN  39          1HD2      ASN  39  -8.600   1.424  -9.208
  288   HD22  ASN  39          2HD2      ASN  39 -10.121   1.403 -10.029
  289    H    GLY  40           HN       GLY  40  -4.097  -0.889 -12.411
  290    HA2  GLY  40          1HA       GLY  40  -2.631   0.314 -13.869
  291    HA3  GLY  40          2HA       GLY  40  -3.701   1.702 -13.742
  292    H    THR  41           HN       THR  41  -3.092   0.110 -10.793
  293    HA   THR  41           HA       THR  41  -0.777   1.742 -10.131
  294    HB   THR  41           HB       THR  41  -2.884   3.111  -9.676
  295    HG1  THR  41          1HG       THR  41  -1.571   4.065  -8.328
  296   HG21  THR  41          1HG2      THR  41  -3.975   0.962  -8.637
  297   HG22  THR  41          2HG2      THR  41  -4.329   2.555  -7.967
  298   HG23  THR  41          3HG2      THR  41  -3.155   1.504  -7.174
  299    H    TRP  42           HN       TRP  42  -1.083   1.442  -7.306
  300    HA   TRP  42           HA       TRP  42  -1.229  -1.439  -6.866
  301    HB2  TRP  42          2HB       TRP  42   0.973  -1.544  -5.830
  302    HB3  TRP  42          3HB       TRP  42   1.120  -0.981  -7.492
  303    HD1  TRP  42          1HD       TRP  42   2.287   1.306  -7.873
  304    HE1  TRP  42          1HE       TRP  42   3.301   3.094  -6.324
  305    HE3  TRP  42          3HE       TRP  42   0.578  -0.446  -3.384
  306    HZ2  TRP  42          2HZ       TRP  42   3.368   3.683  -3.564
  307    HZ3  TRP  42          3HZ       TRP  42   1.162   0.787  -1.337
  308    HH2  TRP  42          2HH       TRP  42   2.530   2.808  -1.427
  309    H    ARG  43           HN       ARG  43  -1.383  -2.033  -4.639
  310    HA   ARG  43           HA       ARG  43  -1.774   0.150  -2.732
  311    HB2  ARG  43          2HB       ARG  43  -3.856  -1.846  -3.571
  312    HB3  ARG  43          3HB       ARG  43  -3.890  -1.139  -1.963
  313    HG2  ARG  43          2HG       ARG  43  -3.609   0.797  -4.148
  314    HG3  ARG  43          3HG       ARG  43  -5.129  -0.100  -4.133
  315    HD2  ARG  43          2HD       ARG  43  -4.529   0.692  -1.469
  316    HD3  ARG  43          3HD       ARG  43  -4.349   2.099  -2.516
  317    HE   ARG  43           HE       ARG  43  -6.783   0.844  -1.756
  318   HH11  ARG  43          1HH1      ARG  43  -5.219   2.495  -4.392
  319   HH12  ARG  43          2HH1      ARG  43  -6.700   3.080  -5.075
  320   HH21  ARG  43          1HH2      ARG  43  -8.739   1.609  -2.645
  321   HH22  ARG  43          2HH2      ARG  43  -8.701   2.577  -4.080
  322    H    CYS  44           HN       CYS  44  -1.288  -0.369  -0.639
  323    HA   CYS  44           HA       CYS  44   0.494  -2.374  -0.067
  324    HB2  CYS  44          2HB       CYS  44   0.145  -1.899   2.257
  325    HB3  CYS  44          3HB       CYS  44  -0.036  -0.387   1.373
  326    H    LYS  45           HN       LYS  45   0.243  -4.242   1.415
  327    HA   LYS  45           HA       LYS  45  -1.663  -6.069   0.390
  328    HB2  LYS  45          2HB       LYS  45  -0.352  -6.670   2.982
  329    HB3  LYS  45          3HB       LYS  45  -0.516  -7.671   1.545
  330    HG2  LYS  45          2HG       LYS  45   1.169  -5.947   0.524
  331    HG3  LYS  45          3HG       LYS  45   1.556  -5.643   2.218
  332    HD2  LYS  45          2HD       LYS  45   3.058  -7.315   1.668
  333    HD3  LYS  45          3HD       LYS  45   1.725  -8.233   2.372
  334    HE2  LYS  45          2HE       LYS  45   0.862  -8.683   0.120
  335    HE3  LYS  45          3HE       LYS  45   2.209  -7.782  -0.572
  336    HZ1  LYS  45          1HZ       LYS  45   3.228  -9.716   1.184
  337    HZ2  LYS  45          2HZ       LYS  45   3.436  -9.603  -0.490
  338    HZ3  LYS  45          3HZ       LYS  45   2.133 -10.477   0.143
  339    H    VAL  46           HN       VAL  46  -1.979  -3.642   2.658
  340    HA   VAL  46           HA       VAL  46  -4.026  -5.027   4.224
  341    HB   VAL  46           HB       VAL  46  -3.092  -2.180   4.570
  342   HG11  VAL  46          1HG1      VAL  46  -5.054  -2.401   5.774
  343   HG12  VAL  46          2HG1      VAL  46  -4.741  -4.090   6.175
  344   HG13  VAL  46          3HG1      VAL  46  -3.834  -2.809   6.978
  345   HG21  VAL  46          1HG2      VAL  46  -1.267  -3.972   4.703
  346   HG22  VAL  46          2HG2      VAL  46  -1.434  -2.870   6.071
  347   HG23  VAL  46          3HG2      VAL  46  -2.082  -4.507   6.173
  348    H    CYS  47           HN       CYS  47  -3.716  -2.908   1.562
  349    HA   CYS  47           HA       CYS  47  -6.525  -2.071   1.788
  350    HB2  CYS  47          2HB       CYS  47  -4.195  -0.949   0.237
  351    HB3  CYS  47          3HB       CYS  47  -5.857  -0.477  -0.100
  352    H    ALA  48           HN       ALA  48  -4.235  -3.807  -0.199
  353    HA   ALA  48           HA       ALA  48  -6.089  -4.176  -2.382
  354    HB1  ALA  48          1HB       ALA  48  -3.285  -4.529  -1.964
  355    HB2  ALA  48          2HB       ALA  48  -3.975  -6.025  -2.595
  356    HB3  ALA  48          3HB       ALA  48  -4.190  -4.512  -3.478
  357    H    LYS  49           HN       LYS  49  -5.259  -5.801   0.547
  358    HA   LYS  49           HA       LYS  49  -5.755  -8.427   0.169
  359    HB2  LYS  49          2HB       LYS  49  -6.010  -6.590   2.370
  360    HB3  LYS  49          3HB       LYS  49  -7.308  -7.775   2.432
  361    HG2  LYS  49          2HG       LYS  49  -5.679  -9.583   2.368
  362    HG3  LYS  49          3HG       LYS  49  -4.368  -8.406   2.272
  363    HD2  LYS  49          2HD       LYS  49  -4.374  -8.843   4.526
  364    HD3  LYS  49          3HD       LYS  49  -5.480  -7.469   4.463
  365    HE2  LYS  49          2HE       LYS  49  -6.786  -8.854   5.686
  366    HE3  LYS  49          3HE       LYS  49  -7.233  -9.459   4.091
  367    HZ1  LYS  49          1HZ       LYS  49  -6.215 -10.937   6.144
  368    HZ2  LYS  49          2HZ       LYS  49  -4.887 -10.730   5.118
  369    HZ3  LYS  49          3HZ       LYS  49  -6.313 -11.420   4.526
  370    H    GLU  50           HN       GLU  50  -8.480  -6.589   1.469
  371    HA   GLU  50           HA       GLU  50 -10.227  -7.231  -0.709
  372    HB2  GLU  50          2HB       GLU  50  -9.881  -9.287   1.059
  373    HB3  GLU  50          3HB       GLU  50 -11.275  -8.466   1.745
  374    HG2  GLU  50          2HG       GLU  50 -12.627  -8.996   0.003
  375    HG3  GLU  50          3HG       GLU  50 -11.308  -8.995  -1.166
  376    H    ILE  51           HN       ILE  51 -10.446  -4.935  -0.536
  377    HA   ILE  51           HA       ILE  51 -12.634  -4.167   1.168
  378    HB   ILE  51           HB       ILE  51 -11.138  -3.596   2.826
  379   HG12  ILE  51          2HG1      ILE  51 -11.027  -1.101   1.125
  380   HG13  ILE  51          3HG1      ILE  51 -12.464  -1.613   2.004
  381   HG21  ILE  51          1HG2      ILE  51  -8.991  -2.192   1.776
  382   HG22  ILE  51          2HG2      ILE  51  -8.979  -3.857   2.352
  383   HG23  ILE  51          3HG2      ILE  51  -9.241  -3.519   0.642
  384   HD11  ILE  51          1HD1      ILE  51 -10.090  -0.244   2.946
  385   HD12  ILE  51          2HD1      ILE  51 -11.690  -0.380   3.678
  386   HD13  ILE  51          3HD1      ILE  51 -10.496  -1.654   3.926
  387    H    GLU  52           HN       GLU  52 -13.912  -2.860   0.040
  388    HA   GLU  52           HA       GLU  52 -12.717  -1.283  -2.143
  389    HB2  GLU  52          2HB       GLU  52 -14.910  -3.167  -2.144
  390    HB3  GLU  52          3HB       GLU  52 -15.452  -1.586  -2.685
  391    HG2  GLU  52          2HG       GLU  52 -12.929  -2.411  -3.884
  392    HG3  GLU  52          3HG       GLU  52 -14.269  -3.497  -4.244
  393    H    LEU  53           HN       LEU  53 -13.168   0.849  -2.251
  394    HA   LEU  53           HA       LEU  53 -14.284   2.137   0.021
  395    HB2  LEU  53          2HB       LEU  53 -12.530   2.906  -1.826
  396    HB3  LEU  53          3HB       LEU  53 -13.981   3.611  -2.536
  397    HG   LEU  53           HG       LEU  53 -13.250   5.390  -1.320
  398   HD11  LEU  53          1HD1      LEU  53 -14.659   5.711   0.497
  399   HD12  LEU  53          2HD1      LEU  53 -14.562   4.024   1.001
  400   HD13  LEU  53          3HD1      LEU  53 -15.488   4.464  -0.434
  401   HD21  LEU  53          1HD2      LEU  53 -11.476   5.215  -0.001
  402   HD22  LEU  53          2HD2      LEU  53 -11.607   3.458  -0.086
  403   HD23  LEU  53          3HD2      LEU  53 -12.421   4.343   1.205
  Start of MODEL    6
    1    H1   SER   1           HN       SER   1   7.241   9.924  11.725
    2    HA   SER   1           HA       SER   1   7.697  11.014   9.483
    3    HB2  SER   1          2HB       SER   1   8.266  12.080  12.143
    4    HB3  SER   1          3HB       SER   1   9.180  12.899  10.876
    5    HG   SER   1           HG       SER   1   7.223  13.927  11.049
    6    H    ASP   2           HN       ASP   2   9.658   8.824   9.910
    7    HA   ASP   2           HA       ASP   2  12.067  10.193   8.902
    8    HB2  ASP   2          2HB       ASP   2  11.817   7.620  10.468
    9    HB3  ASP   2          3HB       ASP   2  13.306   8.148   9.691
   10    H    ARG   3           HN       ARG   3   9.482   8.637   7.816
   11    HA   ARG   3           HA       ARG   3   9.020   7.733   5.764
   12    HB2  ARG   3          2HB       ARG   3  11.961   7.448   5.208
   13    HB3  ARG   3          3HB       ARG   3  10.640   7.638   4.062
   14    HG2  ARG   3          2HG       ARG   3  10.967   9.872   5.932
   15    HG3  ARG   3          3HG       ARG   3  12.320   9.619   4.828
   16    HD2  ARG   3          2HD       ARG   3   9.870   9.362   3.382
   17    HD3  ARG   3          3HD       ARG   3   9.840  10.865   4.303
   18    HE   ARG   3           HE       ARG   3  12.319  10.649   3.012
   19   HH11  ARG   3          1HH1      ARG   3   8.952  11.126   2.265
   20   HH12  ARG   3          2HH1      ARG   3   9.266  12.035   0.825
   21   HH21  ARG   3          1HH2      ARG   3  12.745  11.845   1.118
   22   HH22  ARG   3          2HH2      ARG   3  11.424  12.442   0.172
   23    H    THR   4           HN       THR   4   8.542   6.059   7.556
   24    HA   THR   4           HA       THR   4  10.093   3.612   7.011
   25    HB   THR   4           HB       THR   4   8.392   3.475   9.373
   26    HG1  THR   4          1HG       THR   4   8.923   5.651   9.627
   27   HG21  THR   4          1HG2      THR   4  10.062   1.812   8.977
   28   HG22  THR   4          2HG2      THR   4  10.577   2.748  10.381
   29   HG23  THR   4          3HG2      THR   4  11.321   3.035   8.808
   30    H    CYS   5           HN       CYS   5   8.973   1.670   6.685
   31    HA   CYS   5           HA       CYS   5   6.591   1.842   5.224
   32    HB2  CYS   5          2HB       CYS   5   8.309  -0.006   5.115
   33    HB3  CYS   5          3HB       CYS   5   7.627  -0.634   6.611
   34    H    ALA   6           HN       ALA   6   4.467   1.295   5.696
   35    HA   ALA   6           HA       ALA   6   3.724   1.638   8.491
   36    HB1  ALA   6          1HB       ALA   6   2.364   1.969   5.885
   37    HB2  ALA   6          2HB       ALA   6   1.358   1.503   7.258
   38    HB3  ALA   6          3HB       ALA   6   2.318   2.981   7.330
   39    H    ARG   7           HN       ARG   7   4.544  -0.923   6.657
   40    HA   ARG   7           HA       ARG   7   2.661  -2.713   8.047
   41    HB2  ARG   7          2HB       ARG   7   4.025  -3.352   5.435
   42    HB3  ARG   7          3HB       ARG   7   2.698  -4.214   6.199
   43    HG2  ARG   7          2HG       ARG   7   2.574  -1.454   5.003
   44    HG3  ARG   7          3HG       ARG   7   1.907  -2.931   4.308
   45    HD2  ARG   7          2HD       ARG   7   0.990  -1.375   6.692
   46    HD3  ARG   7          3HD       ARG   7   0.059  -1.941   5.305
   47    HE   ARG   7           HE       ARG   7   0.792  -4.246   6.451
   48   HH11  ARG   7          1HH1      ARG   7  -0.596  -1.341   7.776
   49   HH12  ARG   7          2HH1      ARG   7  -1.433  -2.166   9.049
   50   HH21  ARG   7          1HH2      ARG   7  -0.304  -5.343   8.124
   51   HH22  ARG   7          2HH2      ARG   7  -1.265  -4.442   9.247
   52    H    CYS   8           HN       CYS   8   5.959  -2.164   6.970
   53    HA   CYS   8           HA       CYS   8   6.858  -4.468   8.561
   54    HB2  CYS   8          2HB       CYS   8   8.439  -2.861   6.545
   55    HB3  CYS   8          3HB       CYS   8   8.928  -4.370   7.308
   56    H    GLN   9           HN       GLN   9   6.867  -1.028   8.395
   57    HA   GLN   9           HA       GLN   9   7.649   0.584   9.795
   58    HB2  GLN   9          2HB       GLN   9   7.585  -1.838  11.508
   59    HB3  GLN   9          3HB       GLN   9   8.522  -0.474  12.102
   60    HG2  GLN   9          2HG       GLN   9   6.052  -0.688  12.785
   61    HG3  GLN   9          3HG       GLN   9   6.670   0.889  12.295
   62   HE21  GLN   9          1HE2      GLN   9   5.561  -1.962  10.497
   63   HE22  GLN   9          2HE2      GLN   9   4.383  -1.122   9.555
   64    H    GLU  10           HN       GLU  10   9.429  -0.717   7.904
   65    HA   GLU  10           HA       GLU  10  12.011  -0.496   9.292
   66    HB2  GLU  10          2HB       GLU  10  11.042  -2.084   6.998
   67    HB3  GLU  10          3HB       GLU  10  12.662  -1.423   6.829
   68    HG2  GLU  10          2HG       GLU  10  11.753  -3.063   9.179
   69    HG3  GLU  10          3HG       GLU  10  12.571  -3.724   7.765
   70    H    SER  11           HN       SER  11  13.776   0.563   8.101
   71    HA   SER  11           HA       SER  11  13.078   3.169   7.324
   72    HB2  SER  11          2HB       SER  11  15.510   3.253   6.519
   73    HB3  SER  11          3HB       SER  11  15.249   2.872   8.221
   74    HG   SER  11           HG       SER  11  16.496   1.236   7.733
   75    H    LEU  12           HN       LEU  12  12.857   4.160   5.369
   76    HA   LEU  12           HA       LEU  12  12.372   2.414   3.095
   77    HB2  LEU  12          2HB       LEU  12  11.769   5.272   3.734
   78    HB3  LEU  12          3HB       LEU  12  11.698   4.705   2.066
   79    HG   LEU  12           HG       LEU  12   9.581   4.754   3.717
   80   HD11  LEU  12          1HD1      LEU  12  10.322   3.287   1.295
   81   HD12  LEU  12          2HD1      LEU  12   8.899   4.270   1.641
   82   HD13  LEU  12          3HD1      LEU  12   8.964   2.591   2.180
   83   HD21  LEU  12          1HD2      LEU  12   9.120   2.644   4.674
   84   HD22  LEU  12          2HD2      LEU  12  10.750   3.070   5.198
   85   HD23  LEU  12          3HD2      LEU  12  10.519   1.901   3.896
   86    H    GLY  13           HN       GLY  13  15.109   2.829   3.985
   87    HA2  GLY  13          1HA       GLY  13  16.673   4.626   2.710
   88    HA3  GLY  13          2HA       GLY  13  17.130   2.936   2.859
   89    H    ARG  14           HN       ARG  14  16.913   5.337   0.706
   90    HA   ARG  14           HA       ARG  14  16.439   5.504  -1.552
   91    HB2  ARG  14          2HB       ARG  14  18.675   4.687  -1.599
   92    HB3  ARG  14          3HB       ARG  14  18.155   3.044  -1.250
   93    HG2  ARG  14          2HG       ARG  14  17.621   2.609  -3.398
   94    HG3  ARG  14          3HG       ARG  14  17.075   4.258  -3.711
   95    HD2  ARG  14          2HD       ARG  14  18.998   4.651  -4.749
   96    HD3  ARG  14          3HD       ARG  14  19.834   4.423  -3.213
   97    HE   ARG  14           HE       ARG  14  19.520   1.897  -4.103
   98   HH11  ARG  14          1HH1      ARG  14  20.783   4.790  -5.571
   99   HH12  ARG  14          2HH1      ARG  14  21.898   3.942  -6.592
  100   HH21  ARG  14          1HH2      ARG  14  20.983   0.769  -5.441
  101   HH22  ARG  14          2HH2      ARG  14  22.010   1.655  -6.517
  102    H    LEU  15           HN       LEU  15  14.102   4.950  -0.973
  103    HA   LEU  15           HA       LEU  15  13.321   2.524  -2.450
  104    HB2  LEU  15          2HB       LEU  15  12.897   2.910   0.202
  105    HB3  LEU  15          3HB       LEU  15  11.410   3.571  -0.476
  106    HG   LEU  15           HG       LEU  15  12.233   0.898  -1.444
  107   HD11  LEU  15          1HD1      LEU  15  12.680   0.950   1.056
  108   HD12  LEU  15          2HD1      LEU  15  11.566  -0.285   0.472
  109   HD13  LEU  15          3HD1      LEU  15  10.942   1.167   1.254
  110   HD21  LEU  15          1HD2      LEU  15   9.815   0.519  -1.295
  111   HD22  LEU  15          2HD2      LEU  15  10.196   1.963  -2.236
  112   HD23  LEU  15          3HD2      LEU  15   9.614   2.118  -0.577
  113    H    SER  16           HN       SER  16  12.827   5.903  -1.848
  114    HA   SER  16           HA       SER  16  11.896   7.479  -3.246
  115    HB2  SER  16          2HB       SER  16  12.225   5.620  -5.052
  116    HB3  SER  16          3HB       SER  16  10.492   5.363  -4.847
  117    HG   SER  16           HG       SER  16  11.575   7.927  -5.332
  118    HA   PRO  17           HA       PRO  17   8.155   6.732  -0.637
  119    HB2  PRO  17          2HB       PRO  17   8.312   9.113   0.655
  120    HB3  PRO  17          3HB       PRO  17   9.190   7.674   1.184
  121    HG2  PRO  17          2HG       PRO  17  10.168  10.009  -0.414
  122    HG3  PRO  17          3HG       PRO  17  10.963   9.157   0.923
  123    HD2  PRO  17          2HD       PRO  17  11.594   8.706  -1.671
  124    HD3  PRO  17          3HD       PRO  17  11.681   7.437  -0.433
  125    H    LYS  18           HN       LYS  18   9.040   8.705  -3.166
  126    HA   LYS  18           HA       LYS  18   6.840  10.539  -3.146
  127    HB2  LYS  18          2HB       LYS  18   9.009  10.986  -4.291
  128    HB3  LYS  18          3HB       LYS  18   8.609   9.735  -5.462
  129    HG2  LYS  18          2HG       LYS  18   8.092  11.828  -6.448
  130    HG3  LYS  18          3HG       LYS  18   6.561  11.048  -6.040
  131    HD2  LYS  18          2HD       LYS  18   6.009  12.930  -4.980
  132    HD3  LYS  18          3HD       LYS  18   7.221  12.504  -3.769
  133    HE2  LYS  18          2HE       LYS  18   8.715  14.026  -4.536
  134    HE3  LYS  18          3HE       LYS  18   8.218  13.825  -6.216
  135    HZ1  LYS  18          1HZ       LYS  18   6.914  15.454  -4.115
  136    HZ2  LYS  18          2HZ       LYS  18   6.137  15.058  -5.564
  137    HZ3  LYS  18          3HZ       LYS  18   7.559  15.975  -5.590
  138    H    THR  19           HN       THR  19   7.232   7.273  -4.027
  139    HA   THR  19           HA       THR  19   4.543   7.265  -5.198
  140    HB   THR  19           HB       THR  19   5.092   6.135  -7.112
  141    HG1  THR  19          1HG       THR  19   6.122   4.359  -6.231
  142   HG21  THR  19          1HG2      THR  19   6.251   8.320  -7.155
  143   HG22  THR  19          2HG2      THR  19   7.066   7.103  -8.137
  144   HG23  THR  19          3HG2      THR  19   7.709   7.534  -6.552
  145    H    ASN  20           HN       ASN  20   5.936   6.446  -2.616
  146    HA   ASN  20           HA       ASN  20   5.088   3.624  -2.603
  147    HB2  ASN  20          2HB       ASN  20   6.997   4.965  -0.679
  148    HB3  ASN  20          3HB       ASN  20   6.623   3.247  -0.769
  149   HD21  ASN  20          1HD2      ASN  20   9.203   4.074  -0.866
  150   HD22  ASN  20          2HD2      ASN  20   9.847   3.834  -2.450
  151    H    THR  21           HN       THR  21   3.607   6.258  -2.129
  152    HA   THR  21           HA       THR  21   2.689   5.804   0.620
  153    HB   THR  21           HB       THR  21   1.959   8.096  -1.209
  154    HG1  THR  21          1HG       THR  21   3.527   9.231   0.159
  155   HG21  THR  21          1HG2      THR  21   1.650   7.637   1.757
  156   HG22  THR  21          2HG2      THR  21   0.365   7.833   0.563
  157   HG23  THR  21          3HG2      THR  21   1.407   9.197   0.971
  158    H    CYS  22           HN       CYS  22   1.316   4.075   0.462
  159    HA   CYS  22           HA       CYS  22  -0.402   3.286  -1.452
  160    HB2  CYS  22          2HB       CYS  22  -0.111   2.182   0.760
  161    HB3  CYS  22          3HB       CYS  22  -1.143   3.414   1.477
  162    H    ARG  23           HN       ARG  23  -2.044   4.127  -2.549
  163    HA   ARG  23           HA       ARG  23  -3.074   6.721  -1.870
  164    HB2  ARG  23          2HB       ARG  23  -4.495   5.221  -3.953
  165    HB3  ARG  23          3HB       ARG  23  -3.752   6.814  -4.018
  166    HG2  ARG  23          2HG       ARG  23  -1.529   5.393  -4.003
  167    HG3  ARG  23          3HG       ARG  23  -2.603   4.154  -4.655
  168    HD2  ARG  23          2HD       ARG  23  -2.629   5.132  -6.653
  169    HD3  ARG  23          3HD       ARG  23  -3.064   6.687  -5.945
  170    HE   ARG  23           HE       ARG  23  -0.920   7.331  -6.331
  171   HH11  ARG  23          1HH1      ARG  23  -0.949   3.880  -5.873
  172   HH12  ARG  23          2HH1      ARG  23   0.757   3.702  -6.124
  173   HH21  ARG  23          1HH2      ARG  23   1.325   7.110  -6.662
  174   HH22  ARG  23          2HH2      ARG  23   2.050   5.539  -6.572
  175    H    GLY  24           HN       GLY  24  -3.727   3.823  -0.586
  176    HA2  GLY  24          1HA       GLY  24  -6.609   4.399  -0.276
  177    HA3  GLY  24          2HA       GLY  24  -5.920   2.785  -0.203
  178    H    CYS  25           HN       CYS  25  -3.639   4.341   1.332
  179    HA   CYS  25           HA       CYS  25  -5.023   4.358   3.933
  180    HB2  CYS  25          2HB       CYS  25  -2.316   3.187   3.269
  181    HB3  CYS  25          3HB       CYS  25  -2.902   3.435   4.911
  182    H    ASN  26           HN       ASN  26  -2.569   5.713   1.862
  183    HA   ASN  26           HA       ASN  26  -1.722   7.850   1.847
  184    HB2  ASN  26          2HB       ASN  26  -2.748   8.363   4.621
  185    HB3  ASN  26          3HB       ASN  26  -2.498   9.504   3.303
  186   HD21  ASN  26          1HD2      ASN  26  -3.786   7.965   1.291
  187   HD22  ASN  26          2HD2      ASN  26  -5.481   7.994   1.622
  188    H    HIS  27           HN       HIS  27  -0.756   5.319   3.384
  189    HA   HIS  27           HA       HIS  27   1.394   6.656   4.889
  190    HB2  HIS  27          2HB       HIS  27   0.295   3.854   5.192
  191    HB3  HIS  27          3HB       HIS  27   1.668   4.497   6.088
  192    HD1  HIS  27          1HD       HIS  27   0.629   7.192   6.984
  193    HD2  HIS  27          2HD       HIS  27  -1.680   3.737   7.040
  194    HE1  HIS  27          1HE       HIS  27  -1.175   7.616   8.684
  195    H    LEU  28           HN       LEU  28   3.496   5.453   4.873
  196    HA   LEU  28           HA       LEU  28   4.271   4.963   2.156
  197    HB2  LEU  28          2HB       LEU  28   5.735   4.930   4.778
  198    HB3  LEU  28          3HB       LEU  28   6.515   4.461   3.268
  199    HG   LEU  28           HG       LEU  28   5.285   7.166   3.792
  200   HD11  LEU  28          1HD1      LEU  28   7.354   7.997   4.354
  201   HD12  LEU  28          2HD1      LEU  28   8.220   6.664   3.590
  202   HD13  LEU  28          3HD1      LEU  28   7.393   6.413   5.128
  203   HD21  LEU  28          1HD2      LEU  28   7.203   7.255   1.756
  204   HD22  LEU  28          2HD2      LEU  28   5.454   7.418   1.593
  205   HD23  LEU  28          3HD2      LEU  28   6.213   5.835   1.419
  206    H    VAL  29           HN       VAL  29   5.312   3.053   1.372
  207    HA   VAL  29           HA       VAL  29   5.131   0.609   2.897
  208    HB   VAL  29           HB       VAL  29   3.789   0.086   0.400
  209   HG11  VAL  29          1HG1      VAL  29   2.460  -0.195   3.044
  210   HG12  VAL  29          2HG1      VAL  29   2.531  -1.322   1.688
  211   HG13  VAL  29          3HG1      VAL  29   3.929  -1.123   2.747
  212   HG21  VAL  29          1HG2      VAL  29   1.698   1.236   0.806
  213   HG22  VAL  29          2HG2      VAL  29   2.367   2.002   2.247
  214   HG23  VAL  29          3HG2      VAL  29   3.004   2.410   0.653
  215    H    CYS  30           HN       CYS  30   6.963  -0.408   2.459
  216    HA   CYS  30           HA       CYS  30   8.787   0.214   0.505
  217    HB2  CYS  30          2HB       CYS  30   9.817  -1.965   0.935
  218    HB3  CYS  30          3HB       CYS  30   9.296  -1.214   2.440
  219    H    ARG  31           HN       ARG  31   9.568  -1.426  -1.223
  220    HA   ARG  31           HA       ARG  31   7.430  -1.676  -3.136
  221    HB2  ARG  31          2HB       ARG  31   9.236  -2.483  -4.653
  222    HB3  ARG  31          3HB       ARG  31   9.570  -0.914  -3.931
  223    HG2  ARG  31          2HG       ARG  31  11.124  -1.868  -2.396
  224    HG3  ARG  31          3HG       ARG  31  10.667  -3.504  -2.869
  225    HD2  ARG  31          2HD       ARG  31  11.570  -3.157  -5.084
  226    HD3  ARG  31          3HD       ARG  31  11.924  -1.472  -4.707
  227    HE   ARG  31           HE       ARG  31  13.212  -3.254  -2.896
  228   HH11  ARG  31          1HH1      ARG  31  13.410  -1.898  -6.096
  229   HH12  ARG  31          2HH1      ARG  31  15.129  -2.073  -6.205
  230   HH21  ARG  31          1HH2      ARG  31  15.477  -3.490  -3.028
  231   HH22  ARG  31          2HH2      ARG  31  16.304  -2.980  -4.461
  232    H    ASP  32           HN       ASP  32   7.980  -3.494  -0.614
  233    HA   ASP  32           HA       ASP  32   7.629  -6.056  -2.025
  234    HB2  ASP  32          2HB       ASP  32   9.618  -5.817  -0.477
  235    HB3  ASP  32          3HB       ASP  32   8.470  -5.702   0.853
  236    H    CYS  33           HN       CYS  33   6.095  -3.717  -0.122
  237    HA   CYS  33           HA       CYS  33   4.037  -5.608   0.782
  238    HB2  CYS  33          2HB       CYS  33   4.704  -2.789   1.633
  239    HB3  CYS  33          3HB       CYS  33   3.242  -3.624   2.151
  240    H    ARG  34           HN       ARG  34   4.642  -3.842  -1.851
  241    HA   ARG  34           HA       ARG  34   1.957  -2.737  -2.177
  242    HB2  ARG  34          2HB       ARG  34   3.826  -2.581  -4.445
  243    HB3  ARG  34          3HB       ARG  34   2.839  -1.326  -3.708
  244    HG2  ARG  34          2HG       ARG  34   4.474  -1.160  -1.871
  245    HG3  ARG  34          3HG       ARG  34   5.480  -2.356  -2.691
  246    HD2  ARG  34          2HD       ARG  34   4.658   0.323  -3.811
  247    HD3  ARG  34          3HD       ARG  34   6.236  -0.063  -3.128
  248    HE   ARG  34           HE       ARG  34   5.794  -1.909  -5.131
  249   HH11  ARG  34          1HH1      ARG  34   6.056   1.553  -4.867
  250   HH12  ARG  34          2HH1      ARG  34   6.686   1.758  -6.468
  251   HH21  ARG  34          1HH2      ARG  34   6.624  -1.651  -7.241
  252   HH22  ARG  34          2HH2      ARG  34   7.008  -0.065  -7.817
  253    H    ILE  35           HN       ILE  35   0.424  -3.614  -3.442
  254    HA   ILE  35           HA       ILE  35   1.127  -6.074  -4.903
  255    HB   ILE  35           HB       ILE  35  -1.256  -5.307  -3.303
  256   HG12  ILE  35          2HG1      ILE  35  -1.153  -7.850  -2.922
  257   HG13  ILE  35          3HG1      ILE  35   0.384  -7.790  -3.780
  258   HG21  ILE  35          1HG2      ILE  35  -2.436  -7.258  -4.587
  259   HG22  ILE  35          2HG2      ILE  35  -2.504  -5.609  -5.207
  260   HG23  ILE  35          3HG2      ILE  35  -1.368  -6.764  -5.901
  261   HD11  ILE  35          1HD1      ILE  35   0.097  -7.532  -1.105
  262   HD12  ILE  35          2HD1      ILE  35   1.460  -6.905  -2.033
  263   HD13  ILE  35          3HD1      ILE  35   0.118  -5.842  -1.611
  264    H    GLN  36           HN       GLN  36   1.364  -5.620  -6.998
  265    HA   GLN  36           HA       GLN  36   0.434  -3.462  -8.412
  266    HB2  GLN  36          2HB       GLN  36   1.516  -6.084  -9.060
  267    HB3  GLN  36          3HB       GLN  36   0.379  -5.521 -10.279
  268    HG2  GLN  36          2HG       GLN  36   2.692  -3.881  -9.283
  269    HG3  GLN  36          3HG       GLN  36   2.773  -4.936 -10.692
  270   HE21  GLN  36          1HE2      GLN  36   1.438  -2.014  -9.366
  271   HE22  GLN  36          2HE2      GLN  36   0.900  -1.339 -10.862
  272    H    GLU  37           HN       GLU  37  -1.543  -2.744  -8.805
  273    HA   GLU  37           HA       GLU  37  -3.797  -4.601  -8.705
  274    HB2  GLU  37          2HB       GLU  37  -3.664  -1.583  -8.728
  275    HB3  GLU  37          3HB       GLU  37  -5.166  -2.495  -8.741
  276    HG2  GLU  37          2HG       GLU  37  -3.089  -2.771  -6.589
  277    HG3  GLU  37          3HG       GLU  37  -4.435  -1.635  -6.505
  278    H    SER  38           HN       SER  38  -5.579  -4.255 -10.300
  279    HA   SER  38           HA       SER  38  -4.428  -4.140 -12.982
  280    HB2  SER  38          2HB       SER  38  -6.989  -5.258 -11.860
  281    HB3  SER  38          3HB       SER  38  -6.778  -5.025 -13.595
  282    HG   SER  38           HG       SER  38  -4.632  -6.232 -12.942
  283    H    ASN  39           HN       ASN  39  -5.158  -1.775 -11.220
  284    HA   ASN  39           HA       ASN  39  -7.056  -0.464 -13.049
  285    HB2  ASN  39          2HB       ASN  39  -7.007  -0.580 -10.239
  286    HB3  ASN  39          3HB       ASN  39  -6.516   1.059 -10.656
  287   HD21  ASN  39          1HD2      ASN  39  -8.609   1.421  -9.490
  288   HD22  ASN  39          2HD2      ASN  39 -10.046   1.456 -10.448
  289    H    GLY  40           HN       GLY  40  -3.858  -0.787 -12.628
  290    HA2  GLY  40          1HA       GLY  40  -2.292   0.453 -13.920
  291    HA3  GLY  40          2HA       GLY  40  -3.340   1.858 -13.788
  292    H    THR  41           HN       THR  41  -3.446   0.805 -10.785
  293    HA   THR  41           HA       THR  41  -1.000   2.242  -9.978
  294    HB   THR  41           HB       THR  41  -3.163   3.452  -9.513
  295    HG1  THR  41          1HG       THR  41  -1.340   3.943  -8.275
  296   HG21  THR  41          1HG2      THR  41  -3.860   0.918  -8.417
  297   HG22  THR  41          2HG2      THR  41  -4.852   2.371  -8.544
  298   HG23  THR  41          3HG2      THR  41  -3.858   2.104  -7.112
  299    H    TRP  42           HN       TRP  42  -1.325   1.737  -7.207
  300    HA   TRP  42           HA       TRP  42  -1.301  -1.164  -6.927
  301    HB2  TRP  42          2HB       TRP  42   0.902  -1.188  -5.863
  302    HB3  TRP  42          3HB       TRP  42   1.017  -0.580  -7.513
  303    HD1  TRP  42          1HD       TRP  42   2.100   1.750  -7.839
  304    HE1  TRP  42          1HE       TRP  42   3.007   3.561  -6.252
  305    HE3  TRP  42          3HE       TRP  42   0.403  -0.135  -3.400
  306    HZ2  TRP  42          2HZ       TRP  42   3.005   4.118  -3.485
  307    HZ3  TRP  42          3HZ       TRP  42   0.899   1.097  -1.329
  308    HH2  TRP  42          2HH       TRP  42   2.174   3.179  -1.373
  309    H    ARG  43           HN       ARG  43  -1.375  -1.880  -4.716
  310    HA   ARG  43           HA       ARG  43  -1.904   0.170  -2.704
  311    HB2  ARG  43          2HB       ARG  43  -3.869  -1.917  -3.618
  312    HB3  ARG  43          3HB       ARG  43  -3.949  -1.231  -2.001
  313    HG2  ARG  43          2HG       ARG  43  -3.738   0.825  -4.025
  314    HG3  ARG  43          3HG       ARG  43  -5.131  -0.226  -4.290
  315    HD2  ARG  43          2HD       ARG  43  -4.784   0.528  -1.498
  316    HD3  ARG  43          3HD       ARG  43  -5.016   1.915  -2.560
  317    HE   ARG  43           HE       ARG  43  -6.950  -0.140  -1.924
  318   HH11  ARG  43          1HH1      ARG  43  -6.055   2.463  -4.055
  319   HH12  ARG  43          2HH1      ARG  43  -7.672   2.733  -4.617
  320   HH21  ARG  43          1HH2      ARG  43  -9.083   0.204  -2.656
  321   HH22  ARG  43          2HH2      ARG  43  -9.393   1.448  -3.820
  322    H    CYS  44           HN       CYS  44  -1.283  -0.399  -0.682
  323    HA   CYS  44           HA       CYS  44   0.591  -2.286  -0.175
  324    HB2  CYS  44          2HB       CYS  44   0.174  -2.004   2.153
  325    HB3  CYS  44          3HB       CYS  44  -0.232  -0.470   1.389
  326    H    LYS  45           HN       LYS  45   0.487  -4.280   1.165
  327    HA   LYS  45           HA       LYS  45  -1.131  -6.226  -0.079
  328    HB2  LYS  45          2HB       LYS  45   0.108  -6.711   2.602
  329    HB3  LYS  45          3HB       LYS  45  -0.010  -7.790   1.218
  330    HG2  LYS  45          2HG       LYS  45   1.586  -6.064   0.092
  331    HG3  LYS  45          3HG       LYS  45   1.948  -5.609   1.759
  332    HD2  LYS  45          2HD       LYS  45   3.441  -7.272   1.729
  333    HD3  LYS  45          3HD       LYS  45   2.056  -8.362   1.821
  334    HE2  LYS  45          2HE       LYS  45   1.991  -8.513  -0.605
  335    HE3  LYS  45          3HE       LYS  45   3.326  -7.369  -0.730
  336    HZ1  LYS  45          1HZ       LYS  45   4.076  -9.655  -0.975
  337    HZ2  LYS  45          2HZ       LYS  45   3.467 -10.044   0.554
  338    HZ3  LYS  45          3HZ       LYS  45   4.748  -8.949   0.408
  339    H    VAL  46           HN       VAL  46  -1.786  -4.060   2.446
  340    HA   VAL  46           HA       VAL  46  -3.845  -5.724   3.663
  341    HB   VAL  46           HB       VAL  46  -3.217  -2.843   4.299
  342   HG11  VAL  46          1HG1      VAL  46  -5.149  -3.191   5.426
  343   HG12  VAL  46          2HG1      VAL  46  -4.943  -4.943   5.461
  344   HG13  VAL  46          3HG1      VAL  46  -4.058  -3.925   6.599
  345   HG21  VAL  46          1HG2      VAL  46  -1.401  -3.416   5.468
  346   HG22  VAL  46          2HG2      VAL  46  -2.184  -4.843   6.149
  347   HG23  VAL  46          3HG2      VAL  46  -1.435  -4.925   4.554
  348    H    CYS  47           HN       CYS  47  -3.535  -3.382   1.199
  349    HA   CYS  47           HA       CYS  47  -6.381  -2.694   1.291
  350    HB2  CYS  47          2HB       CYS  47  -3.972  -1.500  -0.006
  351    HB3  CYS  47          3HB       CYS  47  -5.541  -1.235  -0.761
  352    H    ALA  48           HN       ALA  48  -3.951  -4.072  -0.895
  353    HA   ALA  48           HA       ALA  48  -5.713  -4.598  -3.037
  354    HB1  ALA  48          1HB       ALA  48  -3.115  -5.949  -2.318
  355    HB2  ALA  48          2HB       ALA  48  -3.948  -6.085  -3.867
  356    HB3  ALA  48          3HB       ALA  48  -3.305  -4.528  -3.345
  357    H    LYS  49           HN       LYS  49  -5.132  -6.214  -0.044
  358    HA   LYS  49           HA       LYS  49  -6.493  -8.640  -0.958
  359    HB2  LYS  49          2HB       LYS  49  -4.809  -7.951   1.419
  360    HB3  LYS  49          3HB       LYS  49  -5.928  -9.304   1.520
  361    HG2  LYS  49          2HG       LYS  49  -4.127  -9.200  -0.829
  362    HG3  LYS  49          3HG       LYS  49  -3.412  -9.588   0.738
  363    HD2  LYS  49          2HD       LYS  49  -4.213 -11.661   0.643
  364    HD3  LYS  49          3HD       LYS  49  -5.852 -11.059   0.381
  365    HE2  LYS  49          2HE       LYS  49  -5.003 -12.556  -1.424
  366    HE3  LYS  49          3HE       LYS  49  -5.511 -10.963  -1.982
  367    HZ1  LYS  49          1HZ       LYS  49  -3.350 -11.824  -2.900
  368    HZ2  LYS  49          2HZ       LYS  49  -2.689 -11.605  -1.359
  369    HZ3  LYS  49          3HZ       LYS  49  -3.290 -10.277  -2.219
  370    H    GLU  50           HN       GLU  50  -8.261  -6.683  -1.039
  371    HA   GLU  50           HA       GLU  50 -10.279  -7.480   0.751
  372    HB2  GLU  50          2HB       GLU  50  -9.501  -6.271   2.530
  373    HB3  GLU  50          3HB       GLU  50  -8.680  -5.096   1.512
  374    HG2  GLU  50          2HG       GLU  50 -11.659  -5.164   1.570
  375    HG3  GLU  50          3HG       GLU  50 -10.772  -4.407   2.892
  376    H    ILE  51           HN       ILE  51 -12.232  -6.962  -0.067
  377    HA   ILE  51           HA       ILE  51 -12.488  -4.689  -1.879
  378    HB   ILE  51           HB       ILE  51 -13.830  -6.274  -3.440
  379   HG12  ILE  51          2HG1      ILE  51 -11.835  -8.316  -2.536
  380   HG13  ILE  51          3HG1      ILE  51 -13.370  -8.177  -1.685
  381   HG21  ILE  51          1HG2      ILE  51 -10.816  -6.302  -3.363
  382   HG22  ILE  51          2HG2      ILE  51 -11.806  -6.715  -4.762
  383   HG23  ILE  51          3HG2      ILE  51 -11.833  -5.074  -4.116
  384   HD11  ILE  51          1HD1      ILE  51 -14.488  -8.440  -3.931
  385   HD12  ILE  51          2HD1      ILE  51 -12.902  -8.890  -4.560
  386   HD13  ILE  51          3HD1      ILE  51 -13.657  -9.861  -3.296
  387    H    GLU  52           HN       GLU  52 -13.517  -5.796   0.802
  388    HA   GLU  52           HA       GLU  52 -16.389  -5.501   0.210
  389    HB2  GLU  52          2HB       GLU  52 -15.310  -6.759   2.719
  390    HB3  GLU  52          3HB       GLU  52 -16.915  -6.912   2.017
  391    HG2  GLU  52          2HG       GLU  52 -14.488  -7.955   0.608
  392    HG3  GLU  52          3HG       GLU  52 -15.324  -8.901   1.838
  393    H    LEU  53           HN       LEU  53 -15.136  -3.176   0.329
  394    HA   LEU  53           HA       LEU  53 -15.656  -2.161   3.046
  395    HB2  LEU  53          2HB       LEU  53 -13.273  -2.077   1.891
  396    HB3  LEU  53          3HB       LEU  53 -13.956  -0.635   1.145
  397    HG   LEU  53           HG       LEU  53 -14.356  -0.645   4.015
  398   HD11  LEU  53          1HD1      LEU  53 -11.607  -1.118   2.943
  399   HD12  LEU  53          2HD1      LEU  53 -12.384  -1.795   4.374
  400   HD13  LEU  53          3HD1      LEU  53 -11.847  -0.115   4.374
  401   HD21  LEU  53          1HD2      LEU  53 -14.425   1.234   2.228
  402   HD22  LEU  53          2HD2      LEU  53 -12.677   1.282   2.460
  403   HD23  LEU  53          3HD2      LEU  53 -13.757   1.581   3.823
  Start of MODEL    7
    1    H1   SER   1           HN       SER   1   7.773  11.366  12.438
    2    HA   SER   1           HA       SER   1   7.750  10.085  10.169
    3    HB2  SER   1          2HB       SER   1   8.318  13.037  10.448
    4    HB3  SER   1          3HB       SER   1   7.954  12.282   8.896
    5    HG   SER   1           HG       SER   1   6.193  11.643  10.909
    6    H    ASP   2           HN       ASP   2   9.594   8.696  10.098
    7    HA   ASP   2           HA       ASP   2  12.025   9.977   9.037
    8    HB2  ASP   2          2HB       ASP   2  11.912   7.185  10.160
    9    HB3  ASP   2          3HB       ASP   2  13.320   8.219   9.929
   10    H    ARG   3           HN       ARG   3   9.333   8.454   8.024
   11    HA   ARG   3           HA       ARG   3   8.765   7.644   5.958
   12    HB2  ARG   3          2HB       ARG   3  11.661   7.393   5.203
   13    HB3  ARG   3          3HB       ARG   3  10.269   7.680   4.165
   14    HG2  ARG   3          2HG       ARG   3  10.492   9.827   6.029
   15    HG3  ARG   3          3HG       ARG   3  12.055   9.565   5.254
   16    HD2  ARG   3          2HD       ARG   3  11.289  10.157   3.199
   17    HD3  ARG   3          3HD       ARG   3   9.670   9.530   3.504
   18    HE   ARG   3           HE       ARG   3  10.184  11.822   5.092
   19   HH11  ARG   3          1HH1      ARG   3   9.422  10.827   1.844
   20   HH12  ARG   3          2HH1      ARG   3   8.641  12.318   1.432
   21   HH21  ARG   3          1HH2      ARG   3   9.158  13.789   4.562
   22   HH22  ARG   3          2HH2      ARG   3   8.492  14.002   2.978
   23    H    THR   4           HN       THR   4   8.419   5.889   7.712
   24    HA   THR   4           HA       THR   4   9.995   3.497   7.019
   25    HB   THR   4           HB       THR   4   8.277   3.234   9.365
   26    HG1  THR   4          1HG       THR   4  10.424   4.715  10.128
   27   HG21  THR   4          1HG2      THR   4  10.240   2.240  10.318
   28   HG22  THR   4          2HG2      THR   4  11.268   2.958   9.077
   29   HG23  THR   4          3HG2      THR   4  10.116   1.694   8.646
   30    H    CYS   5           HN       CYS   5   8.918   1.534   6.634
   31    HA   CYS   5           HA       CYS   5   6.576   1.689   5.123
   32    HB2  CYS   5          2HB       CYS   5   8.296  -0.143   5.033
   33    HB3  CYS   5          3HB       CYS   5   7.613  -0.779   6.526
   34    H    ALA   6           HN       ALA   6   4.439   1.225   5.533
   35    HA   ALA   6           HA       ALA   6   3.607   1.521   8.298
   36    HB1  ALA   6          1HB       ALA   6   1.284   1.339   6.969
   37    HB2  ALA   6          2HB       ALA   6   2.208   2.836   7.107
   38    HB3  ALA   6          3HB       ALA   6   2.341   1.848   5.651
   39    H    ARG   7           HN       ARG   7   4.660  -1.039   6.750
   40    HA   ARG   7           HA       ARG   7   2.728  -2.841   8.041
   41    HB2  ARG   7          2HB       ARG   7   4.069  -3.835   5.594
   42    HB3  ARG   7          3HB       ARG   7   2.447  -4.147   6.196
   43    HG2  ARG   7          2HG       ARG   7   3.316  -1.573   4.900
   44    HG3  ARG   7          3HG       ARG   7   2.501  -2.896   4.063
   45    HD2  ARG   7          2HD       ARG   7   0.495  -2.404   4.966
   46    HD3  ARG   7          3HD       ARG   7   1.191  -1.973   6.528
   47    HE   ARG   7           HE       ARG   7   1.945   0.095   5.006
   48   HH11  ARG   7          1HH1      ARG   7  -1.133  -1.485   5.400
   49   HH12  ARG   7          2HH1      ARG   7  -2.056  -0.054   5.080
   50   HH21  ARG   7          1HH2      ARG   7   0.741   1.985   4.583
   51   HH22  ARG   7          2HH2      ARG   7  -0.988   1.919   4.615
   52    H    CYS   8           HN       CYS   8   6.010  -2.222   6.980
   53    HA   CYS   8           HA       CYS   8   6.954  -4.516   8.559
   54    HB2  CYS   8          2HB       CYS   8   8.470  -2.882   6.514
   55    HB3  CYS   8          3HB       CYS   8   9.040  -4.343   7.314
   56    H    GLN   9           HN       GLN   9   6.977  -1.062   8.329
   57    HA   GLN   9           HA       GLN   9   7.701   0.559   9.751
   58    HB2  GLN   9          2HB       GLN   9   7.554  -1.839  11.442
   59    HB3  GLN   9          3HB       GLN   9   8.659  -0.605  12.034
   60    HG2  GLN   9          2HG       GLN   9   7.003   0.764  12.634
   61    HG3  GLN   9          3HG       GLN   9   6.073   0.440  11.172
   62   HE21  GLN   9          1HE2      GLN   9   4.941  -1.662  11.104
   63   HE22  GLN   9          2HE2      GLN   9   4.256  -2.262  12.572
   64    H    GLU  10           HN       GLU  10   9.505  -0.814   7.876
   65    HA   GLU  10           HA       GLU  10  12.081  -0.424   9.241
   66    HB2  GLU  10          2HB       GLU  10  11.138  -2.313   7.224
   67    HB3  GLU  10          3HB       GLU  10  12.643  -1.527   6.766
   68    HG2  GLU  10          2HG       GLU  10  13.466  -2.169   9.103
   69    HG3  GLU  10          3HG       GLU  10  12.081  -3.257   9.143
   70    H    SER  11           HN       SER  11  13.616   0.955   8.408
   71    HA   SER  11           HA       SER  11  12.826   3.298   7.209
   72    HB2  SER  11          2HB       SER  11  14.977   3.032   8.371
   73    HB3  SER  11          3HB       SER  11  15.568   2.019   7.053
   74    HG   SER  11           HG       SER  11  16.290   3.957   6.473
   75    H    LEU  12           HN       LEU  12  12.575   4.046   5.171
   76    HA   LEU  12           HA       LEU  12  12.384   2.105   3.050
   77    HB2  LEU  12          2HB       LEU  12  11.798   5.040   3.267
   78    HB3  LEU  12          3HB       LEU  12  11.745   4.203   1.717
   79    HG   LEU  12           HG       LEU  12   9.600   4.567   3.298
   80   HD11  LEU  12          1HD1      LEU  12  10.330   2.875   1.080
   81   HD12  LEU  12          2HD1      LEU  12   8.816   3.717   1.403
   82   HD13  LEU  12          3HD1      LEU  12   9.095   2.114   2.083
   83   HD21  LEU  12          1HD2      LEU  12  10.650   1.829   4.007
   84   HD22  LEU  12          2HD2      LEU  12   9.066   2.479   4.431
   85   HD23  LEU  12          3HD2      LEU  12  10.527   3.201   5.107
   86    H    GLY  13           HN       GLY  13  14.504   4.771   3.927
   87    HA2  GLY  13          1HA       GLY  13  16.558   5.406   3.124
   88    HA3  GLY  13          2HA       GLY  13  16.698   3.772   2.493
   89    H    ARG  14           HN       ARG  14  16.759   3.524   0.355
   90    HA   ARG  14           HA       ARG  14  16.054   5.846  -1.306
   91    HB2  ARG  14          2HB       ARG  14  18.433   4.866  -1.290
   92    HB3  ARG  14          3HB       ARG  14  17.748   3.521  -2.192
   93    HG2  ARG  14          2HG       ARG  14  16.906   5.935  -3.428
   94    HG3  ARG  14          3HG       ARG  14  18.648   6.019  -3.161
   95    HD2  ARG  14          2HD       ARG  14  18.498   3.528  -4.096
   96    HD3  ARG  14          3HD       ARG  14  17.068   4.195  -4.882
   97    HE   ARG  14           HE       ARG  14  19.223   5.945  -5.280
   98   HH11  ARG  14          1HH1      ARG  14  18.136   2.777  -6.230
   99   HH12  ARG  14          2HH1      ARG  14  18.958   2.809  -7.754
  100   HH21  ARG  14          1HH2      ARG  14  20.311   5.999  -7.285
  101   HH22  ARG  14          2HH2      ARG  14  20.196   4.641  -8.353
  102    H    LEU  15           HN       LEU  15  13.826   4.690  -0.720
  103    HA   LEU  15           HA       LEU  15  13.233   2.696  -2.796
  104    HB2  LEU  15          2HB       LEU  15  12.444   2.981  -0.072
  105    HB3  LEU  15          3HB       LEU  15  11.009   3.096  -1.088
  106    HG   LEU  15           HG       LEU  15  12.942   0.826  -1.405
  107   HD11  LEU  15          1HD1      LEU  15  12.357   0.860   0.952
  108   HD12  LEU  15          2HD1      LEU  15  11.554  -0.481   0.136
  109   HD13  LEU  15          3HD1      LEU  15  10.645   0.975   0.543
  110   HD21  LEU  15          1HD2      LEU  15   9.965   0.909  -1.821
  111   HD22  LEU  15          2HD2      LEU  15  11.122  -0.279  -2.420
  112   HD23  LEU  15          3HD2      LEU  15  11.116   1.357  -3.080
  113    H    SER  16           HN       SER  16  12.669   5.943  -1.823
  114    HA   SER  16           HA       SER  16  11.750   7.663  -3.045
  115    HB2  SER  16          2HB       SER  16  12.086   5.967  -5.031
  116    HB3  SER  16          3HB       SER  16  10.338   5.777  -4.895
  117    HG   SER  16           HG       SER  16  10.539   8.282  -4.879
  118    HA   PRO  17           HA       PRO  17   7.980   6.659  -0.580
  119    HB2  PRO  17          2HB       PRO  17   8.097   8.919   0.920
  120    HB3  PRO  17          3HB       PRO  17   8.985   7.448   1.331
  121    HG2  PRO  17          2HG       PRO  17   9.955   9.923  -0.046
  122    HG3  PRO  17          3HG       PRO  17  10.744   8.965   1.221
  123    HD2  PRO  17          2HD       PRO  17  11.409   8.751  -1.395
  124    HD3  PRO  17          3HD       PRO  17  11.496   7.379  -0.272
  125    H    LYS  18           HN       LYS  18   8.901   8.923  -2.870
  126    HA   LYS  18           HA       LYS  18   6.688  10.716  -2.728
  127    HB2  LYS  18          2HB       LYS  18   9.081  10.639  -4.113
  128    HB3  LYS  18          3HB       LYS  18   7.881  10.397  -5.376
  129    HG2  LYS  18          2HG       LYS  18   8.231  12.737  -3.541
  130    HG3  LYS  18          3HG       LYS  18   8.192  12.702  -5.305
  131    HD2  LYS  18          2HD       LYS  18   5.765  11.839  -4.982
  132    HD3  LYS  18          3HD       LYS  18   5.927  12.507  -3.356
  133    HE2  LYS  18          2HE       LYS  18   6.888  14.407  -5.267
  134    HE3  LYS  18          3HE       LYS  18   5.279  13.863  -5.743
  135    HZ1  LYS  18          1HZ       LYS  18   5.375  14.360  -2.957
  136    HZ2  LYS  18          2HZ       LYS  18   4.382  15.063  -4.130
  137    HZ3  LYS  18          3HZ       LYS  18   5.905  15.725  -3.804
  138    H    THR  19           HN       THR  19   7.265   7.636  -4.258
  139    HA   THR  19           HA       THR  19   4.519   7.706  -5.326
  140    HB   THR  19           HB       THR  19   5.116   6.746  -7.306
  141    HG1  THR  19          1HG       THR  19   7.326   5.575  -7.319
  142   HG21  THR  19          1HG2      THR  19   7.090   7.762  -8.198
  143   HG22  THR  19          2HG2      THR  19   7.805   7.913  -6.592
  144   HG23  THR  19          3HG2      THR  19   6.399   8.884  -7.028
  145    H    ASN  20           HN       ASN  20   6.210   6.518  -2.898
  146    HA   ASN  20           HA       ASN  20   5.089   3.804  -3.064
  147    HB2  ASN  20          2HB       ASN  20   7.450   4.955  -1.619
  148    HB3  ASN  20          3HB       ASN  20   6.678   3.496  -1.004
  149   HD21  ASN  20          1HD2      ASN  20   9.337   4.053  -2.259
  150   HD22  ASN  20          2HD2      ASN  20   9.467   2.897  -3.535
  151    H    THR  21           HN       THR  21   3.562   6.198  -2.395
  152    HA   THR  21           HA       THR  21   2.922   5.671   0.431
  153    HB   THR  21           HB       THR  21   2.078   8.076  -1.189
  154    HG1  THR  21          1HG       THR  21   3.891   8.674   0.678
  155   HG21  THR  21          1HG2      THR  21   0.643   8.054   0.605
  156   HG22  THR  21          2HG2      THR  21   2.000   8.938   1.305
  157   HG23  THR  21          3HG2      THR  21   1.793   7.222   1.651
  158    H    CYS  22           HN       CYS  22   1.483   4.009   0.334
  159    HA   CYS  22           HA       CYS  22  -0.351   3.269  -1.466
  160    HB2  CYS  22          2HB       CYS  22  -0.007   2.201   0.761
  161    HB3  CYS  22          3HB       CYS  22  -0.982   3.476   1.486
  162    H    ARG  23           HN       ARG  23  -2.023   4.130  -2.501
  163    HA   ARG  23           HA       ARG  23  -2.928   6.776  -1.848
  164    HB2  ARG  23          2HB       ARG  23  -4.497   5.272  -3.820
  165    HB3  ARG  23          3HB       ARG  23  -3.710   6.838  -3.963
  166    HG2  ARG  23          2HG       ARG  23  -1.544   5.274  -3.974
  167    HG3  ARG  23          3HG       ARG  23  -2.719   4.143  -4.650
  168    HD2  ARG  23          2HD       ARG  23  -2.663   5.179  -6.616
  169    HD3  ARG  23          3HD       ARG  23  -3.028   6.728  -5.859
  170    HE   ARG  23           HE       ARG  23  -0.381   6.357  -5.356
  171   HH11  ARG  23          1HH1      ARG  23  -2.339   6.359  -8.235
  172   HH12  ARG  23          2HH1      ARG  23  -1.065   6.934  -9.258
  173   HH21  ARG  23          1HH2      ARG  23   1.305   7.115  -6.694
  174   HH22  ARG  23          2HH2      ARG  23   1.008   7.362  -8.381
  175    H    GLY  24           HN       GLY  24  -3.684   3.822  -0.608
  176    HA2  GLY  24          1HA       GLY  24  -6.506   4.544  -0.135
  177    HA3  GLY  24          2HA       GLY  24  -5.860   2.913  -0.040
  178    H    CYS  25           HN       CYS  25  -3.477   4.447   1.358
  179    HA   CYS  25           HA       CYS  25  -4.757   4.599   4.007
  180    HB2  CYS  25          2HB       CYS  25  -2.129   3.284   3.295
  181    HB3  CYS  25          3HB       CYS  25  -2.657   3.601   4.944
  182    H    ASN  26           HN       ASN  26  -2.237   5.709   1.846
  183    HA   ASN  26           HA       ASN  26  -1.263   7.785   1.716
  184    HB2  ASN  26          2HB       ASN  26  -3.396   8.305   3.386
  185    HB3  ASN  26          3HB       ASN  26  -2.013   8.790   4.362
  186   HD21  ASN  26          1HD2      ASN  26  -3.658   9.278   1.306
  187   HD22  ASN  26          2HD2      ASN  26  -3.028  10.859   1.005
  188    H    HIS  27           HN       HIS  27  -0.302   5.325   3.164
  189    HA   HIS  27           HA       HIS  27   1.819   6.623   4.747
  190    HB2  HIS  27          2HB       HIS  27   0.716   3.827   5.095
  191    HB3  HIS  27          3HB       HIS  27   1.995   4.563   6.059
  192    HD1  HIS  27          1HD       HIS  27   0.873   7.191   6.880
  193    HD2  HIS  27          2HD       HIS  27  -1.467   3.763   6.676
  194    HE1  HIS  27          1HE       HIS  27  -1.088   7.625   8.392
  195    H    LEU  28           HN       LEU  28   3.890   5.385   4.776
  196    HA   LEU  28           HA       LEU  28   4.685   4.801   2.089
  197    HB2  LEU  28          2HB       LEU  28   6.148   4.658   4.717
  198    HB3  LEU  28          3HB       LEU  28   6.902   4.320   3.160
  199    HG   LEU  28           HG       LEU  28   5.904   6.942   4.230
  200   HD11  LEU  28          1HD1      LEU  28   8.117   7.672   3.916
  201   HD12  LEU  28          2HD1      LEU  28   8.524   6.274   2.920
  202   HD13  LEU  28          3HD1      LEU  28   8.250   6.075   4.650
  203   HD21  LEU  28          1HD2      LEU  28   6.394   6.135   1.381
  204   HD22  LEU  28          2HD2      LEU  28   6.573   7.806   1.919
  205   HD23  LEU  28          3HD2      LEU  28   5.013   6.994   2.066
  206    H    VAL  29           HN       VAL  29   5.346   2.861   1.209
  207    HA   VAL  29           HA       VAL  29   5.189   0.436   2.814
  208    HB   VAL  29           HB       VAL  29   3.787  -0.035   0.337
  209   HG11  VAL  29          1HG1      VAL  29   3.921  -1.249   2.686
  210   HG12  VAL  29          2HG1      VAL  29   2.486  -0.271   2.997
  211   HG13  VAL  29          3HG1      VAL  29   2.508  -1.400   1.642
  212   HG21  VAL  29          1HG2      VAL  29   2.437   1.895   2.220
  213   HG22  VAL  29          2HG2      VAL  29   3.127   2.344   0.660
  214   HG23  VAL  29          3HG2      VAL  29   1.774   1.216   0.733
  215    H    CYS  30           HN       CYS  30   7.030  -0.574   2.388
  216    HA   CYS  30           HA       CYS  30   8.815  -0.083   0.375
  217    HB2  CYS  30          2HB       CYS  30   9.802  -2.264   0.853
  218    HB3  CYS  30          3HB       CYS  30   9.305  -1.477   2.348
  219    H    ARG  31           HN       ARG  31   9.513  -1.816  -1.310
  220    HA   ARG  31           HA       ARG  31   7.340  -2.037  -3.184
  221    HB2  ARG  31          2HB       ARG  31   8.977  -2.652  -4.785
  222    HB3  ARG  31          3HB       ARG  31   9.725  -1.423  -3.773
  223    HG2  ARG  31          2HG       ARG  31  11.116  -2.959  -2.720
  224    HG3  ARG  31          3HG       ARG  31  10.116  -4.333  -3.198
  225    HD2  ARG  31          2HD       ARG  31  10.811  -4.121  -5.483
  226    HD3  ARG  31          3HD       ARG  31  11.654  -2.612  -5.135
  227    HE   ARG  31           HE       ARG  31  13.411  -3.818  -4.258
  228   HH11  ARG  31          1HH1      ARG  31  10.696  -5.918  -4.843
  229   HH12  ARG  31          2HH1      ARG  31  11.601  -7.374  -4.593
  230   HH21  ARG  31          1HH2      ARG  31  14.613  -5.729  -3.925
  231   HH22  ARG  31          2HH2      ARG  31  13.829  -7.265  -4.070
  232    H    ASP  32           HN       ASP  32   7.950  -3.820  -0.613
  233    HA   ASP  32           HA       ASP  32   7.416  -6.395  -1.938
  234    HB2  ASP  32          2HB       ASP  32   9.444  -5.968  -0.290
  235    HB3  ASP  32          3HB       ASP  32   8.210  -6.243   0.937
  236    H    CYS  33           HN       CYS  33   6.010  -3.932  -0.137
  237    HA   CYS  33           HA       CYS  33   3.932  -5.712   0.939
  238    HB2  CYS  33          2HB       CYS  33   4.805  -2.924   1.678
  239    HB3  CYS  33          3HB       CYS  33   3.258  -3.579   2.206
  240    H    ARG  34           HN       ARG  34   4.481  -4.178  -1.809
  241    HA   ARG  34           HA       ARG  34   1.825  -2.971  -2.082
  242    HB2  ARG  34          2HB       ARG  34   3.602  -2.901  -4.414
  243    HB3  ARG  34          3HB       ARG  34   2.705  -1.601  -3.641
  244    HG2  ARG  34          2HG       ARG  34   4.432  -1.440  -1.915
  245    HG3  ARG  34          3HG       ARG  34   5.335  -2.733  -2.707
  246    HD2  ARG  34          2HD       ARG  34   4.593  -0.125  -4.025
  247    HD3  ARG  34          3HD       ARG  34   6.142  -0.432  -3.239
  248    HE   ARG  34           HE       ARG  34   6.763  -1.761  -5.020
  249   HH11  ARG  34          1HH1      ARG  34   3.396  -0.911  -5.270
  250   HH12  ARG  34          2HH1      ARG  34   3.239  -1.482  -6.899
  251   HH21  ARG  34          1HH2      ARG  34   6.569  -2.514  -7.165
  252   HH22  ARG  34          2HH2      ARG  34   5.044  -2.395  -7.975
  253    H    ILE  35           HN       ILE  35   0.318  -3.685  -3.553
  254    HA   ILE  35           HA       ILE  35   0.917  -6.252  -4.874
  255    HB   ILE  35           HB       ILE  35  -1.526  -5.380  -3.373
  256   HG12  ILE  35          2HG1      ILE  35  -1.306  -7.808  -2.596
  257   HG13  ILE  35          3HG1      ILE  35   0.253  -7.814  -3.411
  258   HG21  ILE  35          1HG2      ILE  35  -1.434  -6.988  -5.831
  259   HG22  ILE  35          2HG2      ILE  35  -2.342  -7.702  -4.498
  260   HG23  ILE  35          3HG2      ILE  35  -2.773  -6.102  -5.101
  261   HD11  ILE  35          1HD1      ILE  35   1.219  -6.456  -1.867
  262   HD12  ILE  35          2HD1      ILE  35  -0.294  -5.640  -1.473
  263   HD13  ILE  35          3HD1      ILE  35   0.023  -7.260  -0.850
  264    H    GLN  36           HN       GLN  36   1.203  -5.720  -6.959
  265    HA   GLN  36           HA       GLN  36   0.303  -3.616  -8.405
  266    HB2  GLN  36          2HB       GLN  36   0.915  -6.438  -9.135
  267    HB3  GLN  36          3HB       GLN  36   0.167  -5.415 -10.354
  268    HG2  GLN  36          2HG       GLN  36   2.507  -4.309  -8.924
  269    HG3  GLN  36          3HG       GLN  36   2.801  -5.628 -10.056
  270   HE21  GLN  36          1HE2      GLN  36   0.300  -3.182 -10.323
  271   HE22  GLN  36          2HE2      GLN  36   0.921  -2.432 -11.751
  272    H    GLU  37           HN       GLU  37  -1.654  -2.781  -8.653
  273    HA   GLU  37           HA       GLU  37  -3.996  -4.524  -8.530
  274    HB2  GLU  37          2HB       GLU  37  -3.664  -1.529  -8.393
  275    HB3  GLU  37          3HB       GLU  37  -5.237  -2.309  -8.487
  276    HG2  GLU  37          2HG       GLU  37  -3.527  -3.396  -6.392
  277    HG3  GLU  37          3HG       GLU  37  -3.895  -1.685  -6.189
  278    H    SER  38           HN       SER  38  -5.550  -4.626 -10.143
  279    HA   SER  38           HA       SER  38  -4.563  -4.234 -12.812
  280    HB2  SER  38          2HB       SER  38  -6.050  -6.160 -11.959
  281    HB3  SER  38          3HB       SER  38  -7.386  -5.018 -12.113
  282    HG   SER  38           HG       SER  38  -5.622  -5.397 -14.266
  283    H    ASN  39           HN       ASN  39  -4.336  -1.951 -12.903
  284    HA   ASN  39           HA       ASN  39  -6.477  -0.599 -14.090
  285    HB2  ASN  39          2HB       ASN  39  -7.104   1.016 -12.404
  286    HB3  ASN  39          3HB       ASN  39  -7.356  -0.601 -11.755
  287   HD21  ASN  39          1HD2      ASN  39  -6.619  -0.949  -9.795
  288   HD22  ASN  39          2HD2      ASN  39  -5.369  -0.057  -9.003
  289    H    GLY  40           HN       GLY  40  -3.451  -0.436 -12.332
  290    HA2  GLY  40          1HA       GLY  40  -1.660   0.542 -13.856
  291    HA3  GLY  40          2HA       GLY  40  -2.706   1.954 -13.893
  292    H    THR  41           HN       THR  41  -3.101   0.776 -10.893
  293    HA   THR  41           HA       THR  41  -0.875   2.378  -9.812
  294    HB   THR  41           HB       THR  41  -3.160   3.385  -9.507
  295    HG1  THR  41          1HG       THR  41  -1.194   3.433  -7.949
  296   HG21  THR  41          1HG2      THR  41  -3.677   0.739  -8.455
  297   HG22  THR  41          2HG2      THR  41  -4.812   2.022  -8.876
  298   HG23  THR  41          3HG2      THR  41  -4.074   1.988  -7.276
  299    H    TRP  42           HN       TRP  42  -1.545   1.695  -7.085
  300    HA   TRP  42           HA       TRP  42  -1.366  -1.168  -6.838
  301    HB2  TRP  42          2HB       TRP  42   0.842  -1.191  -5.758
  302    HB3  TRP  42          3HB       TRP  42   0.950  -0.636  -7.427
  303    HD1  TRP  42          1HD       TRP  42   1.943   1.739  -7.844
  304    HE1  TRP  42          1HE       TRP  42   2.923   3.563  -6.316
  305    HE3  TRP  42          3HE       TRP  42   0.524  -0.150  -3.310
  306    HZ2  TRP  42          2HZ       TRP  42   3.075   4.128  -3.555
  307    HZ3  TRP  42          3HZ       TRP  42   1.125   1.094  -1.274
  308    HH2  TRP  42          2HH       TRP  42   2.375   3.188  -1.396
  309    H    ARG  43           HN       ARG  43  -1.454  -1.888  -4.634
  310    HA   ARG  43           HA       ARG  43  -1.963   0.169  -2.620
  311    HB2  ARG  43          2HB       ARG  43  -3.919  -1.956  -3.476
  312    HB3  ARG  43          3HB       ARG  43  -4.005  -1.192  -1.895
  313    HG2  ARG  43          2HG       ARG  43  -3.800   0.774  -3.998
  314    HG3  ARG  43          3HG       ARG  43  -5.173  -0.304  -4.249
  315    HD2  ARG  43          2HD       ARG  43  -4.808   0.655  -1.492
  316    HD3  ARG  43          3HD       ARG  43  -5.223   1.897  -2.673
  317    HE   ARG  43           HE       ARG  43  -6.926  -0.198  -1.690
  318   HH11  ARG  43          1HH1      ARG  43  -6.318   1.995  -4.324
  319   HH12  ARG  43          2HH1      ARG  43  -7.956   1.982  -4.885
  320   HH21  ARG  43          1HH2      ARG  43  -9.086  -0.224  -2.418
  321   HH22  ARG  43          2HH2      ARG  43  -9.532   0.720  -3.800
  322    H    CYS  44           HN       CYS  44  -1.384  -0.407  -0.576
  323    HA   CYS  44           HA       CYS  44   0.499  -2.342  -0.116
  324    HB2  CYS  44          2HB       CYS  44   0.230  -1.936   2.204
  325    HB3  CYS  44          3HB       CYS  44  -0.192  -0.423   1.407
  326    H    LYS  45           HN       LYS  45   0.400  -4.310   1.207
  327    HA   LYS  45           HA       LYS  45  -1.359  -6.209   0.143
  328    HB2  LYS  45          2HB       LYS  45  -0.114  -6.700   2.806
  329    HB3  LYS  45          3HB       LYS  45  -0.229  -7.763   1.410
  330    HG2  LYS  45          2HG       LYS  45   1.410  -6.058   0.322
  331    HG3  LYS  45          3HG       LYS  45   1.753  -5.615   1.996
  332    HD2  LYS  45          2HD       LYS  45   3.211  -7.307   2.005
  333    HD3  LYS  45          3HD       LYS  45   1.809  -8.381   2.023
  334    HE2  LYS  45          2HE       LYS  45   1.825  -8.379  -0.447
  335    HE3  LYS  45          3HE       LYS  45   3.280  -7.384  -0.415
  336    HZ1  LYS  45          1HZ       LYS  45   2.985 -10.213   0.003
  337    HZ2  LYS  45          2HZ       LYS  45   3.928  -9.462   1.190
  338    HZ3  LYS  45          3HZ       LYS  45   4.354  -9.324  -0.442
  339    H    VAL  46           HN       VAL  46  -1.753  -3.992   2.726
  340    HA   VAL  46           HA       VAL  46  -3.850  -5.485   4.048
  341    HB   VAL  46           HB       VAL  46  -3.363  -2.571   4.531
  342   HG11  VAL  46          1HG1      VAL  46  -4.253  -2.964   6.610
  343   HG12  VAL  46          2HG1      VAL  46  -5.128  -4.158   5.651
  344   HG13  VAL  46          3HG1      VAL  46  -3.747  -4.652   6.630
  345   HG21  VAL  46          1HG2      VAL  46  -1.568  -3.195   6.130
  346   HG22  VAL  46          2HG2      VAL  46  -1.591  -4.827   5.462
  347   HG23  VAL  46          3HG2      VAL  46  -1.131  -3.464   4.443
  348    H    CYS  47           HN       CYS  47  -3.577  -3.225   1.479
  349    HA   CYS  47           HA       CYS  47  -6.408  -2.502   1.619
  350    HB2  CYS  47          2HB       CYS  47  -4.042  -1.449   0.114
  351    HB3  CYS  47          3HB       CYS  47  -5.663  -1.137  -0.499
  352    H    ALA  48           HN       ALA  48  -4.088  -3.972  -0.635
  353    HA   ALA  48           HA       ALA  48  -5.995  -4.619  -2.622
  354    HB1  ALA  48          1HB       ALA  48  -4.190  -6.247  -3.379
  355    HB2  ALA  48          2HB       ALA  48  -3.756  -4.538  -3.323
  356    HB3  ALA  48          3HB       ALA  48  -3.225  -5.624  -2.039
  357    H    LYS  49           HN       LYS  49  -5.332  -5.977   0.424
  358    HA   LYS  49           HA       LYS  49  -6.737  -8.462  -0.308
  359    HB2  LYS  49          2HB       LYS  49  -4.426  -8.750   0.574
  360    HB3  LYS  49          3HB       LYS  49  -4.934  -7.981   2.072
  361    HG2  LYS  49          2HG       LYS  49  -5.513  -9.974   2.836
  362    HG3  LYS  49          3HG       LYS  49  -6.776 -10.039   1.604
  363    HD2  LYS  49          2HD       LYS  49  -5.435 -11.254   0.127
  364    HD3  LYS  49          3HD       LYS  49  -3.948 -10.810   0.967
  365    HE2  LYS  49          2HE       LYS  49  -5.911 -12.285   2.586
  366    HE3  LYS  49          3HE       LYS  49  -5.223 -13.191   1.240
  367    HZ1  LYS  49          1HZ       LYS  49  -4.073 -12.762   3.701
  368    HZ2  LYS  49          2HZ       LYS  49  -3.209 -11.764   2.646
  369    HZ3  LYS  49          3HZ       LYS  49  -3.325 -13.422   2.335
  370    H    GLU  50           HN       GLU  50  -6.337  -6.162   2.388
  371    HA   GLU  50           HA       GLU  50  -7.794  -5.386   3.953
  372    HB2  GLU  50          2HB       GLU  50  -9.723  -6.181   1.780
  373    HB3  GLU  50          3HB       GLU  50 -10.269  -5.473   3.292
  374    HG2  GLU  50          2HG       GLU  50  -8.124  -3.953   2.060
  375    HG3  GLU  50          3HG       GLU  50  -9.540  -4.107   1.022
  376    H    ILE  51           HN       ILE  51  -7.087  -7.088   5.364
  377    HA   ILE  51           HA       ILE  51  -9.067  -9.240   5.718
  378    HB   ILE  51           HB       ILE  51  -6.767 -10.018   5.237
  379   HG12  ILE  51          2HG1      ILE  51  -7.156 -10.788   8.075
  380   HG13  ILE  51          3HG1      ILE  51  -8.531 -11.034   7.004
  381   HG21  ILE  51          1HG2      ILE  51  -5.777  -8.002   6.522
  382   HG22  ILE  51          2HG2      ILE  51  -5.931  -9.042   7.938
  383   HG23  ILE  51          3HG2      ILE  51  -4.934  -9.550   6.574
  384   HD11  ILE  51          1HD1      ILE  51  -6.251 -12.024   5.674
  385   HD12  ILE  51          2HD1      ILE  51  -6.209 -12.635   7.329
  386   HD13  ILE  51          3HD1      ILE  51  -7.624 -12.923   6.317
  387    H    GLU  52           HN       GLU  52  -8.371  -6.303   6.886
  388    HA   GLU  52           HA       GLU  52  -9.180  -7.032   9.623
  389    HB2  GLU  52          2HB       GLU  52  -6.933  -5.439   8.711
  390    HB3  GLU  52          3HB       GLU  52  -7.974  -4.524   9.793
  391    HG2  GLU  52          2HG       GLU  52  -7.826  -6.615  11.308
  392    HG3  GLU  52          3HG       GLU  52  -6.415  -7.013  10.330
  393    H    LEU  53           HN       LEU  53  -9.898  -5.326   6.799
  394    HA   LEU  53           HA       LEU  53 -11.925  -3.726   8.219
  395    HB2  LEU  53          2HB       LEU  53 -10.645  -3.085   5.567
  396    HB3  LEU  53          3HB       LEU  53 -11.799  -2.087   6.449
  397    HG   LEU  53           HG       LEU  53  -9.772  -1.034   6.842
  398   HD11  LEU  53          1HD1      LEU  53 -11.098  -1.870   8.930
  399   HD12  LEU  53          2HD1      LEU  53  -9.519  -1.110   9.125
  400   HD13  LEU  53          3HD1      LEU  53  -9.666  -2.866   9.194
  401   HD21  LEU  53          1HD2      LEU  53  -8.448  -3.672   7.439
  402   HD22  LEU  53          2HD2      LEU  53  -7.680  -2.097   7.233
  403   HD23  LEU  53          3HD2      LEU  53  -8.422  -2.905   5.852
  Start of MODEL    8
    1    H1   SER   1           HN       SER   1   9.200   9.077  11.787
    2    HA   SER   1           HA       SER   1   7.819  10.735   9.883
    3    HB2  SER   1          2HB       SER   1   7.550  12.172  11.801
    4    HB3  SER   1          3HB       SER   1   9.249  11.989  12.236
    5    HG   SER   1           HG       SER   1   9.831  13.212  10.507
    6    H    ASP   2           HN       ASP   2   9.923   8.650  10.034
    7    HA   ASP   2           HA       ASP   2  12.148  10.151   8.816
    8    HB2  ASP   2          2HB       ASP   2  12.104   8.037  10.779
    9    HB3  ASP   2          3HB       ASP   2  13.011   7.528   9.358
   10    H    ARG   3           HN       ARG   3   9.505   8.441   8.000
   11    HA   ARG   3           HA       ARG   3   8.845   7.699   5.924
   12    HB2  ARG   3          2HB       ARG   3  11.699   7.449   5.030
   13    HB3  ARG   3          3HB       ARG   3  10.260   7.758   4.067
   14    HG2  ARG   3          2HG       ARG   3  10.636   9.872   5.966
   15    HG3  ARG   3          3HG       ARG   3  12.112   9.620   5.031
   16    HD2  ARG   3          2HD       ARG   3  11.172  10.338   3.112
   17    HD3  ARG   3          3HD       ARG   3   9.618   9.587   3.474
   18    HE   ARG   3           HE       ARG   3   8.923  11.550   4.464
   19   HH11  ARG   3          1HH1      ARG   3  12.335  11.700   3.784
   20   HH12  ARG   3          2HH1      ARG   3  12.458  13.396   4.112
   21   HH21  ARG   3          1HH2      ARG   3   9.073  13.784   4.899
   22   HH22  ARG   3          2HH2      ARG   3  10.603  14.581   4.747
   23    H    THR   4           HN       THR   4   8.639   5.951   7.743
   24    HA   THR   4           HA       THR   4  10.150   3.557   6.925
   25    HB   THR   4           HB       THR   4   8.669   3.181   9.374
   26    HG1  THR   4          1HG       THR   4  10.683   5.165   9.580
   27   HG21  THR   4          1HG2      THR   4  10.479   1.745   8.845
   28   HG22  THR   4          2HG2      THR   4  11.018   2.721  10.213
   29   HG23  THR   4          3HG2      THR   4  11.574   3.102   8.584
   30    H    CYS   5           HN       CYS   5   9.083   1.724   6.322
   31    HA   CYS   5           HA       CYS   5   6.653   1.821   5.083
   32    HB2  CYS   5          2HB       CYS   5   8.311  -0.048   4.936
   33    HB3  CYS   5          3HB       CYS   5   7.737  -0.621   6.499
   34    H    ALA   6           HN       ALA   6   4.529   1.286   5.595
   35    HA   ALA   6           HA       ALA   6   3.846   1.653   8.411
   36    HB1  ALA   6          1HB       ALA   6   1.876   2.546   7.732
   37    HB2  ALA   6          2HB       ALA   6   2.801   2.832   6.257
   38    HB3  ALA   6          3HB       ALA   6   1.719   1.443   6.365
   39    H    ARG   7           HN       ARG   7   4.713  -0.914   6.795
   40    HA   ARG   7           HA       ARG   7   2.712  -2.645   8.080
   41    HB2  ARG   7          2HB       ARG   7   4.033  -3.327   5.457
   42    HB3  ARG   7          3HB       ARG   7   2.672  -4.131   6.225
   43    HG2  ARG   7          2HG       ARG   7   2.575  -1.300   5.215
   44    HG3  ARG   7          3HG       ARG   7   2.095  -2.703   4.258
   45    HD2  ARG   7          2HD       ARG   7   0.088  -2.671   5.201
   46    HD3  ARG   7          3HD       ARG   7   0.821  -2.879   6.791
   47    HE   ARG   7           HE       ARG   7   0.569  -0.620   7.182
   48   HH11  ARG   7          1HH1      ARG   7  -0.142  -1.346   3.852
   49   HH12  ARG   7          2HH1      ARG   7  -0.821   0.214   3.521
   50   HH21  ARG   7          1HH2      ARG   7  -0.323   1.436   6.759
   51   HH22  ARG   7          2HH2      ARG   7  -0.922   1.796   5.175
   52    H    CYS   8           HN       CYS   8   6.018  -2.183   6.995
   53    HA   CYS   8           HA       CYS   8   6.853  -4.520   8.573
   54    HB2  CYS   8          2HB       CYS   8   8.469  -2.990   6.526
   55    HB3  CYS   8          3HB       CYS   8   8.902  -4.517   7.288
   56    H    GLN   9           HN       GLN   9   7.137  -1.070   8.259
   57    HA   GLN   9           HA       GLN   9   7.893   0.506   9.727
   58    HB2  GLN   9          2HB       GLN   9   7.513  -1.793  11.357
   59    HB3  GLN   9          3HB       GLN   9   9.039  -1.055  11.826
   60    HG2  GLN   9          2HG       GLN   9   6.724   0.752  11.487
   61    HG3  GLN   9          3HG       GLN   9   6.699  -0.341  12.870
   62   HE21  GLN   9          1HE2      GLN   9   9.039   1.746  11.200
   63   HE22  GLN   9          2HE2      GLN   9   9.688   2.454  12.636
   64    H    GLU  10           HN       GLU  10   9.539  -0.740   7.684
   65    HA   GLU  10           HA       GLU  10  12.215  -0.541   8.884
   66    HB2  GLU  10          2HB       GLU  10  11.091  -2.029   6.586
   67    HB3  GLU  10          3HB       GLU  10  12.707  -1.377   6.365
   68    HG2  GLU  10          2HG       GLU  10  12.047  -2.953   8.812
   69    HG3  GLU  10          3HG       GLU  10  12.404  -3.771   7.293
   70    H    SER  11           HN       SER  11  13.880   0.593   7.636
   71    HA   SER  11           HA       SER  11  13.047   3.202   6.936
   72    HB2  SER  11          2HB       SER  11  15.214   3.119   7.794
   73    HB3  SER  11          3HB       SER  11  15.657   1.723   6.811
   74    HG   SER  11           HG       SER  11  16.276   3.028   5.290
   75    H    LEU  12           HN       LEU  12  12.752   4.187   4.994
   76    HA   LEU  12           HA       LEU  12  12.404   2.438   2.695
   77    HB2  LEU  12          2HB       LEU  12  11.616   5.262   3.321
   78    HB3  LEU  12          3HB       LEU  12  11.519   4.630   1.679
   79    HG   LEU  12           HG       LEU  12   9.445   4.619   3.338
   80   HD11  LEU  12          1HD1      LEU  12   8.474   3.527   1.656
   81   HD12  LEU  12          2HD1      LEU  12   9.499   2.108   1.874
   82   HD13  LEU  12          3HD1      LEU  12  10.073   3.471   0.913
   83   HD21  LEU  12          1HD2      LEU  12  10.716   1.929   3.829
   84   HD22  LEU  12          2HD2      LEU  12   9.156   2.493   4.429
   85   HD23  LEU  12          3HD2      LEU  12  10.646   3.238   5.011
   86    H    GLY  13           HN       GLY  13  15.080   3.388   3.777
   87    HA2  GLY  13          1HA       GLY  13  16.402   5.244   2.327
   88    HA3  GLY  13          2HA       GLY  13  17.122   3.693   2.732
   89    H    ARG  14           HN       ARG  14  17.319   5.491   0.328
   90    HA   ARG  14           HA       ARG  14  17.110   5.393  -1.974
   91    HB2  ARG  14          2HB       ARG  14  18.407   2.855  -1.040
   92    HB3  ARG  14          3HB       ARG  14  18.154   3.133  -2.757
   93    HG2  ARG  14          2HG       ARG  14  20.020   4.315  -2.823
   94    HG3  ARG  14          3HG       ARG  14  19.309   5.481  -1.704
   95    HD2  ARG  14          2HD       ARG  14  21.453   4.593  -0.888
   96    HD3  ARG  14          3HD       ARG  14  20.113   4.202   0.189
   97    HE   ARG  14           HE       ARG  14  20.470   1.984  -0.234
   98   HH11  ARG  14          1HH1      ARG  14  22.093   3.879  -2.662
   99   HH12  ARG  14          2HH1      ARG  14  22.906   2.520  -3.367
  100   HH21  ARG  14          1HH2      ARG  14  21.535   0.186  -1.153
  101   HH22  ARG  14          2HH2      ARG  14  22.586   0.420  -2.508
  102    H    LEU  15           HN       LEU  15  14.610   5.116  -1.217
  103    HA   LEU  15           HA       LEU  15  13.591   2.957  -2.925
  104    HB2  LEU  15          2HB       LEU  15  13.433   2.562  -0.365
  105    HB3  LEU  15          3HB       LEU  15  12.134   3.750  -0.435
  106    HG   LEU  15           HG       LEU  15  10.810   2.334  -1.825
  107   HD11  LEU  15          1HD1      LEU  15  11.873  -0.056  -2.224
  108   HD12  LEU  15          2HD1      LEU  15  13.370   0.876  -2.192
  109   HD13  LEU  15          3HD1      LEU  15  12.111   1.271  -3.362
  110   HD21  LEU  15          1HD2      LEU  15  11.858   1.417   0.718
  111   HD22  LEU  15          2HD2      LEU  15  11.282   0.084  -0.284
  112   HD23  LEU  15          3HD2      LEU  15  10.201   1.421   0.113
  113    H    SER  16           HN       SER  16  13.092   6.099  -1.433
  114    HA   SER  16           HA       SER  16  12.113   7.975  -2.339
  115    HB2  SER  16          2HB       SER  16  12.463   6.549  -4.589
  116    HB3  SER  16          3HB       SER  16  10.702   6.517  -4.510
  117    HG   SER  16           HG       SER  16  10.941   8.893  -4.181
  118    HA   PRO  17           HA       PRO  17   8.374   6.418  -0.132
  119    HB2  PRO  17          2HB       PRO  17   8.385   8.397   1.726
  120    HB3  PRO  17          3HB       PRO  17   9.335   6.916   1.894
  121    HG2  PRO  17          2HG       PRO  17  10.202   9.626   0.965
  122    HG3  PRO  17          3HG       PRO  17  11.026   8.504   2.063
  123    HD2  PRO  17          2HD       PRO  17  11.712   8.761  -0.544
  124    HD3  PRO  17          3HD       PRO  17  11.854   7.224   0.333
  125    H    LYS  18           HN       LYS  18   9.131   8.911  -2.143
  126    HA   LYS  18           HA       LYS  18   6.891  10.643  -1.687
  127    HB2  LYS  18          2HB       LYS  18   8.804  11.629  -2.698
  128    HB3  LYS  18          3HB       LYS  18   8.883  10.382  -3.935
  129    HG2  LYS  18          2HG       LYS  18   7.229  11.322  -5.190
  130    HG3  LYS  18          3HG       LYS  18   6.436  12.059  -3.795
  131    HD2  LYS  18          2HD       LYS  18   8.238  13.706  -3.640
  132    HD3  LYS  18          3HD       LYS  18   9.043  12.962  -5.023
  133    HE2  LYS  18          2HE       LYS  18   7.927  14.692  -6.043
  134    HE3  LYS  18          3HE       LYS  18   6.747  13.393  -6.203
  135    HZ1  LYS  18          1HZ       LYS  18   6.521  14.918  -3.764
  136    HZ2  LYS  18          2HZ       LYS  18   5.319  14.420  -4.844
  137    HZ3  LYS  18          3HZ       LYS  18   6.221  15.814  -5.167
  138    H    THR  19           HN       THR  19   7.663   8.087  -4.020
  139    HA   THR  19           HA       THR  19   4.861   8.143  -4.923
  140    HB   THR  19           HB       THR  19   5.495   7.457  -7.010
  141    HG1  THR  19          1HG       THR  19   7.894   6.447  -6.953
  142   HG21  THR  19          1HG2      THR  19   6.779   9.571  -6.276
  143   HG22  THR  19          2HG2      THR  19   7.287   8.757  -7.756
  144   HG23  THR  19          3HG2      THR  19   8.198   8.525  -6.264
  145    H    ASN  20           HN       ASN  20   5.947   6.835  -2.481
  146    HA   ASN  20           HA       ASN  20   5.173   4.064  -3.123
  147    HB2  ASN  20          2HB       ASN  20   7.239   5.120  -1.206
  148    HB3  ASN  20          3HB       ASN  20   6.531   3.521  -0.991
  149   HD21  ASN  20          1HD2      ASN  20   9.278   4.417  -1.655
  150   HD22  ASN  20          2HD2      ASN  20   9.692   3.566  -3.101
  151    H    THR  21           HN       THR  21   3.742   6.605  -2.108
  152    HA   THR  21           HA       THR  21   2.732   5.656   0.460
  153    HB   THR  21           HB       THR  21   2.046   8.172  -1.072
  154    HG1  THR  21          1HG       THR  21   3.584   9.132   0.111
  155   HG21  THR  21          1HG2      THR  21   1.090   8.921   1.082
  156   HG22  THR  21          2HG2      THR  21   1.380   7.313   1.746
  157   HG23  THR  21          3HG2      THR  21   0.242   7.527   0.416
  158    H    CYS  22           HN       CYS  22   1.282   4.058   0.267
  159    HA   CYS  22           HA       CYS  22  -0.306   3.363  -1.831
  160    HB2  CYS  22          2HB       CYS  22  -0.087   2.045   0.245
  161    HB3  CYS  22          3HB       CYS  22  -1.099   3.216   1.085
  162    H    ARG  23           HN       ARG  23  -2.042   4.149  -2.847
  163    HA   ARG  23           HA       ARG  23  -3.107   6.701  -2.031
  164    HB2  ARG  23          2HB       ARG  23  -4.495   5.354  -4.223
  165    HB3  ARG  23          3HB       ARG  23  -3.709   6.927  -4.185
  166    HG2  ARG  23          2HG       ARG  23  -1.515   5.537  -4.278
  167    HG3  ARG  23          3HG       ARG  23  -2.573   4.260  -4.883
  168    HD2  ARG  23          2HD       ARG  23  -2.331   5.169  -6.901
  169    HD3  ARG  23          3HD       ARG  23  -3.330   6.502  -6.321
  170    HE   ARG  23           HE       ARG  23  -1.483   7.816  -6.474
  171   HH11  ARG  23          1HH1      ARG  23  -0.441   4.536  -5.949
  172   HH12  ARG  23          2HH1      ARG  23   1.246   4.921  -6.024
  173   HH21  ARG  23          1HH2      ARG  23   0.735   8.336  -6.575
  174   HH22  ARG  23          2HH2      ARG  23   1.914   7.084  -6.379
  175    H    GLY  24           HN       GLY  24  -3.647   3.958  -0.652
  176    HA2  GLY  24          1HA       GLY  24  -6.592   4.157  -0.647
  177    HA3  GLY  24          2HA       GLY  24  -5.688   2.710  -0.226
  178    H    CYS  25           HN       CYS  25  -3.796   3.740   1.502
  179    HA   CYS  25           HA       CYS  25  -5.494   4.574   3.755
  180    HB2  CYS  25          2HB       CYS  25  -3.452   3.688   5.098
  181    HB3  CYS  25          3HB       CYS  25  -4.561   2.530   4.371
  182    H    ASN  26           HN       ASN  26  -2.748   5.417   1.833
  183    HA   ASN  26           HA       ASN  26  -1.712   7.463   1.647
  184    HB2  ASN  26          2HB       ASN  26  -3.894   8.200   3.046
  185    HB3  ASN  26          3HB       ASN  26  -2.655   8.493   4.264
  186   HD21  ASN  26          1HD2      ASN  26  -3.753   9.313   1.045
  187   HD22  ASN  26          2HD2      ASN  26  -2.911  10.817   0.934
  188    H    HIS  27           HN       HIS  27  -0.794   5.058   3.084
  189    HA   HIS  27           HA       HIS  27   1.203   6.322   4.846
  190    HB2  HIS  27          2HB       HIS  27   0.242   3.457   4.967
  191    HB3  HIS  27          3HB       HIS  27   1.341   4.250   6.092
  192    HD1  HIS  27          1HD       HIS  27  -0.237   6.836   6.623
  193    HD2  HIS  27          2HD       HIS  27  -1.931   3.042   6.552
  194    HE1  HIS  27          1HE       HIS  27  -2.341   7.013   7.989
  195    H    LEU  28           HN       LEU  28   3.321   5.231   4.894
  196    HA   LEU  28           HA       LEU  28   4.266   4.776   2.234
  197    HB2  LEU  28          2HB       LEU  28   5.588   4.657   4.933
  198    HB3  LEU  28          3HB       LEU  28   6.450   4.323   3.432
  199    HG   LEU  28           HG       LEU  28   5.213   6.937   4.287
  200   HD11  LEU  28          1HD1      LEU  28   7.395   6.330   5.287
  201   HD12  LEU  28          2HD1      LEU  28   7.471   7.759   4.257
  202   HD13  LEU  28          3HD1      LEU  28   8.071   6.211   3.662
  203   HD21  LEU  28          1HD2      LEU  28   6.648   7.449   2.019
  204   HD22  LEU  28          2HD2      LEU  28   4.893   7.291   2.100
  205   HD23  LEU  28          3HD2      LEU  28   5.883   5.907   1.633
  206    H    VAL  29           HN       VAL  29   5.140   2.902   1.352
  207    HA   VAL  29           HA       VAL  29   5.025   0.419   2.849
  208    HB   VAL  29           HB       VAL  29   3.740  -0.105   0.342
  209   HG11  VAL  29          1HG1      VAL  29   2.300  -1.380   1.642
  210   HG12  VAL  29          2HG1      VAL  29   3.781  -1.358   2.601
  211   HG13  VAL  29          3HG1      VAL  29   2.436  -0.301   3.030
  212   HG21  VAL  29          1HG2      VAL  29   2.349   1.930   2.080
  213   HG22  VAL  29          2HG2      VAL  29   2.936   2.189   0.438
  214   HG23  VAL  29          3HG2      VAL  29   1.613   1.061   0.733
  215    H    CYS  30           HN       CYS  30   6.868  -0.580   2.415
  216    HA   CYS  30           HA       CYS  30   8.729   0.103   0.522
  217    HB2  CYS  30          2HB       CYS  30   9.711  -2.142   0.865
  218    HB3  CYS  30          3HB       CYS  30   9.257  -1.371   2.382
  219    H    ARG  31           HN       ARG  31   9.546  -1.640  -1.177
  220    HA   ARG  31           HA       ARG  31   7.462  -1.755  -3.178
  221    HB2  ARG  31          2HB       ARG  31   9.223  -2.380  -4.716
  222    HB3  ARG  31          3HB       ARG  31   9.761  -1.022  -3.738
  223    HG2  ARG  31          2HG       ARG  31  11.592  -2.181  -3.287
  224    HG3  ARG  31          3HG       ARG  31  10.589  -3.278  -2.338
  225    HD2  ARG  31          2HD       ARG  31  11.437  -4.818  -3.757
  226    HD3  ARG  31          3HD       ARG  31  10.125  -4.257  -4.791
  227    HE   ARG  31           HE       ARG  31  12.202  -2.611  -5.408
  228   HH11  ARG  31          1HH1      ARG  31  11.769  -6.064  -5.324
  229   HH12  ARG  31          2HH1      ARG  31  12.906  -6.369  -6.596
  230   HH21  ARG  31          1HH2      ARG  31  13.701  -2.999  -7.083
  231   HH22  ARG  31          2HH2      ARG  31  14.005  -4.625  -7.595
  232    H    ASP  32           HN       ASP  32   7.649  -3.583  -0.717
  233    HA   ASP  32           HA       ASP  32   7.282  -6.103  -2.199
  234    HB2  ASP  32          2HB       ASP  32   9.371  -5.947  -0.707
  235    HB3  ASP  32          3HB       ASP  32   8.251  -5.998   0.651
  236    H    CYS  33           HN       CYS  33   5.946  -3.773  -0.169
  237    HA   CYS  33           HA       CYS  33   3.925  -5.602   0.908
  238    HB2  CYS  33          2HB       CYS  33   4.740  -2.786   1.579
  239    HB3  CYS  33          3HB       CYS  33   3.196  -3.435   2.123
  240    H    ARG  34           HN       ARG  34   4.384  -3.886  -1.826
  241    HA   ARG  34           HA       ARG  34   1.659  -2.873  -2.066
  242    HB2  ARG  34          2HB       ARG  34   3.406  -2.756  -4.429
  243    HB3  ARG  34          3HB       ARG  34   2.436  -1.496  -3.680
  244    HG2  ARG  34          2HG       ARG  34   4.187  -1.331  -1.898
  245    HG3  ARG  34          3HG       ARG  34   5.177  -2.421  -2.869
  246    HD2  ARG  34          2HD       ARG  34   4.498   0.419  -3.292
  247    HD3  ARG  34          3HD       ARG  34   5.964  -0.470  -3.703
  248    HE   ARG  34           HE       ARG  34   3.674  -0.031  -5.382
  249   HH11  ARG  34          1HH1      ARG  34   6.412  -2.088  -4.757
  250   HH12  ARG  34          2HH1      ARG  34   6.498  -2.687  -6.380
  251   HH21  ARG  34          1HH2      ARG  34   3.776  -0.812  -7.523
  252   HH22  ARG  34          2HH2      ARG  34   4.998  -1.961  -7.953
  253    H    ILE  35           HN       ILE  35   0.115  -3.732  -3.376
  254    HA   ILE  35           HA       ILE  35   0.749  -6.332  -4.598
  255    HB   ILE  35           HB       ILE  35  -1.681  -5.260  -3.260
  256   HG12  ILE  35          2HG1      ILE  35  -1.775  -7.719  -2.575
  257   HG13  ILE  35          3HG1      ILE  35  -0.212  -7.893  -3.366
  258   HG21  ILE  35          1HG2      ILE  35  -1.702  -6.968  -5.700
  259   HG22  ILE  35          2HG2      ILE  35  -2.881  -7.279  -4.427
  260   HG23  ILE  35          3HG2      ILE  35  -2.818  -5.697  -5.203
  261   HD11  ILE  35          1HD1      ILE  35   0.880  -6.664  -1.774
  262   HD12  ILE  35          2HD1      ILE  35  -0.570  -5.769  -1.313
  263   HD13  ILE  35          3HD1      ILE  35  -0.369  -7.446  -0.805
  264    H    GLN  36           HN       GLN  36   1.264  -5.948  -6.677
  265    HA   GLN  36           HA       GLN  36   0.542  -3.933  -8.346
  266    HB2  GLN  36          2HB       GLN  36   1.555  -6.616  -8.668
  267    HB3  GLN  36          3HB       GLN  36   0.468  -6.209  -9.989
  268    HG2  GLN  36          2HG       GLN  36   3.006  -4.841  -9.171
  269    HG3  GLN  36          3HG       GLN  36   2.605  -5.589 -10.715
  270   HE21  GLN  36          1HE2      GLN  36  -0.108  -4.370 -10.600
  271   HE22  GLN  36          2HE2      GLN  36   0.123  -2.724 -11.067
  272    H    GLU  37           HN       GLU  37  -1.462  -3.122  -8.499
  273    HA   GLU  37           HA       GLU  37  -3.781  -4.846  -8.590
  274    HB2  GLU  37          2HB       GLU  37  -3.438  -1.850  -8.708
  275    HB3  GLU  37          3HB       GLU  37  -5.002  -2.638  -8.856
  276    HG2  GLU  37          2HG       GLU  37  -3.241  -3.193  -6.507
  277    HG3  GLU  37          3HG       GLU  37  -4.248  -1.746  -6.559
  278    H    SER  38           HN       SER  38  -5.519  -3.990 -10.299
  279    HA   SER  38           HA       SER  38  -4.207  -4.221 -12.924
  280    HB2  SER  38          2HB       SER  38  -6.937  -5.119 -11.987
  281    HB3  SER  38          3HB       SER  38  -6.455  -5.103 -13.683
  282    HG   SER  38           HG       SER  38  -4.948  -6.647 -13.277
  283    H    ASN  39           HN       ASN  39  -5.279  -1.883 -11.070
  284    HA   ASN  39           HA       ASN  39  -6.946  -0.521 -13.049
  285    HB2  ASN  39          2HB       ASN  39  -7.578  -0.552 -10.609
  286    HB3  ASN  39          3HB       ASN  39  -6.165   0.452 -10.296
  287   HD21  ASN  39          1HD2      ASN  39  -6.306   2.587 -10.581
  288   HD22  ASN  39          2HD2      ASN  39  -7.684   3.409 -11.224
  289    H    GLY  40           HN       GLY  40  -3.774  -0.948 -12.660
  290    HA2  GLY  40          1HA       GLY  40  -2.167   0.206 -13.973
  291    HA3  GLY  40          2HA       GLY  40  -3.163   1.650 -13.873
  292    H    THR  41           HN       THR  41  -3.247   0.594 -10.842
  293    HA   THR  41           HA       THR  41  -0.762   1.985 -10.080
  294    HB   THR  41           HB       THR  41  -2.846   3.309  -9.630
  295    HG1  THR  41          1HG       THR  41  -1.105   3.809  -8.359
  296   HG21  THR  41          1HG2      THR  41  -4.492   1.779  -9.024
  297   HG22  THR  41          2HG2      THR  41  -4.042   2.499  -7.478
  298   HG23  THR  41          3HG2      THR  41  -3.419   0.912  -7.927
  299    H    TRP  42           HN       TRP  42  -1.138   1.556  -7.285
  300    HA   TRP  42           HA       TRP  42  -1.147  -1.351  -6.985
  301    HB2  TRP  42          2HB       TRP  42   0.991  -1.303  -5.748
  302    HB3  TRP  42          3HB       TRP  42   1.187  -0.806  -7.426
  303    HD1  TRP  42          1HD       TRP  42   2.042   1.637  -7.884
  304    HE1  TRP  42          1HE       TRP  42   2.946   3.507  -6.365
  305    HE3  TRP  42          3HE       TRP  42   0.676  -0.274  -3.344
  306    HZ2  TRP  42          2HZ       TRP  42   3.065   4.095  -3.608
  307    HZ3  TRP  42          3HZ       TRP  42   1.223   1.006  -1.313
  308    HH2  TRP  42          2HH       TRP  42   2.392   3.144  -1.445
  309    H    ARG  43           HN       ARG  43  -1.450  -2.072  -4.828
  310    HA   ARG  43           HA       ARG  43  -2.101  -0.011  -2.848
  311    HB2  ARG  43          2HB       ARG  43  -3.941  -2.150  -3.882
  312    HB3  ARG  43          3HB       ARG  43  -4.132  -1.507  -2.256
  313    HG2  ARG  43          2HG       ARG  43  -3.881   0.639  -4.144
  314    HG3  ARG  43          3HG       ARG  43  -5.162  -0.470  -4.637
  315    HD2  ARG  43          2HD       ARG  43  -4.973   0.469  -1.802
  316    HD3  ARG  43          3HD       ARG  43  -5.717   1.493  -3.032
  317    HE   ARG  43           HE       ARG  43  -6.769  -1.166  -3.032
  318   HH11  ARG  43          1HH1      ARG  43  -6.958   1.946  -1.483
  319   HH12  ARG  43          2HH1      ARG  43  -8.592   1.728  -0.950
  320   HH21  ARG  43          1HH2      ARG  43  -8.922  -1.466  -2.336
  321   HH22  ARG  43          2HH2      ARG  43  -9.707  -0.213  -1.435
  322    H    CYS  44           HN       CYS  44  -1.455  -0.501  -0.834
  323    HA   CYS  44           HA       CYS  44   0.364  -2.454  -0.256
  324    HB2  CYS  44          2HB       CYS  44  -0.017  -2.008   2.076
  325    HB3  CYS  44          3HB       CYS  44  -0.218  -0.498   1.194
  326    H    LYS  45           HN       LYS  45   0.105  -4.276   1.363
  327    HA   LYS  45           HA       LYS  45  -1.712  -6.190   0.286
  328    HB2  LYS  45          2HB       LYS  45  -0.386  -6.732   2.885
  329    HB3  LYS  45          3HB       LYS  45  -0.523  -7.751   1.458
  330    HG2  LYS  45          2HG       LYS  45   1.127  -6.090   0.383
  331    HG3  LYS  45          3HG       LYS  45   1.454  -5.582   2.042
  332    HD2  LYS  45          2HD       LYS  45   3.039  -7.214   1.813
  333    HD3  LYS  45          3HD       LYS  45   1.695  -8.187   2.417
  334    HE2  LYS  45          2HE       LYS  45   1.097  -8.636   0.008
  335    HE3  LYS  45          3HE       LYS  45   2.634  -7.891  -0.429
  336    HZ1  LYS  45          1HZ       LYS  45   3.416  -9.961  -0.224
  337    HZ2  LYS  45          2HZ       LYS  45   2.104 -10.494   0.699
  338    HZ3  LYS  45          3HZ       LYS  45   3.381  -9.669   1.441
  339    H    VAL  46           HN       VAL  46  -2.151  -3.746   2.487
  340    HA   VAL  46           HA       VAL  46  -4.154  -5.191   4.061
  341    HB   VAL  46           HB       VAL  46  -3.293  -2.324   4.426
  342   HG11  VAL  46          1HG1      VAL  46  -5.115  -4.164   5.797
  343   HG12  VAL  46          2HG1      VAL  46  -4.003  -3.304   6.865
  344   HG13  VAL  46          3HG1      VAL  46  -5.073  -2.402   5.790
  345   HG21  VAL  46          1HG2      VAL  46  -1.715  -3.054   6.080
  346   HG22  VAL  46          2HG2      VAL  46  -2.204  -4.737   5.873
  347   HG23  VAL  46          3HG2      VAL  46  -1.364  -3.895   4.570
  348    H    CYS  47           HN       CYS  47  -3.869  -3.054   1.411
  349    HA   CYS  47           HA       CYS  47  -6.671  -2.210   1.635
  350    HB2  CYS  47          2HB       CYS  47  -4.329  -1.197   0.045
  351    HB3  CYS  47          3HB       CYS  47  -5.975  -0.771  -0.406
  352    H    ALA  48           HN       ALA  48  -4.437  -3.991  -0.409
  353    HA   ALA  48           HA       ALA  48  -6.292  -4.434  -2.534
  354    HB1  ALA  48          1HB       ALA  48  -3.796  -5.991  -1.870
  355    HB2  ALA  48          2HB       ALA  48  -4.649  -5.966  -3.414
  356    HB3  ALA  48          3HB       ALA  48  -3.840  -4.513  -2.831
  357    H    LYS  49           HN       LYS  49  -5.451  -6.119   0.418
  358    HA   LYS  49           HA       LYS  49  -6.735  -8.573  -0.206
  359    HB2  LYS  49          2HB       LYS  49  -5.426  -7.360   2.104
  360    HB3  LYS  49          3HB       LYS  49  -6.797  -8.364   2.554
  361    HG2  LYS  49          2HG       LYS  49  -5.819 -10.290   1.785
  362    HG3  LYS  49          3HG       LYS  49  -4.795  -9.436   0.628
  363    HD2  LYS  49          2HD       LYS  49  -3.189  -8.986   2.176
  364    HD3  LYS  49          3HD       LYS  49  -4.347  -8.866   3.502
  365    HE2  LYS  49          2HE       LYS  49  -4.340 -11.127   3.891
  366    HE3  LYS  49          3HE       LYS  49  -3.911 -11.521   2.228
  367    HZ1  LYS  49          1HZ       LYS  49  -1.769 -10.112   3.213
  368    HZ2  LYS  49          2HZ       LYS  49  -1.847 -11.782   2.957
  369    HZ3  LYS  49          3HZ       LYS  49  -2.215 -11.142   4.479
  370    H    GLU  50           HN       GLU  50  -7.827  -5.528   1.096
  371    HA   GLU  50           HA       GLU  50  -9.950  -4.704   1.324
  372    HB2  GLU  50          2HB       GLU  50 -10.325  -6.855  -0.403
  373    HB3  GLU  50          3HB       GLU  50 -11.482  -7.134   0.891
  374    HG2  GLU  50          2HG       GLU  50 -12.142  -4.672   0.535
  375    HG3  GLU  50          3HG       GLU  50 -11.299  -4.831  -1.005
  376    H    ILE  51           HN       ILE  51 -10.847  -4.319   3.239
  377    HA   ILE  51           HA       ILE  51 -10.285  -5.587   5.570
  378    HB   ILE  51           HB       ILE  51 -12.697  -4.743   6.276
  379   HG12  ILE  51          2HG1      ILE  51 -12.835  -4.319   3.554
  380   HG13  ILE  51          3HG1      ILE  51 -13.859  -3.551   4.763
  381   HG21  ILE  51          1HG2      ILE  51 -10.395  -2.950   5.517
  382   HG22  ILE  51          2HG2      ILE  51 -11.732  -2.486   6.568
  383   HG23  ILE  51          3HG2      ILE  51 -10.631  -3.773   7.059
  384   HD11  ILE  51          1HD1      ILE  51 -12.356  -1.647   4.847
  385   HD12  ILE  51          2HD1      ILE  51 -11.294  -2.422   3.671
  386   HD13  ILE  51          3HD1      ILE  51 -12.922  -1.935   3.202
  387    H    GLU  52           HN       GLU  52 -13.598  -5.878   4.328
  388    HA   GLU  52           HA       GLU  52 -13.508  -8.768   4.493
  389    HB2  GLU  52          2HB       GLU  52 -14.033  -7.692   6.830
  390    HB3  GLU  52          3HB       GLU  52 -15.630  -7.443   6.138
  391    HG2  GLU  52          2HG       GLU  52 -14.964 -10.098   5.567
  392    HG3  GLU  52          3HG       GLU  52 -14.468  -9.823   7.236
  393    H    LEU  53           HN       LEU  53 -15.426  -5.844   4.017
  394    HA   LEU  53           HA       LEU  53 -16.730  -7.124   1.740
  395    HB2  LEU  53          2HB       LEU  53 -18.295  -7.473   3.532
  396    HB3  LEU  53          3HB       LEU  53 -18.186  -5.779   4.009
  397    HG   LEU  53           HG       LEU  53 -19.053  -6.034   1.263
  398   HD11  LEU  53          1HD1      LEU  53 -20.999  -7.253   1.440
  399   HD12  LEU  53          2HD1      LEU  53 -21.044  -7.130   3.199
  400   HD13  LEU  53          3HD1      LEU  53 -19.888  -8.211   2.421
  401   HD21  LEU  53          1HD2      LEU  53 -19.490  -4.001   2.250
  402   HD22  LEU  53          2HD2      LEU  53 -19.957  -4.724   3.789
  403   HD23  LEU  53          3HD2      LEU  53 -21.053  -4.805   2.409
  Start of MODEL    9
    1    H1   SER   1           HN       SER   1   8.505   8.941  11.769
    2    HA   SER   1           HA       SER   1   8.005  11.253  10.011
    3    HB2  SER   1          2HB       SER   1   8.438  11.115  12.832
    4    HB3  SER   1          3HB       SER   1   9.804  11.958  12.102
    5    HG   SER   1           HG       SER   1   7.975  13.312  12.663
    6    H    ASP   2           HN       ASP   2   9.886   8.610  10.270
    7    HA   ASP   2           HA       ASP   2  12.282   9.961   9.217
    8    HB2  ASP   2          2HB       ASP   2  11.960   7.303  10.610
    9    HB3  ASP   2          3HB       ASP   2  13.438   7.777   9.778
   10    H    ARG   3           HN       ARG   3   9.594   8.333   8.240
   11    HA   ARG   3           HA       ARG   3   9.008   7.654   6.121
   12    HB2  ARG   3          2HB       ARG   3  11.891   7.430   5.322
   13    HB3  ARG   3          3HB       ARG   3  10.488   7.767   4.318
   14    HG2  ARG   3          2HG       ARG   3  10.721   9.839   6.248
   15    HG3  ARG   3          3HG       ARG   3  12.296   9.594   5.491
   16    HD2  ARG   3          2HD       ARG   3  11.589  10.332   3.479
   17    HD3  ARG   3          3HD       ARG   3   9.994   9.602   3.656
   18    HE   ARG   3           HE       ARG   3   9.218  11.569   4.558
   19   HH11  ARG   3          1HH1      ARG   3  12.692  11.655   4.360
   20   HH12  ARG   3          2HH1      ARG   3  12.802  13.342   4.741
   21   HH21  ARG   3          1HH2      ARG   3   9.350  13.790   5.060
   22   HH22  ARG   3          2HH2      ARG   3  10.900  14.555   5.139
   23    H    THR   4           HN       THR   4   8.558   5.812   7.656
   24    HA   THR   4           HA       THR   4  10.131   3.449   6.857
   25    HB   THR   4           HB       THR   4   8.628   3.030   9.297
   26    HG1  THR   4          1HG       THR   4  10.170   4.421  10.524
   27   HG21  THR   4          1HG2      THR   4  10.871   2.324  10.109
   28   HG22  THR   4          2HG2      THR   4  11.559   2.892   8.588
   29   HG23  THR   4          3HG2      THR   4  10.405   1.559   8.590
   30    H    CYS   5           HN       CYS   5   9.020   1.582   6.326
   31    HA   CYS   5           HA       CYS   5   6.640   1.742   4.995
   32    HB2  CYS   5          2HB       CYS   5   8.282  -0.195   5.034
   33    HB3  CYS   5          3HB       CYS   5   7.484  -0.728   6.510
   34    H    ALA   6           HN       ALA   6   4.484   1.101   5.454
   35    HA   ALA   6           HA       ALA   6   3.725   1.601   8.245
   36    HB1  ALA   6          1HB       ALA   6   2.611   3.133   6.892
   37    HB2  ALA   6          2HB       ALA   6   2.284   1.936   5.639
   38    HB3  ALA   6          3HB       ALA   6   1.405   1.875   7.166
   39    H    ARG   7           HN       ARG   7   4.458  -0.993   6.530
   40    HA   ARG   7           HA       ARG   7   2.316  -2.626   7.725
   41    HB2  ARG   7          2HB       ARG   7   3.827  -3.422   5.246
   42    HB3  ARG   7          3HB       ARG   7   2.327  -4.093   5.874
   43    HG2  ARG   7          2HG       ARG   7   2.734  -1.420   4.559
   44    HG3  ARG   7          3HG       ARG   7   1.791  -2.789   3.965
   45    HD2  ARG   7          2HD       ARG   7   1.129  -0.771   6.028
   46    HD3  ARG   7          3HD       ARG   7   0.095  -1.543   4.827
   47    HE   ARG   7           HE       ARG   7   0.599  -3.579   6.474
   48   HH11  ARG   7          1HH1      ARG   7  -0.350  -0.293   7.121
   49   HH12  ARG   7          2HH1      ARG   7  -1.205  -0.688   8.576
   50   HH21  ARG   7          1HH2      ARG   7  -0.524  -4.113   8.387
   51   HH22  ARG   7          2HH2      ARG   7  -1.302  -2.861   9.294
   52    H    CYS   8           HN       CYS   8   5.721  -2.391   6.855
   53    HA   CYS   8           HA       CYS   8   6.287  -4.603   8.720
   54    HB2  CYS   8          2HB       CYS   8   8.330  -5.033   7.432
   55    HB3  CYS   8          3HB       CYS   8   6.901  -5.157   6.411
   56    H    GLN   9           HN       GLN   9   6.621  -1.298   8.128
   57    HA   GLN   9           HA       GLN   9   7.731   0.387   9.179
   58    HB2  GLN   9          2HB       GLN   9   7.674  -1.785  11.215
   59    HB3  GLN   9          3HB       GLN   9   8.723  -0.407  11.520
   60    HG2  GLN   9          2HG       GLN   9   6.634  -0.005  12.585
   61    HG3  GLN   9          3HG       GLN   9   6.764   1.083  11.205
   62   HE21  GLN   9          1HE2      GLN   9   5.190   1.086   9.740
   63   HE22  GLN   9          2HE2      GLN   9   3.888  -0.048   9.671
   64    H    GLU  10           HN       GLU  10   9.217  -0.424   7.233
   65    HA   GLU  10           HA       GLU  10  11.905  -0.883   8.351
   66    HB2  GLU  10          2HB       GLU  10  10.555  -1.920   5.920
   67    HB3  GLU  10          3HB       GLU  10  12.261  -1.521   5.770
   68    HG2  GLU  10          2HG       GLU  10  11.217  -3.295   7.951
   69    HG3  GLU  10          3HG       GLU  10  11.682  -3.913   6.367
   70    H    SER  11           HN       SER  11  13.674   0.215   7.325
   71    HA   SER  11           HA       SER  11  13.217   2.944   6.903
   72    HB2  SER  11          2HB       SER  11  15.375   2.179   7.668
   73    HB3  SER  11          3HB       SER  11  15.609   1.228   6.202
   74    HG   SER  11           HG       SER  11  16.695   3.307   6.234
   75    H    LEU  12           HN       LEU  12  12.825   4.156   5.143
   76    HA   LEU  12           HA       LEU  12  12.335   2.757   2.630
   77    HB2  LEU  12          2HB       LEU  12  11.527   5.399   3.766
   78    HB3  LEU  12          3HB       LEU  12  11.457   5.135   2.024
   79    HG   LEU  12           HG       LEU  12   9.348   4.764   3.545
   80   HD11  LEU  12          1HD1      LEU  12   9.183   4.441   1.226
   81   HD12  LEU  12          2HD1      LEU  12   8.652   2.920   1.941
   82   HD13  LEU  12          3HD1      LEU  12  10.272   3.053   1.255
   83   HD21  LEU  12          1HD2      LEU  12  10.705   3.113   4.959
   84   HD22  LEU  12          2HD2      LEU  12  10.494   1.991   3.616
   85   HD23  LEU  12          3HD2      LEU  12   9.084   2.630   4.461
   86    H    GLY  13           HN       GLY  13  15.029   3.717   3.831
   87    HA2  GLY  13          1HA       GLY  13  16.191   5.755   2.431
   88    HA3  GLY  13          2HA       GLY  13  17.045   4.282   2.870
   89    H    ARG  14           HN       ARG  14  16.890   6.157   0.412
   90    HA   ARG  14           HA       ARG  14  16.701   5.979  -1.886
   91    HB2  ARG  14          2HB       ARG  14  18.333   4.391  -2.765
   92    HB3  ARG  14          3HB       ARG  14  18.966   5.205  -1.340
   93    HG2  ARG  14          2HG       ARG  14  17.600   2.596  -0.962
   94    HG3  ARG  14          3HG       ARG  14  19.211   2.602  -1.684
   95    HD2  ARG  14          2HD       ARG  14  20.164   2.970   0.291
   96    HD3  ARG  14          3HD       ARG  14  19.116   4.354   0.597
   97    HE   ARG  14           HE       ARG  14  17.496   2.285   1.144
   98   HH11  ARG  14          1HH1      ARG  14  20.747   3.032   2.140
   99   HH12  ARG  14          2HH1      ARG  14  20.604   2.229   3.668
  100   HH21  ARG  14          1HH2      ARG  14  17.294   1.224   3.152
  101   HH22  ARG  14          2HH2      ARG  14  18.639   1.200   4.243
  102    H    LEU  15           HN       LEU  15  14.344   5.069  -0.925
  103    HA   LEU  15           HA       LEU  15  13.807   2.719  -2.617
  104    HB2  LEU  15          2HB       LEU  15  13.656   2.585   0.030
  105    HB3  LEU  15          3HB       LEU  15  12.066   3.280  -0.276
  106    HG   LEU  15           HG       LEU  15  12.087   1.195  -2.027
  107   HD11  LEU  15          1HD1      LEU  15  14.259   0.696  -0.335
  108   HD12  LEU  15          2HD1      LEU  15  13.495  -0.423  -1.464
  109   HD13  LEU  15          3HD1      LEU  15  12.963  -0.365   0.217
  110   HD21  LEU  15          1HD2      LEU  15  10.238   1.699  -0.610
  111   HD22  LEU  15          2HD2      LEU  15  11.166   1.312   0.839
  112   HD23  LEU  15          3HD2      LEU  15  10.713   0.032  -0.288
  113    H    SER  16           HN       SER  16  13.167   5.953  -1.967
  114    HA   SER  16           HA       SER  16  11.860   7.439  -3.133
  115    HB2  SER  16          2HB       SER  16  11.875   5.470  -4.898
  116    HB3  SER  16          3HB       SER  16  10.206   5.273  -4.365
  117    HG   SER  16           HG       SER  16  11.398   7.372  -5.761
  118    HA   PRO  17           HA       PRO  17   8.793   6.553   0.223
  119    HB2  PRO  17          2HB       PRO  17   9.144   8.933   1.478
  120    HB3  PRO  17          3HB       PRO  17  10.157   7.521   1.798
  121    HG2  PRO  17          2HG       PRO  17  10.707   9.893   0.055
  122    HG3  PRO  17          3HG       PRO  17  11.789   9.061   1.188
  123    HD2  PRO  17          2HD       PRO  17  11.877   8.641  -1.487
  124    HD3  PRO  17          3HD       PRO  17  12.260   7.371  -0.308
  125    H    LYS  18           HN       LYS  18   9.079   8.585  -2.405
  126    HA   LYS  18           HA       LYS  18   6.723  10.190  -1.864
  127    HB2  LYS  18          2HB       LYS  18   8.851  10.885  -3.200
  128    HB3  LYS  18          3HB       LYS  18   8.087  10.026  -4.532
  129    HG2  LYS  18          2HG       LYS  18   6.423  11.569  -4.760
  130    HG3  LYS  18          3HG       LYS  18   6.479  12.044  -3.062
  131    HD2  LYS  18          2HD       LYS  18   8.797  13.006  -3.622
  132    HD3  LYS  18          3HD       LYS  18   8.294  12.862  -5.307
  133    HE2  LYS  18          2HE       LYS  18   7.017  14.499  -3.128
  134    HE3  LYS  18          3HE       LYS  18   7.786  15.077  -4.604
  135    HZ1  LYS  18          1HZ       LYS  18   5.506  15.195  -5.017
  136    HZ2  LYS  18          2HZ       LYS  18   5.191  13.690  -4.313
  137    HZ3  LYS  18          3HZ       LYS  18   5.987  13.776  -5.803
  138    H    THR  19           HN       THR  19   7.686   7.840  -4.370
  139    HA   THR  19           HA       THR  19   4.961   7.515  -5.247
  140    HB   THR  19           HB       THR  19   5.774   6.192  -6.977
  141    HG1  THR  19          1HG       THR  19   7.677   4.983  -6.827
  142   HG21  THR  19          1HG2      THR  19   6.849   8.561  -6.742
  143   HG22  THR  19          2HG2      THR  19   7.456   7.441  -7.961
  144   HG23  THR  19          3HG2      THR  19   8.330   7.652  -6.444
  145    H    ASN  20           HN       ASN  20   6.641   6.359  -2.651
  146    HA   ASN  20           HA       ASN  20   5.388   3.718  -2.658
  147    HB2  ASN  20          2HB       ASN  20   7.528   5.008  -0.987
  148    HB3  ASN  20          3HB       ASN  20   6.711   3.550  -0.429
  149   HD21  ASN  20          1HD2      ASN  20   9.490   3.903  -1.104
  150   HD22  ASN  20          2HD2      ASN  20   9.833   2.795  -2.385
  151    H    THR  21           HN       THR  21   3.594   5.830  -2.505
  152    HA   THR  21           HA       THR  21   2.685   5.675   0.296
  153    HB   THR  21           HB       THR  21   2.069   7.884  -1.674
  154    HG1  THR  21          1HG       THR  21   4.203   8.092  -1.048
  155   HG21  THR  21          1HG2      THR  21   0.667   7.111   0.572
  156   HG22  THR  21          2HG2      THR  21   0.620   8.708  -0.175
  157   HG23  THR  21          3HG2      THR  21   1.712   8.397   1.174
  158    H    CYS  22           HN       CYS  22   1.184   4.112   0.341
  159    HA   CYS  22           HA       CYS  22  -0.357   3.088  -1.651
  160    HB2  CYS  22          2HB       CYS  22  -0.259   2.191   0.654
  161    HB3  CYS  22          3HB       CYS  22  -1.273   3.522   1.200
  162    H    ARG  23           HN       ARG  23  -1.999   3.739  -2.885
  163    HA   ARG  23           HA       ARG  23  -3.015   6.423  -2.578
  164    HB2  ARG  23          2HB       ARG  23  -4.277   4.697  -4.597
  165    HB3  ARG  23          3HB       ARG  23  -3.560   6.294  -4.767
  166    HG2  ARG  23          2HG       ARG  23  -1.330   4.871  -4.410
  167    HG3  ARG  23          3HG       ARG  23  -2.355   3.623  -5.124
  168    HD2  ARG  23          2HD       ARG  23  -0.969   4.998  -6.736
  169    HD3  ARG  23          3HD       ARG  23  -2.692   4.881  -7.088
  170    HE   ARG  23           HE       ARG  23  -1.915   7.198  -5.546
  171   HH11  ARG  23          1HH1      ARG  23  -2.468   5.869  -8.715
  172   HH12  ARG  23          2HH1      ARG  23  -2.726   7.411  -9.461
  173   HH21  ARG  23          1HH2      ARG  23  -2.253   9.235  -6.516
  174   HH22  ARG  23          2HH2      ARG  23  -2.603   9.326  -8.209
  175    H    GLY  24           HN       GLY  24  -3.730   3.925  -0.829
  176    HA2  GLY  24          1HA       GLY  24  -6.627   4.493  -0.821
  177    HA3  GLY  24          2HA       GLY  24  -6.015   2.857  -0.630
  178    H    CYS  25           HN       CYS  25  -3.736   4.399   0.923
  179    HA   CYS  25           HA       CYS  25  -5.229   4.625   3.451
  180    HB2  CYS  25          2HB       CYS  25  -2.557   3.292   2.982
  181    HB3  CYS  25          3HB       CYS  25  -3.205   3.657   4.578
  182    H    ASN  26           HN       ASN  26  -2.552   5.694   1.470
  183    HA   ASN  26           HA       ASN  26  -1.592   7.783   1.369
  184    HB2  ASN  26          2HB       ASN  26  -2.792   8.544   4.014
  185    HB3  ASN  26          3HB       ASN  26  -2.370   9.576   2.651
  186   HD21  ASN  26          1HD2      ASN  26  -3.594   7.874   0.674
  187   HD22  ASN  26          2HD2      ASN  26  -5.303   8.062   0.848
  188    H    HIS  27           HN       HIS  27  -0.846   5.321   3.083
  189    HA   HIS  27           HA       HIS  27   1.159   6.627   4.792
  190    HB2  HIS  27          2HB       HIS  27  -0.132   3.912   4.880
  191    HB3  HIS  27          3HB       HIS  27   1.383   4.224   5.722
  192    HD1  HIS  27          1HD       HIS  27   0.959   6.836   7.065
  193    HD2  HIS  27          2HD       HIS  27  -2.070   4.010   6.751
  194    HE1  HIS  27          1HE       HIS  27  -0.661   7.380   8.909
  195    H    LEU  28           HN       LEU  28   3.237   5.271   4.993
  196    HA   LEU  28           HA       LEU  28   4.308   4.980   2.322
  197    HB2  LEU  28          2HB       LEU  28   5.459   5.013   5.080
  198    HB3  LEU  28          3HB       LEU  28   6.422   4.414   3.731
  199    HG   LEU  28           HG       LEU  28   5.271   7.190   4.010
  200   HD11  LEU  28          1HD1      LEU  28   7.951   5.987   4.503
  201   HD12  LEU  28          2HD1      LEU  28   7.082   7.221   5.414
  202   HD13  LEU  28          3HD1      LEU  28   7.850   7.634   3.882
  203   HD21  LEU  28          1HD2      LEU  28   7.019   7.388   1.998
  204   HD22  LEU  28          2HD2      LEU  28   5.307   7.041   1.749
  205   HD23  LEU  28          3HD2      LEU  28   6.485   5.726   1.743
  206    H    VAL  29           HN       VAL  29   5.180   3.125   1.429
  207    HA   VAL  29           HA       VAL  29   5.112   0.627   2.895
  208    HB   VAL  29           HB       VAL  29   3.780   0.056   0.443
  209   HG11  VAL  29          1HG1      VAL  29   2.319  -0.047   3.016
  210   HG12  VAL  29          2HG1      VAL  29   2.516  -1.282   1.771
  211   HG13  VAL  29          3HG1      VAL  29   3.824  -0.959   2.910
  212   HG21  VAL  29          1HG2      VAL  29   1.716   1.271   0.671
  213   HG22  VAL  29          2HG2      VAL  29   2.302   2.077   2.126
  214   HG23  VAL  29          3HG2      VAL  29   3.044   2.427   0.565
  215    H    CYS  30           HN       CYS  30   7.045  -0.187   2.449
  216    HA   CYS  30           HA       CYS  30   8.766   0.507   0.433
  217    HB2  CYS  30          2HB       CYS  30   9.991  -1.522   0.907
  218    HB3  CYS  30          3HB       CYS  30   9.346  -0.883   2.415
  219    H    ARG  31           HN       ARG  31   9.620  -1.239  -1.227
  220    HA   ARG  31           HA       ARG  31   7.452  -1.622  -3.101
  221    HB2  ARG  31          2HB       ARG  31   9.144  -2.101  -4.722
  222    HB3  ARG  31          3HB       ARG  31   9.705  -0.739  -3.761
  223    HG2  ARG  31          2HG       ARG  31  11.315  -2.009  -2.671
  224    HG3  ARG  31          3HG       ARG  31  10.526  -3.533  -3.078
  225    HD2  ARG  31          2HD       ARG  31  11.395  -3.579  -5.190
  226    HD3  ARG  31          3HD       ARG  31  11.469  -1.821  -5.312
  227    HE   ARG  31           HE       ARG  31  13.598  -1.894  -4.478
  228   HH11  ARG  31          1HH1      ARG  31  12.018  -4.925  -3.820
  229   HH12  ARG  31          2HH1      ARG  31  13.453  -5.694  -3.226
  230   HH21  ARG  31          1HH2      ARG  31  15.493  -2.893  -3.699
  231   HH22  ARG  31          2HH2      ARG  31  15.429  -4.537  -3.157
  232    H    ASP  32           HN       ASP  32   7.786  -3.290  -0.598
  233    HA   ASP  32           HA       ASP  32   7.669  -5.915  -1.929
  234    HB2  ASP  32          2HB       ASP  32   9.715  -5.770  -0.598
  235    HB3  ASP  32          3HB       ASP  32   8.778  -5.307   0.820
  236    H    CYS  33           HN       CYS  33   6.092  -3.599  -0.068
  237    HA   CYS  33           HA       CYS  33   4.154  -5.567   0.950
  238    HB2  CYS  33          2HB       CYS  33   4.844  -2.774   1.856
  239    HB3  CYS  33          3HB       CYS  33   3.383  -3.600   2.386
  240    H    ARG  34           HN       ARG  34   4.482  -4.138  -1.770
  241    HA   ARG  34           HA       ARG  34   1.798  -2.943  -1.909
  242    HB2  ARG  34          2HB       ARG  34   3.411  -2.660  -4.309
  243    HB3  ARG  34          3HB       ARG  34   2.616  -1.426  -3.340
  244    HG2  ARG  34          2HG       ARG  34   4.491  -1.344  -1.826
  245    HG3  ARG  34          3HG       ARG  34   5.275  -2.673  -2.682
  246    HD2  ARG  34          2HD       ARG  34   4.512  -0.158  -4.119
  247    HD3  ARG  34          3HD       ARG  34   6.007  -0.244  -3.187
  248    HE   ARG  34           HE       ARG  34   5.657  -2.393  -5.074
  249   HH11  ARG  34          1HH1      ARG  34   6.871   0.829  -4.562
  250   HH12  ARG  34          2HH1      ARG  34   8.003   0.752  -5.871
  251   HH21  ARG  34          1HH2      ARG  34   7.144  -2.508  -6.801
  252   HH22  ARG  34          2HH2      ARG  34   8.157  -1.147  -7.144
  253    H    ILE  35           HN       ILE  35   0.288  -3.687  -3.356
  254    HA   ILE  35           HA       ILE  35   0.966  -6.197  -4.746
  255    HB   ILE  35           HB       ILE  35  -1.482  -5.390  -3.233
  256   HG12  ILE  35          2HG1      ILE  35  -1.289  -7.865  -2.603
  257   HG13  ILE  35          3HG1      ILE  35   0.268  -7.839  -3.423
  258   HG21  ILE  35          1HG2      ILE  35  -1.404  -6.973  -5.737
  259   HG22  ILE  35          2HG2      ILE  35  -2.430  -7.564  -4.432
  260   HG23  ILE  35          3HG2      ILE  35  -2.678  -5.945  -5.085
  261   HD11  ILE  35          1HD1      ILE  35   1.267  -6.700  -1.764
  262   HD12  ILE  35          2HD1      ILE  35  -0.164  -5.724  -1.425
  263   HD13  ILE  35          3HD1      ILE  35  -0.052  -7.371  -0.804
  264    H    GLN  36           HN       GLN  36   1.374  -5.485  -6.783
  265    HA   GLN  36           HA       GLN  36   0.417  -3.422  -8.214
  266    HB2  GLN  36          2HB       GLN  36   0.454  -6.064  -9.607
  267    HB3  GLN  36          3HB       GLN  36   1.086  -4.512 -10.140
  268    HG2  GLN  36          2HG       GLN  36   3.026  -5.624  -9.714
  269    HG3  GLN  36          3HG       GLN  36   2.752  -4.855  -8.151
  270   HE21  GLN  36          1HE2      GLN  36   0.479  -6.765  -7.694
  271   HE22  GLN  36          2HE2      GLN  36   1.243  -8.231  -7.192
  272    H    GLU  37           HN       GLU  37  -1.579  -2.658  -8.404
  273    HA   GLU  37           HA       GLU  37  -3.846  -4.491  -8.444
  274    HB2  GLU  37          2HB       GLU  37  -3.674  -1.483  -8.243
  275    HB3  GLU  37          3HB       GLU  37  -5.190  -2.368  -8.322
  276    HG2  GLU  37          2HG       GLU  37  -3.528  -3.482  -6.276
  277    HG3  GLU  37          3HG       GLU  37  -3.673  -1.740  -6.051
  278    H    SER  38           HN       SER  38  -5.507  -4.340 -10.049
  279    HA   SER  38           HA       SER  38  -4.440  -4.056 -12.700
  280    HB2  SER  38          2HB       SER  38  -7.069  -4.946 -11.560
  281    HB3  SER  38          3HB       SER  38  -6.926  -4.606 -13.284
  282    HG   SER  38           HG       SER  38  -6.068  -6.504 -13.459
  283    H    ASN  39           HN       ASN  39  -5.772  -1.912 -10.528
  284    HA   ASN  39           HA       ASN  39  -7.299  -0.297 -12.334
  285    HB2  ASN  39          2HB       ASN  39  -6.134   0.469  -9.649
  286    HB3  ASN  39          3HB       ASN  39  -7.435   1.292 -10.505
  287   HD21  ASN  39          1HD2      ASN  39  -7.724   0.409  -7.915
  288   HD22  ASN  39          2HD2      ASN  39  -8.867  -0.885  -7.878
  289    H    GLY  40           HN       GLY  40  -4.104  -0.902 -12.257
  290    HA2  GLY  40          1HA       GLY  40  -2.647   0.221 -13.803
  291    HA3  GLY  40          2HA       GLY  40  -3.485   1.723 -13.439
  292    H    THR  41           HN       THR  41  -3.375   0.870 -10.503
  293    HA   THR  41           HA       THR  41  -0.579   1.690 -10.049
  294    HB   THR  41           HB       THR  41  -2.361   3.383  -9.437
  295    HG1  THR  41          1HG       THR  41  -0.204   3.243  -8.465
  296   HG21  THR  41          1HG2      THR  41  -3.749   3.053  -7.567
  297   HG22  THR  41          2HG2      THR  41  -2.869   1.608  -7.063
  298   HG23  THR  41          3HG2      THR  41  -3.894   1.563  -8.498
  299    H    TRP  42           HN       TRP  42  -0.760   1.388  -7.206
  300    HA   TRP  42           HA       TRP  42  -1.176  -1.500  -6.880
  301    HB2  TRP  42          2HB       TRP  42   0.956  -1.720  -5.700
  302    HB3  TRP  42          3HB       TRP  42   1.213  -1.143  -7.344
  303    HD1  TRP  42          1HD       TRP  42   2.675   0.956  -7.587
  304    HE1  TRP  42          1HE       TRP  42   3.608   2.735  -5.979
  305    HE3  TRP  42          3HE       TRP  42   0.226  -0.440  -3.323
  306    HZ2  TRP  42          2HZ       TRP  42   3.341   3.452  -3.262
  307    HZ3  TRP  42          3HZ       TRP  42   0.621   0.844  -1.261
  308    HH2  TRP  42          2HH       TRP  42   2.147   2.749  -1.234
  309    H    ARG  43           HN       ARG  43  -1.457  -2.190  -4.686
  310    HA   ARG  43           HA       ARG  43  -2.000  -0.040  -2.761
  311    HB2  ARG  43          2HB       ARG  43  -3.876  -2.239  -3.606
  312    HB3  ARG  43          3HB       ARG  43  -4.043  -1.423  -2.058
  313    HG2  ARG  43          2HG       ARG  43  -3.797   0.576  -4.040
  314    HG3  ARG  43          3HG       ARG  43  -4.970  -0.608  -4.618
  315    HD2  ARG  43          2HD       ARG  43  -5.112   0.420  -1.812
  316    HD3  ARG  43          3HD       ARG  43  -5.771   1.371  -3.142
  317    HE   ARG  43           HE       ARG  43  -6.673  -1.369  -3.054
  318   HH11  ARG  43          1HH1      ARG  43  -7.253   1.906  -2.028
  319   HH12  ARG  43          2HH1      ARG  43  -8.945   1.657  -1.748
  320   HH21  ARG  43          1HH2      ARG  43  -8.899  -1.710  -2.689
  321   HH22  ARG  43          2HH2      ARG  43  -9.880  -0.401  -2.124
  322    H    CYS  44           HN       CYS  44  -1.414  -0.477  -0.701
  323    HA   CYS  44           HA       CYS  44   0.462  -2.329  -0.045
  324    HB2  CYS  44          2HB       CYS  44   0.008  -1.885   2.258
  325    HB3  CYS  44          3HB       CYS  44  -0.336  -0.402   1.374
  326    H    LYS  45           HN       LYS  45   0.375  -4.252   1.336
  327    HA   LYS  45           HA       LYS  45  -1.308  -6.238   0.263
  328    HB2  LYS  45          2HB       LYS  45  -0.058  -6.686   2.923
  329    HB3  LYS  45          3HB       LYS  45  -0.094  -7.730   1.509
  330    HG2  LYS  45          2HG       LYS  45   1.465  -5.860   0.507
  331    HG3  LYS  45          3HG       LYS  45   1.794  -5.548   2.213
  332    HD2  LYS  45          2HD       LYS  45   3.372  -7.135   1.924
  333    HD3  LYS  45          3HD       LYS  45   2.014  -8.237   2.160
  334    HE2  LYS  45          2HE       LYS  45   1.767  -8.586  -0.162
  335    HE3  LYS  45          3HE       LYS  45   2.807  -7.217  -0.554
  336    HZ1  LYS  45          1HZ       LYS  45   4.036  -9.208  -0.894
  337    HZ2  LYS  45          2HZ       LYS  45   3.630  -9.808   0.633
  338    HZ3  LYS  45          3HZ       LYS  45   4.658  -8.471   0.496
  339    H    VAL  46           HN       VAL  46  -1.991  -3.860   2.497
  340    HA   VAL  46           HA       VAL  46  -3.954  -5.445   3.973
  341    HB   VAL  46           HB       VAL  46  -3.467  -2.499   4.335
  342   HG11  VAL  46          1HG1      VAL  46  -4.873  -4.653   5.783
  343   HG12  VAL  46          2HG1      VAL  46  -3.980  -3.499   6.777
  344   HG13  VAL  46          3HG1      VAL  46  -5.235  -2.930   5.675
  345   HG21  VAL  46          1HG2      VAL  46  -2.017  -3.642   6.327
  346   HG22  VAL  46          2HG2      VAL  46  -1.689  -4.744   4.990
  347   HG23  VAL  46          3HG2      VAL  46  -1.334  -3.024   4.823
  348    H    CYS  47           HN       CYS  47  -3.736  -3.222   1.355
  349    HA   CYS  47           HA       CYS  47  -6.589  -2.604   1.440
  350    HB2  CYS  47          2HB       CYS  47  -4.239  -1.530  -0.065
  351    HB3  CYS  47          3HB       CYS  47  -5.850  -1.321  -0.745
  352    H    ALA  48           HN       ALA  48  -4.216  -4.077  -0.757
  353    HA   ALA  48           HA       ALA  48  -6.051  -4.845  -2.748
  354    HB1  ALA  48          1HB       ALA  48  -3.996  -6.716  -2.830
  355    HB2  ALA  48          2HB       ALA  48  -4.087  -5.200  -3.727
  356    HB3  ALA  48          3HB       ALA  48  -3.251  -5.258  -2.176
  357    H    LYS  49           HN       LYS  49  -5.389  -6.133   0.362
  358    HA   LYS  49           HA       LYS  49  -6.421  -8.773  -0.220
  359    HB2  LYS  49          2HB       LYS  49  -5.719  -9.374   1.881
  360    HB3  LYS  49          3HB       LYS  49  -4.641  -8.018   1.579
  361    HG2  LYS  49          2HG       LYS  49  -6.014  -6.559   2.900
  362    HG3  LYS  49          3HG       LYS  49  -7.236  -7.819   3.092
  363    HD2  LYS  49          2HD       LYS  49  -5.893  -9.072   4.524
  364    HD3  LYS  49          3HD       LYS  49  -4.412  -8.273   3.991
  365    HE2  LYS  49          2HE       LYS  49  -4.591  -6.964   5.782
  366    HE3  LYS  49          3HE       LYS  49  -5.990  -6.223   5.008
  367    HZ1  LYS  49          1HZ       LYS  49  -6.906  -8.554   6.163
  368    HZ2  LYS  49          2HZ       LYS  49  -7.190  -6.973   6.695
  369    HZ3  LYS  49          3HZ       LYS  49  -5.889  -7.857   7.321
  370    H    GLU  50           HN       GLU  50  -7.581  -5.747   1.056
  371    HA   GLU  50           HA       GLU  50 -10.268  -6.926   1.264
  372    HB2  GLU  50          2HB       GLU  50  -8.912  -6.253   3.475
  373    HB3  GLU  50          3HB       GLU  50  -9.590  -4.680   3.084
  374    HG2  GLU  50          2HG       GLU  50 -11.776  -6.253   2.830
  375    HG3  GLU  50          3HG       GLU  50 -10.894  -7.100   4.099
  376    H    ILE  51           HN       ILE  51 -11.370  -4.351   2.099
  377    HA   ILE  51           HA       ILE  51 -11.071  -2.855  -0.423
  378    HB   ILE  51           HB       ILE  51 -13.532  -3.679   1.049
  379   HG12  ILE  51          2HG1      ILE  51 -13.539  -3.211  -1.861
  380   HG13  ILE  51          3HG1      ILE  51 -12.390  -4.428  -1.316
  381   HG21  ILE  51          1HG2      ILE  51 -13.850  -1.351   1.153
  382   HG22  ILE  51          2HG2      ILE  51 -13.186  -1.106  -0.462
  383   HG23  ILE  51          3HG2      ILE  51 -14.758  -1.880  -0.263
  384   HD11  ILE  51          1HD1      ILE  51 -14.428  -5.515  -1.894
  385   HD12  ILE  51          2HD1      ILE  51 -14.262  -5.564  -0.137
  386   HD13  ILE  51          3HD1      ILE  51 -15.365  -4.409  -0.889
  387    H    GLU  52           HN       GLU  52 -11.148  -2.774   3.008
  388    HA   GLU  52           HA       GLU  52 -10.818  -1.122   4.536
  389    HB2  GLU  52          2HB       GLU  52  -9.129  -0.566   2.414
  390    HB3  GLU  52          3HB       GLU  52  -9.961   0.961   2.678
  391    HG2  GLU  52          2HG       GLU  52  -8.739  -0.525   4.966
  392    HG3  GLU  52          3HG       GLU  52  -7.757   0.501   3.924
  393    H    LEU  53           HN       LEU  53 -11.631   0.933   5.313
  394    HA   LEU  53           HA       LEU  53 -14.126   1.676   3.953
  395    HB2  LEU  53          2HB       LEU  53 -15.083   2.009   5.973
  396    HB3  LEU  53          3HB       LEU  53 -13.841   0.861   6.469
  397    HG   LEU  53           HG       LEU  53 -13.774   3.858   6.803
  398   HD11  LEU  53          1HD1      LEU  53 -13.568   3.078   9.245
  399   HD12  LEU  53          2HD1      LEU  53 -14.208   1.544   8.654
  400   HD13  LEU  53          3HD1      LEU  53 -15.154   3.021   8.475
  401   HD21  LEU  53          1HD2      LEU  53 -11.668   3.342   8.095
  402   HD22  LEU  53          2HD2      LEU  53 -11.547   3.208   6.340
  403   HD23  LEU  53          3HD2      LEU  53 -11.690   1.754   7.330
  Start of MODEL   10
    1    H1   SER   1           HN       SER   1   9.344  11.460  12.226
    2    HA   SER   1           HA       SER   1   8.150   9.452  10.915
    3    HB2  SER   1          2HB       SER   1   7.727  10.787   8.608
    4    HB3  SER   1          3HB       SER   1   6.452  10.475   9.786
    5    HG   SER   1           HG       SER   1   6.297  12.542  10.052
    6    H    ASP   2           HN       ASP   2   9.864   8.399  10.194
    7    HA   ASP   2           HA       ASP   2  12.083   9.942   9.024
    8    HB2  ASP   2          2HB       ASP   2  12.179   7.201  10.302
    9    HB3  ASP   2          3HB       ASP   2  13.557   8.126   9.712
   10    H    ARG   3           HN       ARG   3   9.520   8.353   7.994
   11    HA   ARG   3           HA       ARG   3   8.987   7.541   5.919
   12    HB2  ARG   3          2HB       ARG   3  11.903   7.312   5.229
   13    HB3  ARG   3          3HB       ARG   3  10.534   7.549   4.152
   14    HG2  ARG   3          2HG       ARG   3  10.818   9.710   6.069
   15    HG3  ARG   3          3HG       ARG   3  12.254   9.495   5.064
   16    HD2  ARG   3          2HD       ARG   3  11.197  10.166   3.189
   17    HD3  ARG   3          3HD       ARG   3   9.688   9.370   3.633
   18    HE   ARG   3           HE       ARG   3   9.834  11.471   5.345
   19   HH11  ARG   3          1HH1      ARG   3  10.021  11.150   1.883
   20   HH12  ARG   3          2HH1      ARG   3   9.349  12.717   1.571
   21   HH21  ARG   3          1HH2      ARG   3   8.949  13.535   4.947
   22   HH22  ARG   3          2HH2      ARG   3   8.742  14.073   3.315
   23    H    THR   4           HN       THR   4   8.545   5.772   7.583
   24    HA   THR   4           HA       THR   4  10.115   3.374   6.889
   25    HB   THR   4           HB       THR   4   8.532   3.107   9.318
   26    HG1  THR   4          1HG       THR   4   9.557   4.606  10.549
   27   HG21  THR   4          1HG2      THR   4  10.458   1.677   8.385
   28   HG22  THR   4          2HG2      THR   4  10.440   2.009  10.117
   29   HG23  THR   4          3HG2      THR   4  11.518   2.916   9.057
   30    H    CYS   5           HN       CYS   5   9.021   1.497   6.384
   31    HA   CYS   5           HA       CYS   5   6.632   1.640   5.032
   32    HB2  CYS   5          2HB       CYS   5   8.284  -0.255   4.973
   33    HB3  CYS   5          3HB       CYS   5   7.611  -0.814   6.500
   34    H    ALA   6           HN       ALA   6   4.488   1.123   5.495
   35    HA   ALA   6           HA       ALA   6   3.748   1.498   8.302
   36    HB1  ALA   6          1HB       ALA   6   1.863   1.501   5.963
   37    HB2  ALA   6          2HB       ALA   6   1.642   2.225   7.557
   38    HB3  ALA   6          3HB       ALA   6   2.798   2.924   6.424
   39    H    ARG   7           HN       ARG   7   4.653  -1.073   6.864
   40    HA   ARG   7           HA       ARG   7   2.489  -2.744   7.940
   41    HB2  ARG   7          2HB       ARG   7   3.990  -3.336   5.384
   42    HB3  ARG   7          3HB       ARG   7   2.697  -4.298   6.088
   43    HG2  ARG   7          2HG       ARG   7   2.368  -1.469   5.115
   44    HG3  ARG   7          3HG       ARG   7   1.996  -2.906   4.160
   45    HD2  ARG   7          2HD       ARG   7   0.506  -1.655   6.354
   46    HD3  ARG   7          3HD       ARG   7  -0.065  -2.656   5.020
   47    HE   ARG   7           HE       ARG   7   0.591  -3.523   7.671
   48   HH11  ARG   7          1HH1      ARG   7   0.397  -4.495   4.334
   49   HH12  ARG   7          2HH1      ARG   7   0.188  -6.175   4.700
   50   HH21  ARG   7          1HH2      ARG   7   0.316  -5.732   8.166
   51   HH22  ARG   7          2HH2      ARG   7   0.141  -6.877   6.879
   52    H    CYS   8           HN       CYS   8   5.883  -2.506   6.985
   53    HA   CYS   8           HA       CYS   8   6.501  -4.664   8.896
   54    HB2  CYS   8          2HB       CYS   8   8.524  -5.102   7.580
   55    HB3  CYS   8          3HB       CYS   8   7.077  -5.259   6.588
   56    H    GLN   9           HN       GLN   9   6.816  -1.369   8.215
   57    HA   GLN   9           HA       GLN   9   7.904   0.345   9.241
   58    HB2  GLN   9          2HB       GLN   9   7.969  -1.816  11.287
   59    HB3  GLN   9          3HB       GLN   9   9.006  -0.419  11.545
   60    HG2  GLN   9          2HG       GLN   9   7.238   0.513  12.512
   61    HG3  GLN   9          3HG       GLN   9   6.614   0.732  10.879
   62   HE21  GLN   9          1HE2      GLN   9   5.600  -1.444  10.041
   63   HE22  GLN   9          2HE2      GLN   9   4.448  -2.145  11.120
   64    H    GLU  10           HN       GLU  10   9.329  -0.477   7.239
   65    HA   GLU  10           HA       GLU  10  12.069  -0.848   8.258
   66    HB2  GLU  10          2HB       GLU  10  10.687  -1.893   5.824
   67    HB3  GLU  10          3HB       GLU  10  12.415  -1.576   5.743
   68    HG2  GLU  10          2HG       GLU  10  11.088  -3.360   7.772
   69    HG3  GLU  10          3HG       GLU  10  11.871  -3.915   6.293
   70    H    SER  11           HN       SER  11  13.756   0.325   7.238
   71    HA   SER  11           HA       SER  11  13.213   3.012   6.751
   72    HB2  SER  11          2HB       SER  11  15.613   2.791   5.575
   73    HB3  SER  11          3HB       SER  11  15.413   2.752   7.327
   74    HG   SER  11           HG       SER  11  15.641   0.529   5.579
   75    H    LEU  12           HN       LEU  12  12.704   4.174   4.992
   76    HA   LEU  12           HA       LEU  12  12.171   2.724   2.520
   77    HB2  LEU  12          2HB       LEU  12  11.323   5.349   3.657
   78    HB3  LEU  12          3HB       LEU  12  11.223   5.086   1.917
   79    HG   LEU  12           HG       LEU  12   9.158   4.655   3.478
   80   HD11  LEU  12          1HD1      LEU  12   8.853   4.307   1.211
   81   HD12  LEU  12          2HD1      LEU  12   8.559   2.705   1.886
   82   HD13  LEU  12          3HD1      LEU  12  10.107   3.071   1.125
   83   HD21  LEU  12          1HD2      LEU  12  10.468   1.947   3.555
   84   HD22  LEU  12          2HD2      LEU  12   8.962   2.451   4.323
   85   HD23  LEU  12          3HD2      LEU  12  10.504   3.075   4.912
   86    H    GLY  13           HN       GLY  13  14.907   3.574   3.492
   87    HA2  GLY  13          1HA       GLY  13  15.922   5.687   1.981
   88    HA3  GLY  13          2HA       GLY  13  16.858   4.305   2.531
   89    H    ARG  14           HN       ARG  14  16.962   5.830   0.001
   90    HA   ARG  14           HA       ARG  14  16.941   5.514  -2.277
   91    HB2  ARG  14          2HB       ARG  14  18.078   2.969  -1.139
   92    HB3  ARG  14          3HB       ARG  14  18.025   3.264  -2.872
   93    HG2  ARG  14          2HG       ARG  14  19.323   5.356  -2.482
   94    HG3  ARG  14          3HG       ARG  14  19.493   4.869  -0.794
   95    HD2  ARG  14          2HD       ARG  14  20.223   2.642  -2.352
   96    HD3  ARG  14          3HD       ARG  14  21.006   4.042  -3.084
   97    HE   ARG  14           HE       ARG  14  22.362   4.208  -1.242
   98   HH11  ARG  14          1HH1      ARG  14  19.709   2.069  -0.533
   99   HH12  ARG  14          2HH1      ARG  14  20.369   1.539   0.978
  100   HH21  ARG  14          1HH2      ARG  14  23.242   3.518   0.746
  101   HH22  ARG  14          2HH2      ARG  14  22.378   2.365   1.705
  102    H    LEU  15           HN       LEU  15  14.386   5.043  -1.172
  103    HA   LEU  15           HA       LEU  15  13.403   2.924  -2.968
  104    HB2  LEU  15          2HB       LEU  15  13.152   3.055  -0.185
  105    HB3  LEU  15          3HB       LEU  15  11.573   3.517  -0.821
  106    HG   LEU  15           HG       LEU  15  13.033   0.911  -1.127
  107   HD11  LEU  15          1HD1      LEU  15  10.211   1.552  -0.290
  108   HD12  LEU  15          2HD1      LEU  15  11.552   1.289   0.824
  109   HD13  LEU  15          3HD1      LEU  15  11.011  -0.019  -0.229
  110   HD21  LEU  15          1HD2      LEU  15  11.084   2.174  -2.961
  111   HD22  LEU  15          2HD2      LEU  15  10.829   0.473  -2.566
  112   HD23  LEU  15          3HD2      LEU  15  12.353   0.993  -3.288
  113    H    SER  16           HN       SER  16  13.255   6.186  -1.983
  114    HA   SER  16           HA       SER  16  12.169   7.986  -2.869
  115    HB2  SER  16          2HB       SER  16  12.108   6.097  -4.943
  116    HB3  SER  16          3HB       SER  16  10.453   6.693  -4.809
  117    HG   SER  16           HG       SER  16  12.635   7.928  -5.807
  118    HA   PRO  17           HA       PRO  17   8.544   6.786  -0.282
  119    HB2  PRO  17          2HB       PRO  17   8.749   8.924   1.378
  120    HB3  PRO  17          3HB       PRO  17   9.659   7.428   1.621
  121    HG2  PRO  17          2HG       PRO  17  10.548  10.006   0.387
  122    HG3  PRO  17          3HG       PRO  17  11.409   8.956   1.528
  123    HD2  PRO  17          2HD       PRO  17  11.920   8.947  -1.131
  124    HD3  PRO  17          3HD       PRO  17  12.072   7.491  -0.125
  125    H    LYS  18           HN       LYS  18   9.279   9.122  -2.516
  126    HA   LYS  18           HA       LYS  18   7.079  10.913  -2.084
  127    HB2  LYS  18          2HB       LYS  18   9.257  11.467  -3.276
  128    HB3  LYS  18          3HB       LYS  18   8.634  10.552  -4.644
  129    HG2  LYS  18          2HG       LYS  18   8.290  12.969  -4.886
  130    HG3  LYS  18          3HG       LYS  18   6.771  12.070  -4.865
  131    HD2  LYS  18          2HD       LYS  18   6.212  12.822  -2.738
  132    HD3  LYS  18          3HD       LYS  18   7.883  13.229  -2.337
  133    HE2  LYS  18          2HE       LYS  18   6.267  14.665  -4.437
  134    HE3  LYS  18          3HE       LYS  18   6.369  15.190  -2.757
  135    HZ1  LYS  18          1HZ       LYS  18   8.966  14.755  -3.708
  136    HZ2  LYS  18          2HZ       LYS  18   8.257  16.214  -3.230
  137    HZ3  LYS  18          3HZ       LYS  18   8.156  15.713  -4.843
  138    H    THR  19           HN       THR  19   7.594   7.944  -3.809
  139    HA   THR  19           HA       THR  19   4.806   8.055  -4.749
  140    HB   THR  19           HB       THR  19   5.302   7.251  -6.840
  141    HG1  THR  19          1HG       THR  19   7.372   6.143  -7.238
  142   HG21  THR  19          1HG2      THR  19   8.002   8.469  -6.386
  143   HG22  THR  19          2HG2      THR  19   6.546   9.459  -6.295
  144   HG23  THR  19          3HG2      THR  19   6.941   8.605  -7.786
  145    H    ASN  20           HN       ASN  20   6.068   6.880  -2.333
  146    HA   ASN  20           HA       ASN  20   5.408   4.049  -2.811
  147    HB2  ASN  20          2HB       ASN  20   7.263   5.282  -0.765
  148    HB3  ASN  20          3HB       ASN  20   6.802   3.581  -0.782
  149   HD21  ASN  20          1HD2      ASN  20   9.342   3.841  -0.875
  150   HD22  ASN  20          2HD2      ASN  20   9.999   3.668  -2.462
  151    H    THR  21           HN       THR  21   3.849   6.593  -1.917
  152    HA   THR  21           HA       THR  21   2.797   5.623   0.635
  153    HB   THR  21           HB       THR  21   2.056   8.154  -0.840
  154    HG1  THR  21          1HG       THR  21   3.638   9.149   0.284
  155   HG21  THR  21          1HG2      THR  21   1.742   8.434   1.930
  156   HG22  THR  21          2HG2      THR  21   1.058   6.858   1.532
  157   HG23  THR  21          3HG2      THR  21   0.468   8.307   0.718
  158    H    CYS  22           HN       CYS  22   1.322   4.058   0.400
  159    HA   CYS  22           HA       CYS  22  -0.191   3.363  -1.741
  160    HB2  CYS  22          2HB       CYS  22  -0.109   2.073   0.352
  161    HB3  CYS  22          3HB       CYS  22  -1.100   3.294   1.143
  162    H    ARG  23           HN       ARG  23  -1.909   4.115  -2.826
  163    HA   ARG  23           HA       ARG  23  -2.941   6.723  -2.128
  164    HB2  ARG  23          2HB       ARG  23  -4.243   5.334  -4.353
  165    HB3  ARG  23          3HB       ARG  23  -3.462   6.909  -4.311
  166    HG2  ARG  23          2HG       ARG  23  -1.281   5.405  -4.211
  167    HG3  ARG  23          3HG       ARG  23  -2.352   4.255  -5.014
  168    HD2  ARG  23          2HD       ARG  23  -1.924   5.301  -6.928
  169    HD3  ARG  23          3HD       ARG  23  -2.794   6.699  -6.294
  170    HE   ARG  23           HE       ARG  23  -0.286   6.968  -5.276
  171   HH11  ARG  23          1HH1      ARG  23  -1.585   6.561  -8.481
  172   HH12  ARG  23          2HH1      ARG  23  -0.313   7.451  -9.250
  173   HH21  ARG  23          1HH2      ARG  23   1.394   8.142  -6.279
  174   HH22  ARG  23          2HH2      ARG  23   1.381   8.349  -7.997
  175    H    GLY  24           HN       GLY  24  -3.586   4.097  -0.645
  176    HA2  GLY  24          1HA       GLY  24  -6.527   4.325  -0.801
  177    HA3  GLY  24          2HA       GLY  24  -5.675   2.869  -0.311
  178    H    CYS  25           HN       CYS  25  -3.861   3.808   1.498
  179    HA   CYS  25           HA       CYS  25  -5.619   4.790   3.642
  180    HB2  CYS  25          2HB       CYS  25  -3.735   3.817   5.119
  181    HB3  CYS  25          3HB       CYS  25  -4.822   2.693   4.308
  182    H    ASN  26           HN       ASN  26  -2.848   5.532   1.768
  183    HA   ASN  26           HA       ASN  26  -1.693   7.510   1.618
  184    HB2  ASN  26          2HB       ASN  26  -3.866   8.300   3.078
  185    HB3  ASN  26          3HB       ASN  26  -2.550   8.645   4.197
  186   HD21  ASN  26          1HD2      ASN  26  -4.053   9.460   1.198
  187   HD22  ASN  26          2HD2      ASN  26  -3.132  10.887   0.880
  188    H    HIS  27           HN       HIS  27  -0.943   5.057   3.113
  189    HA   HIS  27           HA       HIS  27   1.050   6.217   4.945
  190    HB2  HIS  27          2HB       HIS  27  -0.063   3.405   4.884
  191    HB3  HIS  27          3HB       HIS  27   1.156   3.997   6.010
  192    HD1  HIS  27          1HD       HIS  27  -0.025   6.569   7.000
  193    HD2  HIS  27          2HD       HIS  27  -2.310   3.159   6.362
  194    HE1  HIS  27          1HE       HIS  27  -2.069   6.851   8.438
  195    H    LEU  28           HN       LEU  28   3.150   5.084   5.018
  196    HA   LEU  28           HA       LEU  28   4.164   4.721   2.358
  197    HB2  LEU  28          2HB       LEU  28   5.371   4.687   5.099
  198    HB3  LEU  28          3HB       LEU  28   6.305   4.171   3.697
  199    HG   LEU  28           HG       LEU  28   5.102   6.906   4.118
  200   HD11  LEU  28          1HD1      LEU  28   7.004   7.499   5.093
  201   HD12  LEU  28          2HD1      LEU  28   7.956   6.792   3.789
  202   HD13  LEU  28          3HD1      LEU  28   7.446   5.792   5.148
  203   HD21  LEU  28          1HD2      LEU  28   6.575   7.421   2.104
  204   HD22  LEU  28          2HD2      LEU  28   5.076   6.542   1.800
  205   HD23  LEU  28          3HD2      LEU  28   6.615   5.679   1.832
  206    H    VAL  29           HN       VAL  29   5.143   2.869   1.497
  207    HA   VAL  29           HA       VAL  29   5.044   0.364   2.928
  208    HB   VAL  29           HB       VAL  29   3.705  -0.186   0.470
  209   HG11  VAL  29          1HG1      VAL  29   2.422  -1.532   1.788
  210   HG12  VAL  29          2HG1      VAL  29   3.780  -1.276   2.886
  211   HG13  VAL  29          3HG1      VAL  29   2.299  -0.338   3.081
  212   HG21  VAL  29          1HG2      VAL  29   1.602   0.992   0.807
  213   HG22  VAL  29          2HG2      VAL  29   2.284   1.846   2.191
  214   HG23  VAL  29          3HG2      VAL  29   2.922   2.138   0.574
  215    H    CYS  30           HN       CYS  30   6.991  -0.419   2.477
  216    HA   CYS  30           HA       CYS  30   8.679   0.288   0.431
  217    HB2  CYS  30          2HB       CYS  30   9.948  -1.719   0.922
  218    HB3  CYS  30          3HB       CYS  30   9.336  -1.035   2.424
  219    H    ARG  31           HN       ARG  31   9.560  -1.547  -1.163
  220    HA   ARG  31           HA       ARG  31   7.404  -1.963  -3.042
  221    HB2  ARG  31          2HB       ARG  31   9.244  -2.809  -4.524
  222    HB3  ARG  31          3HB       ARG  31   9.463  -1.160  -3.954
  223    HG2  ARG  31          2HG       ARG  31  11.196  -1.740  -2.535
  224    HG3  ARG  31          3HG       ARG  31  10.718  -3.439  -2.486
  225    HD2  ARG  31          2HD       ARG  31  11.354  -2.552  -5.175
  226    HD3  ARG  31          3HD       ARG  31  12.704  -2.322  -4.063
  227    HE   ARG  31           HE       ARG  31  11.588  -4.836  -4.959
  228   HH11  ARG  31          1HH1      ARG  31  13.583  -3.201  -2.620
  229   HH12  ARG  31          2HH1      ARG  31  14.455  -4.630  -2.173
  230   HH21  ARG  31          1HH2      ARG  31  12.729  -6.723  -4.377
  231   HH22  ARG  31          2HH2      ARG  31  13.969  -6.633  -3.173
  232    H    ASP  32           HN       ASP  32   7.738  -3.551  -0.465
  233    HA   ASP  32           HA       ASP  32   7.511  -6.210  -1.711
  234    HB2  ASP  32          2HB       ASP  32   9.632  -5.819  -0.330
  235    HB3  ASP  32          3HB       ASP  32   8.573  -5.781   1.077
  236    H    CYS  33           HN       CYS  33   6.033  -3.796   0.058
  237    HA   CYS  33           HA       CYS  33   4.103  -5.680   1.242
  238    HB2  CYS  33          2HB       CYS  33   4.922  -2.895   2.056
  239    HB3  CYS  33          3HB       CYS  33   3.449  -3.650   2.656
  240    H    ARG  34           HN       ARG  34   4.350  -4.362  -1.527
  241    HA   ARG  34           HA       ARG  34   1.667  -3.145  -1.586
  242    HB2  ARG  34          2HB       ARG  34   3.196  -2.735  -4.006
  243    HB3  ARG  34          3HB       ARG  34   2.457  -1.549  -2.939
  244    HG2  ARG  34          2HG       ARG  34   4.394  -1.482  -1.550
  245    HG3  ARG  34          3HG       ARG  34   5.114  -2.850  -2.400
  246    HD2  ARG  34          2HD       ARG  34   5.733  -1.589  -4.191
  247    HD3  ARG  34          3HD       ARG  34   4.369  -0.485  -4.021
  248    HE   ARG  34           HE       ARG  34   5.831   0.141  -1.876
  249   HH11  ARG  34          1HH1      ARG  34   6.724  -0.318  -5.210
  250   HH12  ARG  34          2HH1      ARG  34   8.043   0.805  -5.147
  251   HH21  ARG  34          1HH2      ARG  34   7.564   1.622  -1.781
  252   HH22  ARG  34          2HH2      ARG  34   8.519   1.908  -3.196
  253    H    ILE  35           HN       ILE  35   0.307  -3.644  -3.407
  254    HA   ILE  35           HA       ILE  35   0.920  -6.259  -4.623
  255    HB   ILE  35           HB       ILE  35  -1.658  -5.211  -3.498
  256   HG12  ILE  35          2HG1      ILE  35  -1.699  -7.540  -2.543
  257   HG13  ILE  35          3HG1      ILE  35  -0.098  -7.789  -3.231
  258   HG21  ILE  35          1HG2      ILE  35  -1.357  -7.424  -5.525
  259   HG22  ILE  35          2HG2      ILE  35  -2.823  -7.082  -4.606
  260   HG23  ILE  35          3HG2      ILE  35  -2.202  -5.893  -5.753
  261   HD11  ILE  35          1HD1      ILE  35   0.905  -6.338  -1.750
  262   HD12  ILE  35          2HD1      ILE  35  -0.600  -5.483  -1.406
  263   HD13  ILE  35          3HD1      ILE  35  -0.336  -7.100  -0.755
  264    H    GLN  36           HN       GLN  36   1.173  -6.147  -6.745
  265    HA   GLN  36           HA       GLN  36   0.717  -3.890  -8.307
  266    HB2  GLN  36          2HB       GLN  36   1.552  -6.635  -8.739
  267    HB3  GLN  36          3HB       GLN  36   0.569  -6.044 -10.073
  268    HG2  GLN  36          2HG       GLN  36   2.694  -4.237  -9.117
  269    HG3  GLN  36          3HG       GLN  36   3.221  -5.715  -9.920
  270   HE21  GLN  36          1HE2      GLN  36   0.574  -3.397 -10.402
  271   HE22  GLN  36          2HE2      GLN  36   0.888  -3.128 -12.079
  272    H    GLU  37           HN       GLU  37  -1.346  -3.068  -8.047
  273    HA   GLU  37           HA       GLU  37  -3.695  -4.648  -8.406
  274    HB2  GLU  37          2HB       GLU  37  -3.286  -1.654  -8.384
  275    HB3  GLU  37          3HB       GLU  37  -4.859  -2.434  -8.440
  276    HG2  GLU  37          2HG       GLU  37  -2.919  -3.044  -6.248
  277    HG3  GLU  37          3HG       GLU  37  -3.958  -1.622  -6.178
  278    H    SER  38           HN       SER  38  -5.191  -4.572 -10.124
  279    HA   SER  38           HA       SER  38  -3.930  -4.153 -12.721
  280    HB2  SER  38          2HB       SER  38  -5.010  -6.294 -12.424
  281    HB3  SER  38          3HB       SER  38  -6.512  -5.517 -11.924
  282    HG   SER  38           HG       SER  38  -5.363  -5.004 -14.450
  283    H    ASN  39           HN       ASN  39  -4.586  -1.814 -11.286
  284    HA   ASN  39           HA       ASN  39  -6.681  -0.701 -13.028
  285    HB2  ASN  39          2HB       ASN  39  -6.165   0.067 -10.146
  286    HB3  ASN  39          3HB       ASN  39  -7.378   0.779 -11.205
  287   HD21  ASN  39          1HD2      ASN  39  -6.345  -2.367  -9.946
  288   HD22  ASN  39          2HD2      ASN  39  -7.939  -3.002  -9.746
  289    H    GLY  40           HN       GLY  40  -3.603  -0.804 -12.938
  290    HA2  GLY  40          1HA       GLY  40  -2.065   0.636 -13.930
  291    HA3  GLY  40          2HA       GLY  40  -3.250   1.929 -13.829
  292    H    THR  41           HN       THR  41  -2.643   0.137 -10.961
  293    HA   THR  41           HA       THR  41  -0.551   1.877  -9.996
  294    HB   THR  41           HB       THR  41  -2.685   3.201  -9.703
  295    HG1  THR  41          1HG       THR  41  -0.762   3.465  -8.378
  296   HG21  THR  41          1HG2      THR  41  -3.677   0.808  -8.731
  297   HG22  THR  41          2HG2      THR  41  -4.446   2.388  -8.586
  298   HG23  THR  41          3HG2      THR  41  -3.432   1.778  -7.279
  299    H    TRP  42           HN       TRP  42  -1.020   1.484  -7.244
  300    HA   TRP  42           HA       TRP  42  -1.128  -1.420  -6.907
  301    HB2  TRP  42          2HB       TRP  42   0.947  -1.375  -5.544
  302    HB3  TRP  42          3HB       TRP  42   1.231  -0.966  -7.234
  303    HD1  TRP  42          1HD       TRP  42   1.993   1.529  -7.785
  304    HE1  TRP  42          1HE       TRP  42   2.948   3.410  -6.311
  305    HE3  TRP  42          3HE       TRP  42   0.801  -0.358  -3.186
  306    HZ2  TRP  42          2HZ       TRP  42   3.167   4.015  -3.563
  307    HZ3  TRP  42          3HZ       TRP  42   1.419   0.934  -1.185
  308    HH2  TRP  42          2HH       TRP  42   2.578   3.074  -1.371
  309    H    ARG  43           HN       ARG  43  -1.314  -2.079  -4.645
  310    HA   ARG  43           HA       ARG  43  -2.095   0.012  -2.768
  311    HB2  ARG  43          2HB       ARG  43  -3.933  -2.065  -3.894
  312    HB3  ARG  43          3HB       ARG  43  -4.153  -1.523  -2.235
  313    HG2  ARG  43          2HG       ARG  43  -3.845   0.752  -3.934
  314    HG3  ARG  43          3HG       ARG  43  -5.083  -0.316  -4.597
  315    HD2  ARG  43          2HD       ARG  43  -5.030   0.493  -1.701
  316    HD3  ARG  43          3HD       ARG  43  -5.848   1.453  -2.933
  317    HE   ARG  43           HE       ARG  43  -6.608  -1.333  -2.860
  318   HH11  ARG  43          1HH1      ARG  43  -7.256   1.883  -1.695
  319   HH12  ARG  43          2HH1      ARG  43  -8.904   1.544  -1.285
  320   HH21  ARG  43          1HH2      ARG  43  -8.777  -1.793  -2.324
  321   HH22  ARG  43          2HH2      ARG  43  -9.768  -0.548  -1.643
  322    H    CYS  44           HN       CYS  44  -1.413  -0.430  -0.769
  323    HA   CYS  44           HA       CYS  44   0.319  -2.399  -0.084
  324    HB2  CYS  44          2HB       CYS  44  -0.138  -1.920   2.228
  325    HB3  CYS  44          3HB       CYS  44  -0.295  -0.419   1.322
  326    H    LYS  45           HN       LYS  45   0.092  -4.279   1.360
  327    HA   LYS  45           HA       LYS  45  -1.742  -6.156   0.310
  328    HB2  LYS  45          2HB       LYS  45  -0.464  -6.681   2.942
  329    HB3  LYS  45          3HB       LYS  45  -0.605  -7.724   1.533
  330    HG2  LYS  45          2HG       LYS  45   1.079  -6.128   0.434
  331    HG3  LYS  45          3HG       LYS  45   1.391  -5.560   2.076
  332    HD2  LYS  45          2HD       LYS  45   2.980  -7.218   1.852
  333    HD3  LYS  45          3HD       LYS  45   1.649  -8.107   2.599
  334    HE2  LYS  45          2HE       LYS  45   1.274  -8.159  -0.215
  335    HE3  LYS  45          3HE       LYS  45   2.949  -8.597   0.117
  336    HZ1  LYS  45          1HZ       LYS  45   0.624 -10.148   0.460
  337    HZ2  LYS  45          2HZ       LYS  45   1.371  -9.944   1.964
  338    HZ3  LYS  45          3HZ       LYS  45   2.240 -10.604   0.671
  339    H    VAL  46           HN       VAL  46  -2.244  -3.702   2.478
  340    HA   VAL  46           HA       VAL  46  -4.282  -5.144   4.013
  341    HB   VAL  46           HB       VAL  46  -3.445  -2.273   4.391
  342   HG11  VAL  46          1HG1      VAL  46  -4.399  -2.516   6.586
  343   HG12  VAL  46          2HG1      VAL  46  -5.592  -3.024   5.388
  344   HG13  VAL  46          3HG1      VAL  46  -4.697  -4.232   6.310
  345   HG21  VAL  46          1HG2      VAL  46  -1.540  -3.948   4.555
  346   HG22  VAL  46          2HG2      VAL  46  -1.818  -2.926   5.964
  347   HG23  VAL  46          3HG2      VAL  46  -2.374  -4.599   5.966
  348    H    CYS  47           HN       CYS  47  -3.928  -3.006   1.369
  349    HA   CYS  47           HA       CYS  47  -6.752  -2.210   1.505
  350    HB2  CYS  47          2HB       CYS  47  -4.388  -1.098   0.006
  351    HB3  CYS  47          3HB       CYS  47  -6.041  -0.661  -0.417
  352    H    ALA  48           HN       ALA  48  -4.374  -3.844  -0.503
  353    HA   ALA  48           HA       ALA  48  -6.230  -4.327  -2.654
  354    HB1  ALA  48          1HB       ALA  48  -4.266  -5.972  -3.289
  355    HB2  ALA  48          2HB       ALA  48  -4.115  -4.228  -3.508
  356    HB3  ALA  48          3HB       ALA  48  -3.389  -5.006  -2.101
  357    H    LYS  49           HN       LYS  49  -5.103  -6.017   0.186
  358    HA   LYS  49           HA       LYS  49  -6.473  -8.469  -0.620
  359    HB2  LYS  49          2HB       LYS  49  -4.120  -8.202   0.603
  360    HB3  LYS  49          3HB       LYS  49  -5.144  -8.213   2.033
  361    HG2  LYS  49          2HG       LYS  49  -5.816 -10.387   1.705
  362    HG3  LYS  49          3HG       LYS  49  -5.488 -10.339  -0.029
  363    HD2  LYS  49          2HD       LYS  49  -3.626 -11.476   0.501
  364    HD3  LYS  49          3HD       LYS  49  -3.006  -9.907   1.020
  365    HE2  LYS  49          2HE       LYS  49  -2.692 -10.857   3.015
  366    HE3  LYS  49          3HE       LYS  49  -4.442 -10.772   3.205
  367    HZ1  LYS  49          1HZ       LYS  49  -3.381 -13.070   1.757
  368    HZ2  LYS  49          2HZ       LYS  49  -4.681 -12.976   2.837
  369    HZ3  LYS  49          3HZ       LYS  49  -3.095 -13.027   3.424
  370    H    GLU  50           HN       GLU  50  -8.611  -8.382  -0.298
  371    HA   GLU  50           HA       GLU  50  -9.586  -7.287   2.256
  372    HB2  GLU  50          2HB       GLU  50 -11.613  -6.691   1.204
  373    HB3  GLU  50          3HB       GLU  50 -10.348  -6.203   0.085
  374    HG2  GLU  50          2HG       GLU  50 -10.755  -8.504  -1.012
  375    HG3  GLU  50          3HG       GLU  50 -12.277  -8.474  -0.124
  376    H    ILE  51           HN       ILE  51  -9.967  -8.860   3.667
  377    HA   ILE  51           HA       ILE  51 -10.649 -11.533   2.801
  378    HB   ILE  51           HB       ILE  51 -10.377 -10.380   5.579
  379   HG12  ILE  51          2HG1      ILE  51  -8.502 -12.259   4.144
  380   HG13  ILE  51          3HG1      ILE  51  -8.318 -10.510   4.080
  381   HG21  ILE  51          1HG2      ILE  51 -10.517 -13.281   4.784
  382   HG22  ILE  51          2HG2      ILE  51 -10.472 -12.613   6.415
  383   HG23  ILE  51          3HG2      ILE  51 -11.891 -12.362   5.398
  384   HD11  ILE  51          1HD1      ILE  51  -8.372 -12.081   6.641
  385   HD12  ILE  51          2HD1      ILE  51  -6.896 -11.665   5.769
  386   HD13  ILE  51          3HD1      ILE  51  -7.925 -10.389   6.419
  387    H    GLU  52           HN       GLU  52 -12.614 -12.444   2.779
  388    HA   GLU  52           HA       GLU  52 -14.959 -11.108   2.640
  389    HB2  GLU  52          2HB       GLU  52 -14.352 -13.899   3.552
  390    HB3  GLU  52          3HB       GLU  52 -16.009 -13.313   3.555
  391    HG2  GLU  52          2HG       GLU  52 -15.926 -12.905   1.190
  392    HG3  GLU  52          3HG       GLU  52 -14.213 -13.315   1.142
  393    H    LEU  53           HN       LEU  53 -13.842 -12.739   5.610
  394    HA   LEU  53           HA       LEU  53 -15.873 -11.758   7.272
  395    HB2  LEU  53          2HB       LEU  53 -13.284 -13.092   7.613
  396    HB3  LEU  53          3HB       LEU  53 -13.773 -12.090   8.978
  397    HG   LEU  53           HG       LEU  53 -15.897 -13.857   8.043
  398   HD11  LEU  53          1HD1      LEU  53 -14.134 -15.374   7.497
  399   HD12  LEU  53          2HD1      LEU  53 -14.848 -15.894   9.023
  400   HD13  LEU  53          3HD1      LEU  53 -13.304 -15.042   9.016
  401   HD21  LEU  53          1HD2      LEU  53 -15.991 -12.615  10.132
  402   HD22  LEU  53          2HD2      LEU  53 -14.540 -13.437  10.705
  403   HD23  LEU  53          3HD2      LEU  53 -16.026 -14.352  10.441
  Start of MODEL   11
    1    H1   SER   1           HN       SER   1   7.489   9.017  12.217
    2    HA   SER   1           HA       SER   1   7.620  10.868  10.125
    3    HB2  SER   1          2HB       SER   1   7.637  10.986  12.902
    4    HB3  SER   1          3HB       SER   1   9.197  11.668  12.443
    5    HG   SER   1           HG       SER   1   8.020  13.400  12.159
    6    H    ASP   2           HN       ASP   2   9.486   8.461  10.034
    7    HA   ASP   2           HA       ASP   2  11.899   9.981   9.307
    8    HB2  ASP   2          2HB       ASP   2  11.637   7.781  11.197
    9    HB3  ASP   2          3HB       ASP   2  12.804   7.424   9.925
   10    H    ARG   3           HN       ARG   3   9.400   8.288   8.149
   11    HA   ARG   3           HA       ARG   3   9.003   7.523   6.019
   12    HB2  ARG   3          2HB       ARG   3  11.952   7.348   5.476
   13    HB3  ARG   3          3HB       ARG   3  10.632   7.610   4.342
   14    HG2  ARG   3          2HG       ARG   3  10.746   9.729   6.288
   15    HG3  ARG   3          3HG       ARG   3  12.296   9.532   5.467
   16    HD2  ARG   3          2HD       ARG   3  10.623   9.356   3.367
   17    HD3  ARG   3          3HD       ARG   3   9.684  10.416   4.416
   18    HE   ARG   3           HE       ARG   3  12.406  11.251   4.168
   19   HH11  ARG   3          1HH1      ARG   3   9.281  11.323   2.634
   20   HH12  ARG   3          2HH1      ARG   3   9.600  12.783   1.758
   21   HH21  ARG   3          1HH2      ARG   3  12.837  13.175   3.020
   22   HH22  ARG   3          2HH2      ARG   3  11.623  13.835   1.979
   23    H    THR   4           HN       THR   4   8.520   5.728   7.652
   24    HA   THR   4           HA       THR   4  10.144   3.364   6.970
   25    HB   THR   4           HB       THR   4   8.589   2.988   9.380
   26    HG1  THR   4          1HG       THR   4   9.310   4.606  10.598
   27   HG21  THR   4          1HG2      THR   4  10.539   1.641   8.570
   28   HG22  THR   4          2HG2      THR   4  10.672   2.173  10.246
   29   HG23  THR   4          3HG2      THR   4  11.581   3.003   8.983
   30    H    CYS   5           HN       CYS   5   9.089   1.526   6.348
   31    HA   CYS   5           HA       CYS   5   6.682   1.650   5.046
   32    HB2  CYS   5          2HB       CYS   5   8.369  -0.208   4.908
   33    HB3  CYS   5          3HB       CYS   5   7.729  -0.827   6.427
   34    H    ALA   6           HN       ALA   6   4.563   0.920   5.508
   35    HA   ALA   6           HA       ALA   6   3.805   1.336   8.301
   36    HB1  ALA   6          1HB       ALA   6   2.715   2.233   5.929
   37    HB2  ALA   6          2HB       ALA   6   1.613   0.952   6.436
   38    HB3  ALA   6          3HB       ALA   6   1.955   2.301   7.519
   39    H    ARG   7           HN       ARG   7   4.764  -1.223   6.639
   40    HA   ARG   7           HA       ARG   7   2.823  -3.025   7.932
   41    HB2  ARG   7          2HB       ARG   7   4.348  -3.737   5.436
   42    HB3  ARG   7          3HB       ARG   7   2.942  -4.540   6.121
   43    HG2  ARG   7          2HG       ARG   7   3.038  -1.877   4.730
   44    HG3  ARG   7          3HG       ARG   7   2.231  -3.351   4.192
   45    HD2  ARG   7          2HD       ARG   7   1.408  -1.360   6.224
   46    HD3  ARG   7          3HD       ARG   7   0.435  -2.262   5.063
   47    HE   ARG   7           HE       ARG   7   1.179  -4.198   6.741
   48   HH11  ARG   7          1HH1      ARG   7  -0.087  -1.010   7.342
   49   HH12  ARG   7          2HH1      ARG   7  -0.866  -1.457   8.824
   50   HH21  ARG   7          1HH2      ARG   7   0.157  -4.798   8.690
   51   HH22  ARG   7          2HH2      ARG   7  -0.725  -3.612   9.591
   52    H    CYS   8           HN       CYS   8   6.154  -2.741   6.723
   53    HA   CYS   8           HA       CYS   8   6.987  -4.805   8.634
   54    HB2  CYS   8          2HB       CYS   8   8.864  -3.617   6.635
   55    HB3  CYS   8          3HB       CYS   8   8.800  -5.256   7.273
   56    H    GLN   9           HN       GLN   9   7.048  -1.433   8.093
   57    HA   GLN   9           HA       GLN   9   7.853   0.300   9.331
   58    HB2  GLN   9          2HB       GLN   9   7.865  -1.951  11.172
   59    HB3  GLN   9          3HB       GLN   9   9.147  -0.802  11.534
   60    HG2  GLN   9          2HG       GLN   9   7.719   0.751  12.273
   61    HG3  GLN   9          3HG       GLN   9   6.546   0.425  10.999
   62   HE21  GLN   9          1HE2      GLN   9   5.108  -1.363  11.276
   63   HE22  GLN   9          2HE2      GLN   9   4.684  -1.901  12.862
   64    H    GLU  10           HN       GLU  10   9.460  -1.068   7.324
   65    HA   GLU  10           HA       GLU  10  12.183  -0.842   8.348
   66    HB2  GLU  10          2HB       GLU  10  10.909  -2.075   5.972
   67    HB3  GLU  10          3HB       GLU  10  12.534  -1.445   5.749
   68    HG2  GLU  10          2HG       GLU  10  11.667  -3.509   7.758
   69    HG3  GLU  10          3HG       GLU  10  12.633  -3.780   6.309
   70    H    SER  11           HN       SER  11  13.676   0.642   7.623
   71    HA   SER  11           HA       SER  11  12.855   3.211   7.058
   72    HB2  SER  11          2HB       SER  11  15.093   2.749   7.878
   73    HB3  SER  11          3HB       SER  11  15.498   1.893   6.390
   74    HG   SER  11           HG       SER  11  15.755   4.473   6.896
   75    H    LEU  12           HN       LEU  12  12.750   4.487   5.207
   76    HA   LEU  12           HA       LEU  12  12.428   2.974   2.705
   77    HB2  LEU  12          2HB       LEU  12  11.138   5.457   3.769
   78    HB3  LEU  12          3HB       LEU  12  11.156   5.125   2.039
   79    HG   LEU  12           HG       LEU  12   9.110   4.445   3.548
   80   HD11  LEU  12          1HD1      LEU  12  10.095   2.411   1.581
   81   HD12  LEU  12          2HD1      LEU  12   9.603   4.024   1.067
   82   HD13  LEU  12          3HD1      LEU  12   8.446   2.966   1.876
   83   HD21  LEU  12          1HD2      LEU  12  10.772   1.945   3.721
   84   HD22  LEU  12          2HD2      LEU  12   9.198   2.265   4.450
   85   HD23  LEU  12          3HD2      LEU  12  10.634   3.095   5.050
   86    H    GLY  13           HN       GLY  13  14.959   4.040   3.813
   87    HA2  GLY  13          1HA       GLY  13  15.982   6.325   2.856
   88    HA3  GLY  13          2HA       GLY  13  16.873   4.814   2.749
   89    H    ARG  14           HN       ARG  14  16.972   3.707   0.791
   90    HA   ARG  14           HA       ARG  14  16.592   5.384  -1.533
   91    HB2  ARG  14          2HB       ARG  14  17.694   2.577  -1.307
   92    HB3  ARG  14          3HB       ARG  14  17.752   3.588  -2.745
   93    HG2  ARG  14          2HG       ARG  14  18.947   4.608  -0.216
   94    HG3  ARG  14          3HG       ARG  14  19.816   3.391  -1.154
   95    HD2  ARG  14          2HD       ARG  14  20.652   5.237  -2.170
   96    HD3  ARG  14          3HD       ARG  14  19.183   5.066  -3.132
   97    HE   ARG  14           HE       ARG  14  18.519   6.653  -0.969
   98   HH11  ARG  14          1HH1      ARG  14  20.718   6.788  -3.664
   99   HH12  ARG  14          2HH1      ARG  14  20.692   8.517  -3.767
  100   HH21  ARG  14          1HH2      ARG  14  18.475   8.930  -1.094
  101   HH22  ARG  14          2HH2      ARG  14  19.416   9.735  -2.304
  102    H    LEU  15           HN       LEU  15  14.170   4.637  -0.303
  103    HA   LEU  15           HA       LEU  15  13.039   2.593  -2.068
  104    HB2  LEU  15          2HB       LEU  15  12.392   3.664   0.582
  105    HB3  LEU  15          3HB       LEU  15  10.991   3.394  -0.454
  106    HG   LEU  15           HG       LEU  15  11.957   1.538   1.201
  107   HD11  LEU  15          1HD1      LEU  15   9.917   1.472  -0.241
  108   HD12  LEU  15          2HD1      LEU  15  10.736  -0.078  -0.055
  109   HD13  LEU  15          3HD1      LEU  15  10.929   0.847  -1.544
  110   HD21  LEU  15          1HD2      LEU  15  13.216   0.665  -1.365
  111   HD22  LEU  15          2HD2      LEU  15  13.496   0.084   0.277
  112   HD23  LEU  15          3HD2      LEU  15  14.129   1.653  -0.224
  113    H    SER  16           HN       SER  16  12.876   6.010  -1.329
  114    HA   SER  16           HA       SER  16  12.164   7.731  -2.685
  115    HB2  SER  16          2HB       SER  16  12.269   5.695  -4.507
  116    HB3  SER  16          3HB       SER  16  10.554   6.109  -4.544
  117    HG   SER  16           HG       SER  16  12.052   7.310  -5.991
  118    HA   PRO  17           HA       PRO  17   8.232   7.212  -0.333
  119    HB2  PRO  17          2HB       PRO  17   8.482   9.554   1.018
  120    HB3  PRO  17          3HB       PRO  17   9.228   8.046   1.562
  121    HG2  PRO  17          2HG       PRO  17  10.452  10.335   0.069
  122    HG3  PRO  17          3HG       PRO  17  11.111   9.405   1.428
  123    HD2  PRO  17          2HD       PRO  17  11.851   8.958  -1.139
  124    HD3  PRO  17          3HD       PRO  17  11.781   7.664   0.075
  125    H    LYS  18           HN       LYS  18   9.351   9.093  -2.809
  126    HA   LYS  18           HA       LYS  18   7.345  11.133  -2.861
  127    HB2  LYS  18          2HB       LYS  18   9.502  11.454  -3.966
  128    HB3  LYS  18          3HB       LYS  18   9.166  10.105  -5.044
  129    HG2  LYS  18          2HG       LYS  18   8.720  12.022  -6.305
  130    HG3  LYS  18          3HG       LYS  18   7.135  11.423  -5.813
  131    HD2  LYS  18          2HD       LYS  18   6.907  13.096  -4.162
  132    HD3  LYS  18          3HD       LYS  18   8.615  13.531  -4.259
  133    HE2  LYS  18          2HE       LYS  18   8.301  14.865  -6.044
  134    HE3  LYS  18          3HE       LYS  18   7.138  13.766  -6.786
  135    HZ1  LYS  18          1HZ       LYS  18   5.659  15.323  -6.224
  136    HZ2  LYS  18          2HZ       LYS  18   6.684  16.058  -5.098
  137    HZ3  LYS  18          3HZ       LYS  18   5.778  14.699  -4.657
  138    H    THR  19           HN       THR  19   7.633   7.883  -4.094
  139    HA   THR  19           HA       THR  19   4.878   8.079  -5.106
  140    HB   THR  19           HB       THR  19   5.461   7.492  -7.172
  141    HG1  THR  19          1HG       THR  19   6.396   5.479  -7.545
  142   HG21  THR  19          1HG2      THR  19   8.340   7.277  -6.312
  143   HG22  THR  19          2HG2      THR  19   7.521   8.823  -6.544
  144   HG23  THR  19          3HG2      THR  19   7.708   7.711  -7.900
  145    H    ASN  20           HN       ASN  20   6.778   6.772  -2.836
  146    HA   ASN  20           HA       ASN  20   5.625   4.087  -2.919
  147    HB2  ASN  20          2HB       ASN  20   7.728   5.317  -1.125
  148    HB3  ASN  20          3HB       ASN  20   7.144   3.662  -0.973
  149   HD21  ASN  20          1HD2      ASN  20   9.230   2.876  -1.350
  150   HD22  ASN  20          2HD2      ASN  20   9.917   2.859  -2.935
  151    H    THR  21           HN       THR  21   3.664   5.880  -2.540
  152    HA   THR  21           HA       THR  21   2.967   5.495   0.291
  153    HB   THR  21           HB       THR  21   2.281   7.977  -1.294
  154    HG1  THR  21          1HG       THR  21   4.583   7.413  -0.279
  155   HG21  THR  21          1HG2      THR  21   1.089   8.706   0.499
  156   HG22  THR  21          2HG2      THR  21   2.119   7.870   1.661
  157   HG23  THR  21          3HG2      THR  21   0.891   6.975   0.767
  158    H    CYS  22           HN       CYS  22   1.354   4.073   0.292
  159    HA   CYS  22           HA       CYS  22  -0.274   3.334  -1.794
  160    HB2  CYS  22          2HB       CYS  22  -0.094   2.095   0.333
  161    HB3  CYS  22          3HB       CYS  22  -1.018   3.358   1.139
  162    H    ARG  23           HN       ARG  23  -2.160   4.015  -2.681
  163    HA   ARG  23           HA       ARG  23  -3.010   6.714  -2.026
  164    HB2  ARG  23          2HB       ARG  23  -4.554   5.362  -4.088
  165    HB3  ARG  23          3HB       ARG  23  -3.628   6.854  -4.176
  166    HG2  ARG  23          2HG       ARG  23  -1.576   5.250  -4.246
  167    HG3  ARG  23          3HG       ARG  23  -2.775   4.059  -4.756
  168    HD2  ARG  23          2HD       ARG  23  -2.450   6.745  -6.075
  169    HD3  ARG  23          3HD       ARG  23  -1.593   5.300  -6.608
  170    HE   ARG  23           HE       ARG  23  -4.260   4.612  -6.524
  171   HH11  ARG  23          1HH1      ARG  23  -2.293   6.953  -8.189
  172   HH12  ARG  23          2HH1      ARG  23  -3.310   7.002  -9.592
  173   HH21  ARG  23          1HH2      ARG  23  -5.606   4.667  -8.364
  174   HH22  ARG  23          2HH2      ARG  23  -5.193   5.703  -9.690
  175    H    GLY  24           HN       GLY  24  -3.611   4.176  -0.397
  176    HA2  GLY  24          1HA       GLY  24  -6.544   4.527  -0.308
  177    HA3  GLY  24          2HA       GLY  24  -5.732   3.020   0.089
  178    H    CYS  25           HN       CYS  25  -3.683   3.903   1.706
  179    HA   CYS  25           HA       CYS  25  -5.190   4.891   4.030
  180    HB2  CYS  25          2HB       CYS  25  -3.172   3.876   5.290
  181    HB3  CYS  25          3HB       CYS  25  -4.358   2.779   4.593
  182    H    ASN  26           HN       ASN  26  -2.608   5.605   1.887
  183    HA   ASN  26           HA       ASN  26  -1.392   7.527   1.638
  184    HB2  ASN  26          2HB       ASN  26  -2.430   8.539   4.277
  185    HB3  ASN  26          3HB       ASN  26  -1.881   9.467   2.884
  186   HD21  ASN  26          1HD2      ASN  26  -3.286   9.940   1.269
  187   HD22  ASN  26          2HD2      ASN  26  -4.967   9.544   1.311
  188    H    HIS  27           HN       HIS  27  -0.590   5.113   3.147
  189    HA   HIS  27           HA       HIS  27   1.506   6.297   4.847
  190    HB2  HIS  27          2HB       HIS  27   0.328   3.512   4.944
  191    HB3  HIS  27          3HB       HIS  27   1.632   4.100   5.972
  192    HD1  HIS  27          1HD       HIS  27   0.496   6.808   6.820
  193    HD2  HIS  27          2HD       HIS  27  -1.733   3.304   6.700
  194    HE1  HIS  27          1HE       HIS  27  -1.420   7.175   8.407
  195    H    LEU  28           HN       LEU  28   3.589   5.140   4.848
  196    HA   LEU  28           HA       LEU  28   4.474   4.688   2.164
  197    HB2  LEU  28          2HB       LEU  28   5.807   4.604   4.850
  198    HB3  LEU  28          3HB       LEU  28   6.656   4.106   3.388
  199    HG   LEU  28           HG       LEU  28   5.471   6.845   3.835
  200   HD11  LEU  28          1HD1      LEU  28   7.936   5.666   4.761
  201   HD12  LEU  28          2HD1      LEU  28   7.241   7.247   5.113
  202   HD13  LEU  28          3HD1      LEU  28   8.241   7.025   3.678
  203   HD21  LEU  28          1HD2      LEU  28   5.612   6.794   1.578
  204   HD22  LEU  28          2HD2      LEU  28   6.800   5.490   1.570
  205   HD23  LEU  28          3HD2      LEU  28   7.309   7.145   1.907
  206    H    VAL  29           HN       VAL  29   5.279   2.801   1.250
  207    HA   VAL  29           HA       VAL  29   5.125   0.308   2.734
  208    HB   VAL  29           HB       VAL  29   3.784  -0.124   0.225
  209   HG11  VAL  29          1HG1      VAL  29   3.871  -1.318   2.624
  210   HG12  VAL  29          2HG1      VAL  29   2.349  -0.438   2.786
  211   HG13  VAL  29          3HG1      VAL  29   2.573  -1.580   1.460
  212   HG21  VAL  29          1HG2      VAL  29   2.978   2.136   0.386
  213   HG22  VAL  29          2HG2      VAL  29   1.661   1.035   0.795
  214   HG23  VAL  29          3HG2      VAL  29   2.519   1.897   2.072
  215    H    CYS  30           HN       CYS  30   6.943  -0.720   2.271
  216    HA   CYS  30           HA       CYS  30   8.772  -0.068   0.323
  217    HB2  CYS  30          2HB       CYS  30   9.764  -2.293   0.698
  218    HB3  CYS  30          3HB       CYS  30   9.319  -1.515   2.213
  219    H    ARG  31           HN       ARG  31   9.537  -1.825  -1.371
  220    HA   ARG  31           HA       ARG  31   7.401  -1.977  -3.310
  221    HB2  ARG  31          2HB       ARG  31   9.324  -3.023  -4.707
  222    HB3  ARG  31          3HB       ARG  31   9.390  -1.311  -4.305
  223    HG2  ARG  31          2HG       ARG  31  11.166  -1.561  -2.916
  224    HG3  ARG  31          3HG       ARG  31  10.696  -3.191  -2.429
  225    HD2  ARG  31          2HD       ARG  31  11.749  -4.172  -4.199
  226    HD3  ARG  31          3HD       ARG  31  11.518  -2.776  -5.250
  227    HE   ARG  31           HE       ARG  31  13.805  -3.343  -3.708
  228   HH11  ARG  31          1HH1      ARG  31  11.756  -0.687  -4.638
  229   HH12  ARG  31          2HH1      ARG  31  13.012   0.499  -4.505
  230   HH21  ARG  31          1HH2      ARG  31  15.468  -1.791  -3.529
  231   HH22  ARG  31          2HH2      ARG  31  15.122  -0.129  -3.875
  232    H    ASP  32           HN       ASP  32   7.601  -3.752  -0.829
  233    HA   ASP  32           HA       ASP  32   7.209  -6.302  -2.250
  234    HB2  ASP  32          2HB       ASP  32   9.314  -6.315  -0.934
  235    HB3  ASP  32          3HB       ASP  32   8.379  -5.976   0.521
  236    H    CYS  33           HN       CYS  33   5.856  -3.909  -0.363
  237    HA   CYS  33           HA       CYS  33   3.833  -5.722   0.763
  238    HB2  CYS  33          2HB       CYS  33   4.679  -2.928   1.523
  239    HB3  CYS  33          3HB       CYS  33   3.201  -3.664   2.132
  240    H    ARG  34           HN       ARG  34   4.240  -4.234  -1.993
  241    HA   ARG  34           HA       ARG  34   1.618  -2.937  -2.134
  242    HB2  ARG  34          2HB       ARG  34   3.497  -3.046  -4.455
  243    HB3  ARG  34          3HB       ARG  34   2.365  -1.782  -3.992
  244    HG2  ARG  34          2HG       ARG  34   3.805  -0.929  -2.358
  245    HG3  ARG  34          3HG       ARG  34   4.799  -2.388  -2.353
  246    HD2  ARG  34          2HD       ARG  34   5.716  -1.873  -4.481
  247    HD3  ARG  34          3HD       ARG  34   4.535  -0.592  -4.752
  248    HE   ARG  34           HE       ARG  34   6.068  -0.042  -2.441
  249   HH11  ARG  34          1HH1      ARG  34   6.273  -0.077  -5.916
  250   HH12  ARG  34          2HH1      ARG  34   7.492   1.153  -5.987
  251   HH21  ARG  34          1HH2      ARG  34   7.673   1.577  -2.521
  252   HH22  ARG  34          2HH2      ARG  34   8.288   2.092  -4.055
  253    H    ILE  35           HN       ILE  35  -0.060  -3.775  -3.235
  254    HA   ILE  35           HA       ILE  35   0.340  -6.401  -4.489
  255    HB   ILE  35           HB       ILE  35  -1.995  -5.125  -3.127
  256   HG12  ILE  35          2HG1      ILE  35  -2.124  -7.434  -2.133
  257   HG13  ILE  35          3HG1      ILE  35  -0.660  -7.835  -3.023
  258   HG21  ILE  35          1HG2      ILE  35  -3.227  -5.734  -4.943
  259   HG22  ILE  35          2HG2      ILE  35  -2.099  -7.001  -5.422
  260   HG23  ILE  35          3HG2      ILE  35  -3.215  -7.275  -4.084
  261   HD11  ILE  35          1HD1      ILE  35  -0.364  -7.198  -0.607
  262   HD12  ILE  35          2HD1      ILE  35   0.631  -6.319  -1.769
  263   HD13  ILE  35          3HD1      ILE  35  -0.801  -5.555  -1.079
  264    H    GLN  36           HN       GLN  36   0.695  -6.171  -6.611
  265    HA   GLN  36           HA       GLN  36   0.020  -4.096  -8.267
  266    HB2  GLN  36          2HB       GLN  36   0.633  -6.964  -8.680
  267    HB3  GLN  36          3HB       GLN  36  -0.134  -6.131 -10.025
  268    HG2  GLN  36          2HG       GLN  36   2.194  -4.826  -8.733
  269    HG3  GLN  36          3HG       GLN  36   2.489  -6.239  -9.747
  270   HE21  GLN  36          1HE2      GLN  36   0.982  -3.054  -9.706
  271   HE22  GLN  36          2HE2      GLN  36   1.172  -2.742 -11.394
  272    H    GLU  37           HN       GLU  37  -1.887  -3.210  -8.678
  273    HA   GLU  37           HA       GLU  37  -4.318  -4.786  -8.456
  274    HB2  GLU  37          2HB       GLU  37  -3.883  -1.838  -8.958
  275    HB3  GLU  37          3HB       GLU  37  -5.459  -2.597  -8.785
  276    HG2  GLU  37          2HG       GLU  37  -3.456  -2.965  -6.620
  277    HG3  GLU  37          3HG       GLU  37  -4.282  -1.414  -6.763
  278    H    SER  38           HN       SER  38  -2.245  -3.501 -10.892
  279    HA   SER  38           HA       SER  38  -2.209  -3.915 -13.147
  280    HB2  SER  38          2HB       SER  38  -3.886  -5.902 -12.270
  281    HB3  SER  38          3HB       SER  38  -4.920  -5.026 -13.397
  282    HG   SER  38           HG       SER  38  -3.820  -6.514 -14.593
  283    H    ASN  39           HN       ASN  39  -5.389  -2.949 -11.894
  284    HA   ASN  39           HA       ASN  39  -6.529  -1.652 -13.959
  285    HB2  ASN  39          2HB       ASN  39  -7.636  -0.205 -12.398
  286    HB3  ASN  39          3HB       ASN  39  -7.397  -1.757 -11.602
  287   HD21  ASN  39          1HD2      ASN  39  -6.964  -1.461  -9.548
  288   HD22  ASN  39          2HD2      ASN  39  -5.918  -0.254  -8.888
  289    H    GLY  40           HN       GLY  40  -3.689  -0.602 -12.204
  290    HA2  GLY  40          1HA       GLY  40  -2.353   0.791 -14.004
  291    HA3  GLY  40          2HA       GLY  40  -3.631   1.942 -13.644
  292    H    THR  41           HN       THR  41  -3.430   0.579 -10.807
  293    HA   THR  41           HA       THR  41  -1.069   2.082  -9.900
  294    HB   THR  41           HB       THR  41  -3.221   3.354  -9.509
  295    HG1  THR  41          1HG       THR  41  -1.142   3.280  -8.119
  296   HG21  THR  41          1HG2      THR  41  -4.951   2.403  -8.471
  297   HG22  THR  41          2HG2      THR  41  -3.933   1.932  -7.110
  298   HG23  THR  41          3HG2      THR  41  -4.076   0.874  -8.514
  299    H    TRP  42           HN       TRP  42  -1.624   1.561  -7.125
  300    HA   TRP  42           HA       TRP  42  -1.730  -1.321  -6.840
  301    HB2  TRP  42          2HB       TRP  42   0.474  -1.461  -5.729
  302    HB3  TRP  42          3HB       TRP  42   0.612  -0.994  -7.422
  303    HD1  TRP  42          1HD       TRP  42   1.741   1.299  -7.955
  304    HE1  TRP  42          1HE       TRP  42   2.868   3.112  -6.516
  305    HE3  TRP  42          3HE       TRP  42   0.281  -0.313  -3.328
  306    HZ2  TRP  42          2HZ       TRP  42   3.107   3.770  -3.782
  307    HZ3  TRP  42          3HZ       TRP  42   1.002   0.964  -1.353
  308    HH2  TRP  42          2HH       TRP  42   2.386   2.962  -1.577
  309    H    ARG  43           HN       ARG  43  -1.716  -2.000  -4.575
  310    HA   ARG  43           HA       ARG  43  -2.198   0.129  -2.631
  311    HB2  ARG  43          2HB       ARG  43  -4.176  -1.985  -3.440
  312    HB3  ARG  43          3HB       ARG  43  -4.219  -1.274  -1.832
  313    HG2  ARG  43          2HG       ARG  43  -4.054   0.802  -3.795
  314    HG3  ARG  43          3HG       ARG  43  -5.381  -0.293  -4.187
  315    HD2  ARG  43          2HD       ARG  43  -5.161   0.453  -1.351
  316    HD3  ARG  43          3HD       ARG  43  -5.562   1.775  -2.446
  317    HE   ARG  43           HE       ARG  43  -7.298  -0.274  -1.596
  318   HH11  ARG  43          1HH1      ARG  43  -6.432   1.539  -4.439
  319   HH12  ARG  43          2HH1      ARG  43  -7.995   1.387  -5.172
  320   HH21  ARG  43          1HH2      ARG  43  -9.360  -0.482  -2.551
  321   HH22  ARG  43          2HH2      ARG  43  -9.659   0.237  -4.097
  322    H    CYS  44           HN       CYS  44  -1.612  -0.381  -0.566
  323    HA   CYS  44           HA       CYS  44   0.266  -2.349  -0.093
  324    HB2  CYS  44          2HB       CYS  44   0.002  -1.870   2.265
  325    HB3  CYS  44          3HB       CYS  44  -0.135  -0.368   1.357
  326    H    LYS  45           HN       LYS  45   0.086  -4.154   1.528
  327    HA   LYS  45           HA       LYS  45  -1.818  -6.048   0.615
  328    HB2  LYS  45          2HB       LYS  45  -0.402  -6.521   3.183
  329    HB3  LYS  45          3HB       LYS  45  -0.625  -7.593   1.808
  330    HG2  LYS  45          2HG       LYS  45   0.995  -5.855   0.650
  331    HG3  LYS  45          3HG       LYS  45   1.485  -5.574   2.321
  332    HD2  LYS  45          2HD       LYS  45   2.929  -7.262   1.701
  333    HD3  LYS  45          3HD       LYS  45   1.605  -8.183   2.419
  334    HE2  LYS  45          2HE       LYS  45   0.703  -8.682   0.250
  335    HE3  LYS  45          3HE       LYS  45   1.863  -7.606  -0.529
  336    HZ1  LYS  45          1HZ       LYS  45   3.638  -9.091   0.353
  337    HZ2  LYS  45          2HZ       LYS  45   2.633  -9.818  -0.797
  338    HZ3  LYS  45          3HZ       LYS  45   2.433 -10.172   0.846
  339    H    VAL  46           HN       VAL  46  -2.050  -3.567   2.865
  340    HA   VAL  46           HA       VAL  46  -4.017  -4.910   4.546
  341    HB   VAL  46           HB       VAL  46  -3.211  -2.010   4.698
  342   HG11  VAL  46          1HG1      VAL  46  -5.224  -2.644   5.925
  343   HG12  VAL  46          2HG1      VAL  46  -4.327  -3.921   6.749
  344   HG13  VAL  46          3HG1      VAL  46  -3.913  -2.229   7.028
  345   HG21  VAL  46          1HG2      VAL  46  -1.316  -3.811   4.818
  346   HG22  VAL  46          2HG2      VAL  46  -1.367  -2.494   5.991
  347   HG23  VAL  46          3HG2      VAL  46  -1.965  -4.094   6.433
  348    H    CYS  47           HN       CYS  47  -3.859  -2.774   1.838
  349    HA   CYS  47           HA       CYS  47  -6.688  -2.057   2.114
  350    HB2  CYS  47          2HB       CYS  47  -4.459  -1.000   0.382
  351    HB3  CYS  47          3HB       CYS  47  -6.144  -0.585   0.088
  352    H    ALA  48           HN       ALA  48  -4.425  -3.610  -0.119
  353    HA   ALA  48           HA       ALA  48  -6.393  -4.235  -2.084
  354    HB1  ALA  48          1HB       ALA  48  -3.717  -5.557  -1.671
  355    HB2  ALA  48          2HB       ALA  48  -4.684  -5.541  -3.146
  356    HB3  ALA  48          3HB       ALA  48  -3.959  -4.047  -2.550
  357    H    LYS  49           HN       LYS  49  -5.065  -5.909   0.706
  358    HA   LYS  49           HA       LYS  49  -6.922  -8.140   0.196
  359    HB2  LYS  49          2HB       LYS  49  -4.230  -8.044   1.530
  360    HB3  LYS  49          3HB       LYS  49  -5.359  -9.349   1.871
  361    HG2  LYS  49          2HG       LYS  49  -5.214 -10.211  -0.265
  362    HG3  LYS  49          3HG       LYS  49  -4.657  -8.685  -0.955
  363    HD2  LYS  49          2HD       LYS  49  -2.724  -9.962  -0.947
  364    HD3  LYS  49          3HD       LYS  49  -2.580  -9.052   0.558
  365    HE2  LYS  49          2HE       LYS  49  -2.726 -10.900   1.819
  366    HE3  LYS  49          3HE       LYS  49  -4.030 -11.572   0.842
  367    HZ1  LYS  49          1HZ       LYS  49  -1.614 -12.629   0.922
  368    HZ2  LYS  49          2HZ       LYS  49  -1.375 -11.548  -0.357
  369    HZ3  LYS  49          3HZ       LYS  49  -2.596 -12.715  -0.453
  370    H    GLU  50           HN       GLU  50  -7.726  -9.218   2.213
  371    HA   GLU  50           HA       GLU  50  -8.834  -9.173   4.202
  372    HB2  GLU  50          2HB       GLU  50  -6.482  -7.749   4.690
  373    HB3  GLU  50          3HB       GLU  50  -7.762  -6.722   5.320
  374    HG2  GLU  50          2HG       GLU  50  -8.555  -8.493   6.740
  375    HG3  GLU  50          3HG       GLU  50  -7.397  -9.620   6.037
  376    H    ILE  51           HN       ILE  51 -10.355  -7.775   5.522
  377    HA   ILE  51           HA       ILE  51 -11.735  -5.944   3.689
  378    HB   ILE  51           HB       ILE  51 -13.593  -6.267   5.527
  379   HG12  ILE  51          2HG1      ILE  51 -12.007  -8.830   5.791
  380   HG13  ILE  51          3HG1      ILE  51 -12.072  -7.568   7.018
  381   HG21  ILE  51          1HG2      ILE  51 -13.029  -7.398   3.031
  382   HG22  ILE  51          2HG2      ILE  51 -13.564  -8.731   4.052
  383   HG23  ILE  51          3HG2      ILE  51 -14.592  -7.314   3.843
  384   HD11  ILE  51          1HD1      ILE  51 -14.729  -8.139   6.465
  385   HD12  ILE  51          2HD1      ILE  51 -13.921  -9.708   6.477
  386   HD13  ILE  51          3HD1      ILE  51 -13.803  -8.644   7.878
  387    H    GLU  52           HN       GLU  52 -13.063  -4.215   4.909
  388    HA   GLU  52           HA       GLU  52 -11.771  -3.173   7.286
  389    HB2  GLU  52          2HB       GLU  52 -11.590  -0.886   6.032
  390    HB3  GLU  52          3HB       GLU  52 -10.305  -2.076   5.881
  391    HG2  GLU  52          2HG       GLU  52 -10.592  -1.440   3.702
  392    HG3  GLU  52          3HG       GLU  52 -11.641  -2.854   3.790
  393    H    LEU  53           HN       LEU  53 -12.911  -1.308   8.183
  394    HA   LEU  53           HA       LEU  53 -15.748  -1.622   7.923
  395    HB2  LEU  53          2HB       LEU  53 -14.186  -0.949   9.977
  396    HB3  LEU  53          3HB       LEU  53 -14.611   0.669   9.421
  397    HG   LEU  53           HG       LEU  53 -17.063  -0.367   9.543
  398   HD11  LEU  53          1HD1      LEU  53 -17.378  -2.085  10.980
  399   HD12  LEU  53          2HD1      LEU  53 -15.981  -1.662  11.969
  400   HD13  LEU  53          3HD1      LEU  53 -15.753  -2.514  10.442
  401   HD21  LEU  53          1HD2      LEU  53 -17.361   1.034  11.294
  402   HD22  LEU  53          2HD2      LEU  53 -15.726   1.539  10.866
  403   HD23  LEU  53          3HD2      LEU  53 -15.980   0.395  12.186
  Start of MODEL   12
    1    H1   SER   1           HN       SER   1   8.385  13.347  10.720
    2    HA   SER   1           HA       SER   1   7.686  10.497  10.442
    3    HB2  SER   1          2HB       SER   1   6.326  12.203   9.062
    4    HB3  SER   1          3HB       SER   1   7.798  12.401   8.111
    5    HG   SER   1           HG       SER   1   6.962  10.755   7.070
    6    H    ASP   2           HN       ASP   2   9.204   9.146   9.610
    7    HA   ASP   2           HA       ASP   2  11.793  10.349   8.874
    8    HB2  ASP   2          2HB       ASP   2  11.150   7.985  10.604
    9    HB3  ASP   2          3HB       ASP   2  12.681   8.042   9.734
   10    H    ARG   3           HN       ARG   3   9.199   8.569   7.798
   11    HA   ARG   3           HA       ARG   3   8.835   7.684   5.704
   12    HB2  ARG   3          2HB       ARG   3  11.785   7.470   5.202
   13    HB3  ARG   3          3HB       ARG   3  10.479   7.682   4.045
   14    HG2  ARG   3          2HG       ARG   3  10.533   9.915   5.827
   15    HG3  ARG   3          3HG       ARG   3  12.144   9.649   5.158
   16    HD2  ARG   3          2HD       ARG   3  10.661   9.346   2.935
   17    HD3  ARG   3          3HD       ARG   3   9.643  10.477   3.825
   18    HE   ARG   3           HE       ARG   3  12.240  11.456   3.926
   19   HH11  ARG   3          1HH1      ARG   3   9.804  10.795   1.528
   20   HH12  ARG   3          2HH1      ARG   3  10.342  12.040   0.450
   21   HH21  ARG   3          1HH2      ARG   3  12.957  13.099   2.516
   22   HH22  ARG   3          2HH2      ARG   3  12.135  13.351   1.013
   23    H    THR   4           HN       THR   4   8.304   5.990   7.400
   24    HA   THR   4           HA       THR   4   9.986   3.608   6.963
   25    HB   THR   4           HB       THR   4   8.288   3.351   9.285
   26    HG1  THR   4          1HG       THR   4   8.704   5.153  10.309
   27   HG21  THR   4          1HG2      THR   4  11.296   3.396   9.012
   28   HG22  THR   4          2HG2      THR   4  10.277   1.980   8.755
   29   HG23  THR   4          3HG2      THR   4  10.373   2.720  10.353
   30    H    CYS   5           HN       CYS   5   8.982   1.687   6.468
   31    HA   CYS   5           HA       CYS   5   6.614   1.740   5.024
   32    HB2  CYS   5          2HB       CYS   5   8.392  -0.047   4.960
   33    HB3  CYS   5          3HB       CYS   5   7.710  -0.687   6.451
   34    H    ALA   6           HN       ALA   6   4.515   0.935   5.449
   35    HA   ALA   6           HA       ALA   6   3.672   1.365   8.210
   36    HB1  ALA   6          1HB       ALA   6   2.605   2.264   5.908
   37    HB2  ALA   6          2HB       ALA   6   1.642   0.806   6.148
   38    HB3  ALA   6          3HB       ALA   6   1.684   2.050   7.397
   39    H    ARG   7           HN       ARG   7   4.732  -1.193   6.519
   40    HA   ARG   7           HA       ARG   7   2.941  -3.057   7.932
   41    HB2  ARG   7          2HB       ARG   7   4.370  -3.749   5.375
   42    HB3  ARG   7          3HB       ARG   7   3.024  -4.586   6.137
   43    HG2  ARG   7          2HG       ARG   7   2.964  -1.942   4.708
   44    HG3  ARG   7          3HG       ARG   7   2.194  -3.452   4.221
   45    HD2  ARG   7          2HD       ARG   7   1.385  -1.474   6.274
   46    HD3  ARG   7          3HD       ARG   7   0.397  -2.409   5.153
   47    HE   ARG   7           HE       ARG   7   1.266  -4.316   6.802
   48   HH11  ARG   7          1HH1      ARG   7  -0.078  -1.170   7.450
   49   HH12  ARG   7          2HH1      ARG   7  -0.784  -1.639   8.960
   50   HH21  ARG   7          1HH2      ARG   7   0.338  -4.946   8.789
   51   HH22  ARG   7          2HH2      ARG   7  -0.546  -3.787   9.721
   52    H    CYS   8           HN       CYS   8   6.205  -2.461   6.714
   53    HA   CYS   8           HA       CYS   8   7.236  -4.595   8.442
   54    HB2  CYS   8          2HB       CYS   8   8.807  -3.002   6.419
   55    HB3  CYS   8          3HB       CYS   8   9.231  -4.549   7.143
   56    H    GLN   9           HN       GLN   9   7.025  -1.180   8.153
   57    HA   GLN   9           HA       GLN   9   7.689   0.521   9.512
   58    HB2  GLN   9          2HB       GLN   9   7.763  -1.843  11.232
   59    HB3  GLN   9          3HB       GLN   9   8.875  -0.582  11.746
   60    HG2  GLN   9          2HG       GLN   9   7.208   0.880  12.262
   61    HG3  GLN   9          3HG       GLN   9   6.095   0.203  11.073
   62   HE21  GLN   9          1HE2      GLN   9   5.738  -2.293  11.634
   63   HE22  GLN   9          2HE2      GLN   9   5.201  -2.552  13.255
   64    H    GLU  10           HN       GLU  10   9.510  -0.781   7.577
   65    HA   GLU  10           HA       GLU  10  12.129  -0.324   8.797
   66    HB2  GLU  10          2HB       GLU  10  11.243  -1.584   6.212
   67    HB3  GLU  10          3HB       GLU  10  12.922  -1.147   6.494
   68    HG2  GLU  10          2HG       GLU  10  13.153  -2.694   8.235
   69    HG3  GLU  10          3HG       GLU  10  11.410  -2.898   8.397
   70    H    SER  11           HN       SER  11  13.648   1.120   7.905
   71    HA   SER  11           HA       SER  11  12.684   3.629   7.200
   72    HB2  SER  11          2HB       SER  11  15.183   3.827   6.268
   73    HB3  SER  11          3HB       SER  11  14.829   3.789   7.995
   74    HG   SER  11           HG       SER  11  16.482   2.259   6.974
   75    H    LEU  12           HN       LEU  12  12.541   4.767   5.277
   76    HA   LEU  12           HA       LEU  12  12.419   3.093   2.865
   77    HB2  LEU  12          2HB       LEU  12  10.970   5.565   3.726
   78    HB3  LEU  12          3HB       LEU  12  11.085   5.149   2.018
   79    HG   LEU  12           HG       LEU  12   9.008   4.443   3.484
   80   HD11  LEU  12          1HD1      LEU  12  10.405   3.000   1.279
   81   HD12  LEU  12          2HD1      LEU  12   8.892   3.906   1.252
   82   HD13  LEU  12          3HD1      LEU  12   8.949   2.305   1.990
   83   HD21  LEU  12          1HD2      LEU  12   9.161   2.317   4.485
   84   HD22  LEU  12          2HD2      LEU  12  10.552   3.221   5.084
   85   HD23  LEU  12          3HD2      LEU  12  10.762   2.022   3.806
   86    H    GLY  13           HN       GLY  13  14.852   4.345   3.995
   87    HA2  GLY  13          1HA       GLY  13  15.753   6.630   2.840
   88    HA3  GLY  13          2HA       GLY  13  16.767   5.209   3.035
   89    H    ARG  14           HN       ARG  14  17.223   3.916   1.276
   90    HA   ARG  14           HA       ARG  14  16.865   5.184  -1.296
   91    HB2  ARG  14          2HB       ARG  14  18.899   3.743  -0.223
   92    HB3  ARG  14          3HB       ARG  14  18.096   2.504  -1.177
   93    HG2  ARG  14          2HG       ARG  14  19.196   3.245  -2.946
   94    HG3  ARG  14          3HG       ARG  14  18.259   4.737  -2.847
   95    HD2  ARG  14          2HD       ARG  14  20.542   5.371  -2.863
   96    HD3  ARG  14          3HD       ARG  14  19.977   5.570  -1.205
   97    HE   ARG  14           HE       ARG  14  21.062   3.019  -1.413
   98   HH11  ARG  14          1HH1      ARG  14  22.115   6.329  -1.646
   99   HH12  ARG  14          2HH1      ARG  14  23.726   5.991  -1.103
  100   HH21  ARG  14          1HH2      ARG  14  23.179   2.562  -0.697
  101   HH22  ARG  14          2HH2      ARG  14  24.330   3.849  -0.564
  102    H    LEU  15           HN       LEU  15  14.404   4.679  -0.714
  103    HA   LEU  15           HA       LEU  15  13.707   2.340  -2.342
  104    HB2  LEU  15          2HB       LEU  15  13.454   2.141   0.280
  105    HB3  LEU  15          3HB       LEU  15  11.966   3.033  -0.031
  106    HG   LEU  15           HG       LEU  15  11.079   1.269  -1.347
  107   HD11  LEU  15          1HD1      LEU  15  13.896   0.302  -1.382
  108   HD12  LEU  15          2HD1      LEU  15  12.734   0.443  -2.700
  109   HD13  LEU  15          3HD1      LEU  15  12.583  -0.867  -1.529
  110   HD21  LEU  15          1HD2      LEU  15  11.411  -0.727   0.256
  111   HD22  LEU  15          2HD2      LEU  15  10.681   0.752   0.881
  112   HD23  LEU  15          3HD2      LEU  15  12.379   0.398   1.207
  113    H    SER  16           HN       SER  16  13.608   5.556  -2.076
  114    HA   SER  16           HA       SER  16  12.352   7.228  -2.973
  115    HB2  SER  16          2HB       SER  16  11.691   4.863  -4.674
  116    HB3  SER  16          3HB       SER  16  10.740   6.334  -4.881
  117    HG   SER  16           HG       SER  16  12.498   7.399  -5.559
  118    HA   PRO  17           HA       PRO  17   8.782   6.137  -0.225
  119    HB2  PRO  17          2HB       PRO  17   9.031   8.333   1.350
  120    HB3  PRO  17          3HB       PRO  17   9.926   6.837   1.641
  121    HG2  PRO  17          2HG       PRO  17  10.830   9.357   0.300
  122    HG3  PRO  17          3HG       PRO  17  11.692   8.340   1.470
  123    HD2  PRO  17          2HD       PRO  17  12.174   8.225  -1.192
  124    HD3  PRO  17          3HD       PRO  17  12.319   6.808  -0.133
  125    H    LYS  18           HN       LYS  18   9.535   8.410  -2.533
  126    HA   LYS  18           HA       LYS  18   7.319  10.201  -2.148
  127    HB2  LYS  18          2HB       LYS  18   9.626  10.526  -3.422
  128    HB3  LYS  18          3HB       LYS  18   8.683   9.942  -4.787
  129    HG2  LYS  18          2HG       LYS  18   7.234  11.971  -3.354
  130    HG3  LYS  18          3HG       LYS  18   8.834  12.552  -3.821
  131    HD2  LYS  18          2HD       LYS  18   8.423  12.202  -6.098
  132    HD3  LYS  18          3HD       LYS  18   7.059  11.129  -5.779
  133    HE2  LYS  18          2HE       LYS  18   5.977  13.208  -4.695
  134    HE3  LYS  18          3HE       LYS  18   7.201  14.117  -5.579
  135    HZ1  LYS  18          1HZ       LYS  18   6.356  13.377  -7.624
  136    HZ2  LYS  18          2HZ       LYS  18   4.993  13.809  -6.721
  137    HZ3  LYS  18          3HZ       LYS  18   5.402  12.178  -6.909
  138    H    THR  19           HN       THR  19   7.916   7.243  -3.883
  139    HA   THR  19           HA       THR  19   5.179   7.368  -4.974
  140    HB   THR  19           HB       THR  19   5.832   6.073  -6.853
  141    HG1  THR  19          1HG       THR  19   8.330   5.751  -5.519
  142   HG21  THR  19          1HG2      THR  19   8.283   7.650  -6.921
  143   HG22  THR  19          2HG2      THR  19   6.883   8.578  -6.384
  144   HG23  THR  19          3HG2      THR  19   6.848   7.749  -7.939
  145    H    ASN  20           HN       ASN  20   6.259   6.326  -2.367
  146    HA   ASN  20           HA       ASN  20   5.337   3.540  -2.644
  147    HB2  ASN  20          2HB       ASN  20   7.310   4.719  -0.677
  148    HB3  ASN  20          3HB       ASN  20   6.674   3.080  -0.575
  149   HD21  ASN  20          1HD2      ASN  20   9.130   2.837  -0.658
  150   HD22  ASN  20          2HD2      ASN  20   9.806   2.567  -2.225
  151    H    THR  21           HN       THR  21   3.910   6.163  -2.080
  152    HA   THR  21           HA       THR  21   2.845   5.612   0.594
  153    HB   THR  21           HB       THR  21   2.144   7.951  -1.180
  154    HG1  THR  21          1HG       THR  21   3.767   9.080  -0.045
  155   HG21  THR  21          1HG2      THR  21   1.873   7.409   1.775
  156   HG22  THR  21          2HG2      THR  21   0.578   7.657   0.605
  157   HG23  THR  21          3HG2      THR  21   1.637   8.996   1.045
  158    H    CYS  22           HN       CYS  22   1.478   3.892   0.323
  159    HA   CYS  22           HA       CYS  22  -0.148   3.152  -1.682
  160    HB2  CYS  22          2HB       CYS  22  -0.021   1.941   0.442
  161    HB3  CYS  22          3HB       CYS  22  -0.930   3.220   1.240
  162    H    ARG  23           HN       ARG  23  -1.889   3.874  -2.747
  163    HA   ARG  23           HA       ARG  23  -2.899   6.512  -2.102
  164    HB2  ARG  23          2HB       ARG  23  -4.212   5.086  -4.294
  165    HB3  ARG  23          3HB       ARG  23  -3.430   6.661  -4.284
  166    HG2  ARG  23          2HG       ARG  23  -1.233   5.270  -4.232
  167    HG3  ARG  23          3HG       ARG  23  -2.266   3.973  -4.838
  168    HD2  ARG  23          2HD       ARG  23  -2.906   5.303  -6.738
  169    HD3  ARG  23          3HD       ARG  23  -2.048   6.704  -6.097
  170    HE   ARG  23           HE       ARG  23  -0.926   4.515  -7.556
  171   HH11  ARG  23          1HH1      ARG  23  -0.266   6.932  -5.139
  172   HH12  ARG  23          2HH1      ARG  23   1.440   6.958  -5.443
  173   HH21  ARG  23          1HH2      ARG  23   1.318   4.541  -7.967
  174   HH22  ARG  23          2HH2      ARG  23   2.340   5.599  -7.053
  175    H    GLY  24           HN       GLY  24  -3.524   4.041  -0.466
  176    HA2  GLY  24          1HA       GLY  24  -6.467   4.274  -0.603
  177    HA3  GLY  24          2HA       GLY  24  -5.649   2.775  -0.187
  178    H    CYS  25           HN       CYS  25  -3.659   3.930   1.506
  179    HA   CYS  25           HA       CYS  25  -5.350   4.782   3.766
  180    HB2  CYS  25          2HB       CYS  25  -3.491   3.725   5.178
  181    HB3  CYS  25          3HB       CYS  25  -4.567   2.629   4.319
  182    H    ASN  26           HN       ASN  26  -2.780   5.605   1.726
  183    HA   ASN  26           HA       ASN  26  -1.534   7.516   1.590
  184    HB2  ASN  26          2HB       ASN  26  -2.322   8.583   4.236
  185    HB3  ASN  26          3HB       ASN  26  -2.248   9.390   2.672
  186   HD21  ASN  26          1HD2      ASN  26  -3.897   7.928   1.129
  187   HD22  ASN  26          2HD2      ASN  26  -5.512   7.985   1.742
  188    H    HIS  27           HN       HIS  27  -0.879   5.016   3.179
  189    HA   HIS  27           HA       HIS  27   1.229   6.117   4.908
  190    HB2  HIS  27          2HB       HIS  27   0.101   3.311   4.803
  191    HB3  HIS  27          3HB       HIS  27   1.338   3.877   5.921
  192    HD1  HIS  27          1HD       HIS  27   0.085   6.504   6.855
  193    HD2  HIS  27          2HD       HIS  27  -2.033   2.953   6.445
  194    HE1  HIS  27          1HE       HIS  27  -1.912   6.734   8.366
  195    H    LEU  28           HN       LEU  28   3.345   5.113   4.842
  196    HA   LEU  28           HA       LEU  28   4.246   4.725   2.153
  197    HB2  LEU  28          2HB       LEU  28   5.573   4.730   4.839
  198    HB3  LEU  28          3HB       LEU  28   6.456   4.234   3.397
  199    HG   LEU  28           HG       LEU  28   5.212   6.940   3.880
  200   HD11  LEU  28          1HD1      LEU  28   8.127   6.405   3.514
  201   HD12  LEU  28          2HD1      LEU  28   7.382   6.180   5.097
  202   HD13  LEU  28          3HD1      LEU  28   7.323   7.759   4.310
  203   HD21  LEU  28          1HD2      LEU  28   6.935   7.150   1.754
  204   HD22  LEU  28          2HD2      LEU  28   5.176   7.065   1.650
  205   HD23  LEU  28          3HD2      LEU  28   6.143   5.601   1.464
  206    H    VAL  29           HN       VAL  29   5.214   2.887   1.256
  207    HA   VAL  29           HA       VAL  29   5.171   0.386   2.720
  208    HB   VAL  29           HB       VAL  29   3.867  -0.111   0.204
  209   HG11  VAL  29          1HG1      VAL  29   2.805  -1.671   1.423
  210   HG12  VAL  29          2HG1      VAL  29   3.995  -1.256   2.660
  211   HG13  VAL  29          3HG1      VAL  29   2.385  -0.533   2.704
  212   HG21  VAL  29          1HG2      VAL  29   1.703   0.938   0.698
  213   HG22  VAL  29          2HG2      VAL  29   2.429   1.775   2.071
  214   HG23  VAL  29          3HG2      VAL  29   2.966   2.138   0.431
  215    H    CYS  30           HN       CYS  30   7.026  -0.573   2.248
  216    HA   CYS  30           HA       CYS  30   8.841   0.194   0.331
  217    HB2  CYS  30          2HB       CYS  30   9.922  -1.998   0.671
  218    HB3  CYS  30          3HB       CYS  30   9.439  -1.259   2.195
  219    H    ARG  31           HN       ARG  31   9.691  -1.631  -1.328
  220    HA   ARG  31           HA       ARG  31   7.597  -1.779  -3.325
  221    HB2  ARG  31          2HB       ARG  31  10.447  -2.734  -3.592
  222    HB3  ARG  31          3HB       ARG  31   9.328  -2.312  -4.882
  223    HG2  ARG  31          2HG       ARG  31   9.487  -0.012  -3.347
  224    HG3  ARG  31          3HG       ARG  31  11.138  -0.634  -3.378
  225    HD2  ARG  31          2HD       ARG  31   9.447  -0.314  -5.848
  226    HD3  ARG  31          3HD       ARG  31  10.518   0.950  -5.243
  227    HE   ARG  31           HE       ARG  31  11.956  -1.456  -5.509
  228   HH11  ARG  31          1HH1      ARG  31  10.472   1.033  -7.438
  229   HH12  ARG  31          2HH1      ARG  31  11.556   0.825  -8.774
  230   HH21  ARG  31          1HH2      ARG  31  13.389  -1.740  -7.262
  231   HH22  ARG  31          2HH2      ARG  31  13.213  -0.752  -8.673
  232    H    ASP  32           HN       ASP  32   7.816  -3.568  -0.843
  233    HA   ASP  32           HA       ASP  32   7.475  -6.112  -2.288
  234    HB2  ASP  32          2HB       ASP  32   9.576  -5.836  -0.765
  235    HB3  ASP  32          3HB       ASP  32   8.429  -6.044   0.555
  236    H    CYS  33           HN       CYS  33   6.103  -3.768  -0.329
  237    HA   CYS  33           HA       CYS  33   4.101  -5.625   0.758
  238    HB2  CYS  33          2HB       CYS  33   4.904  -2.826   1.544
  239    HB3  CYS  33          3HB       CYS  33   3.431  -3.584   2.141
  240    H    ARG  34           HN       ARG  34   4.546  -3.868  -1.920
  241    HA   ARG  34           HA       ARG  34   1.832  -2.784  -2.066
  242    HB2  ARG  34          2HB       ARG  34   3.570  -2.514  -4.422
  243    HB3  ARG  34          3HB       ARG  34   2.605  -1.304  -3.587
  244    HG2  ARG  34          2HG       ARG  34   4.337  -1.156  -1.845
  245    HG3  ARG  34          3HG       ARG  34   5.313  -2.316  -2.749
  246    HD2  ARG  34          2HD       ARG  34   4.330   0.232  -3.995
  247    HD3  ARG  34          3HD       ARG  34   5.820   0.178  -3.053
  248    HE   ARG  34           HE       ARG  34   6.065  -1.847  -4.878
  249   HH11  ARG  34          1HH1      ARG  34   5.507   1.585  -5.037
  250   HH12  ARG  34          2HH1      ARG  34   6.294   1.774  -6.569
  251   HH21  ARG  34          1HH2      ARG  34   7.103  -1.612  -6.895
  252   HH22  ARG  34          2HH2      ARG  34   7.201  -0.045  -7.625
  253    H    ILE  35           HN       ILE  35   0.255  -3.672  -3.265
  254    HA   ILE  35           HA       ILE  35   0.918  -6.114  -4.763
  255    HB   ILE  35           HB       ILE  35  -1.575  -5.226  -3.349
  256   HG12  ILE  35          2HG1      ILE  35  -1.399  -7.461  -2.336
  257   HG13  ILE  35          3HG1      ILE  35   0.006  -7.808  -3.338
  258   HG21  ILE  35          1HG2      ILE  35  -1.358  -7.292  -5.527
  259   HG22  ILE  35          2HG2      ILE  35  -2.685  -7.240  -4.367
  260   HG23  ILE  35          3HG2      ILE  35  -2.422  -5.887  -5.466
  261   HD11  ILE  35          1HD1      ILE  35   1.317  -6.200  -2.195
  262   HD12  ILE  35          2HD1      ILE  35  -0.093  -5.552  -1.357
  263   HD13  ILE  35          3HD1      ILE  35   0.497  -7.169  -0.972
  264    H    GLN  36           HN       GLN  36   0.780  -6.091  -6.904
  265    HA   GLN  36           HA       GLN  36   0.093  -3.797  -8.371
  266    HB2  GLN  36          2HB       GLN  36   0.475  -6.675  -9.175
  267    HB3  GLN  36          3HB       GLN  36   0.112  -5.414 -10.345
  268    HG2  GLN  36          2HG       GLN  36   2.569  -6.107  -9.911
  269    HG3  GLN  36          3HG       GLN  36   2.157  -4.403 -10.101
  270   HE21  GLN  36          1HE2      GLN  36   2.034  -3.091  -8.223
  271   HE22  GLN  36          2HE2      GLN  36   2.898  -3.518  -6.790
  272    H    GLU  37           HN       GLU  37  -1.823  -2.992  -8.886
  273    HA   GLU  37           HA       GLU  37  -4.183  -4.726  -8.678
  274    HB2  GLU  37          2HB       GLU  37  -3.958  -1.712  -8.675
  275    HB3  GLU  37          3HB       GLU  37  -5.467  -2.607  -8.557
  276    HG2  GLU  37          2HG       GLU  37  -3.436  -3.357  -6.582
  277    HG3  GLU  37          3HG       GLU  37  -4.032  -1.704  -6.447
  278    H    SER  38           HN       SER  38  -5.934  -4.381 -10.243
  279    HA   SER  38           HA       SER  38  -4.830  -4.101 -12.935
  280    HB2  SER  38          2HB       SER  38  -7.172  -5.512 -11.752
  281    HB3  SER  38          3HB       SER  38  -7.308  -4.967 -13.424
  282    HG   SER  38           HG       SER  38  -5.582  -6.227 -13.974
  283    H    ASN  39           HN       ASN  39  -4.708  -1.779 -12.842
  284    HA   ASN  39           HA       ASN  39  -6.931  -0.506 -14.024
  285    HB2  ASN  39          2HB       ASN  39  -6.799  -0.430 -11.117
  286    HB3  ASN  39          3HB       ASN  39  -6.770   1.185 -11.818
  287   HD21  ASN  39          1HD2      ASN  39  -8.863   0.468 -10.281
  288   HD22  ASN  39          2HD2      ASN  39 -10.278   0.250 -11.248
  289    H    GLY  40           HN       GLY  40  -3.892  -0.223 -12.289
  290    HA2  GLY  40          1HA       GLY  40  -2.189   0.859 -13.883
  291    HA3  GLY  40          2HA       GLY  40  -3.278   2.235 -13.791
  292    H    THR  41           HN       THR  41  -3.444   0.818 -10.849
  293    HA   THR  41           HA       THR  41  -1.175   2.368  -9.784
  294    HB   THR  41           HB       THR  41  -3.390   3.501  -9.414
  295    HG1  THR  41          1HG       THR  41  -2.881   3.282  -6.883
  296   HG21  THR  41          1HG2      THR  41  -3.867   1.050  -7.717
  297   HG22  THR  41          2HG2      THR  41  -4.834   1.614  -9.080
  298   HG23  THR  41          3HG2      THR  41  -4.798   2.541  -7.581
  299    H    TRP  42           HN       TRP  42  -1.767   1.687  -7.063
  300    HA   TRP  42           HA       TRP  42  -1.754  -1.197  -6.879
  301    HB2  TRP  42          2HB       TRP  42   0.463  -1.312  -5.789
  302    HB3  TRP  42          3HB       TRP  42   0.572  -0.794  -7.469
  303    HD1  TRP  42          1HD       TRP  42   1.503   1.628  -7.946
  304    HE1  TRP  42          1HE       TRP  42   2.648   3.395  -6.467
  305    HE3  TRP  42          3HE       TRP  42   0.450  -0.355  -3.353
  306    HZ2  TRP  42          2HZ       TRP  42   3.052   3.883  -3.717
  307    HZ3  TRP  42          3HZ       TRP  42   1.253   0.823  -1.349
  308    HH2  TRP  42          2HH       TRP  42   2.527   2.898  -1.528
  309    H    ARG  43           HN       ARG  43  -1.631  -1.939  -4.614
  310    HA   ARG  43           HA       ARG  43  -2.155   0.103  -2.599
  311    HB2  ARG  43          2HB       ARG  43  -4.126  -1.982  -3.488
  312    HB3  ARG  43          3HB       ARG  43  -4.151  -1.371  -1.839
  313    HG2  ARG  43          2HG       ARG  43  -4.079   0.693  -3.924
  314    HG3  ARG  43          3HG       ARG  43  -5.539  -0.298  -3.891
  315    HD2  ARG  43          2HD       ARG  43  -4.850   0.409  -1.218
  316    HD3  ARG  43          3HD       ARG  43  -4.842   1.868  -2.207
  317    HE   ARG  43           HE       ARG  43  -7.118   0.467  -1.324
  318   HH11  ARG  43          1HH1      ARG  43  -5.856   2.062  -4.150
  319   HH12  ARG  43          2HH1      ARG  43  -7.419   2.486  -4.768
  320   HH21  ARG  43          1HH2      ARG  43  -9.180   1.020  -2.127
  321   HH22  ARG  43          2HH2      ARG  43  -9.308   1.893  -3.616
  322    H    CYS  44           HN       CYS  44  -1.423  -0.442  -0.615
  323    HA   CYS  44           HA       CYS  44   0.446  -2.394  -0.211
  324    HB2  CYS  44          2HB       CYS  44   0.189  -2.034   2.161
  325    HB3  CYS  44          3HB       CYS  44  -0.039  -0.495   1.335
  326    H    LYS  45           HN       LYS  45   0.290  -4.254   1.394
  327    HA   LYS  45           HA       LYS  45  -1.524  -6.181   0.355
  328    HB2  LYS  45          2HB       LYS  45  -0.175  -6.749   2.927
  329    HB3  LYS  45          3HB       LYS  45  -0.267  -7.721   1.465
  330    HG2  LYS  45          2HG       LYS  45   1.333  -5.949   0.472
  331    HG3  LYS  45          3HG       LYS  45   1.643  -5.532   2.159
  332    HD2  LYS  45          2HD       LYS  45   3.275  -7.105   1.822
  333    HD3  LYS  45          3HD       LYS  45   1.961  -8.137   2.394
  334    HE2  LYS  45          2HE       LYS  45   1.402  -8.771   0.151
  335    HE3  LYS  45          3HE       LYS  45   2.537  -7.598  -0.515
  336    HZ1  LYS  45          1HZ       LYS  45   3.345  -9.936  -0.490
  337    HZ2  LYS  45          2HZ       LYS  45   3.356  -9.874   1.200
  338    HZ3  LYS  45          3HZ       LYS  45   4.361  -8.845   0.309
  339    H    VAL  46           HN       VAL  46  -1.917  -3.783   2.649
  340    HA   VAL  46           HA       VAL  46  -3.872  -5.265   4.236
  341    HB   VAL  46           HB       VAL  46  -3.159  -2.360   4.575
  342   HG11  VAL  46          1HG1      VAL  46  -4.332  -2.442   6.491
  343   HG12  VAL  46          2HG1      VAL  46  -5.104  -3.845   5.746
  344   HG13  VAL  46          3HG1      VAL  46  -3.774  -4.068   6.883
  345   HG21  VAL  46          1HG2      VAL  46  -1.114  -3.807   4.576
  346   HG22  VAL  46          2HG2      VAL  46  -1.411  -2.952   6.089
  347   HG23  VAL  46          3HG2      VAL  46  -1.798  -4.666   5.956
  348    H    CYS  47           HN       CYS  47  -3.705  -3.083   1.596
  349    HA   CYS  47           HA       CYS  47  -6.557  -2.421   1.848
  350    HB2  CYS  47          2HB       CYS  47  -4.328  -1.187   0.230
  351    HB3  CYS  47          3HB       CYS  47  -6.022  -0.781  -0.023
  352    H    ALA  48           HN       ALA  48  -4.175  -3.872  -0.302
  353    HA   ALA  48           HA       ALA  48  -6.010  -4.368  -2.434
  354    HB1  ALA  48          1HB       ALA  48  -3.372  -5.729  -1.914
  355    HB2  ALA  48          2HB       ALA  48  -4.239  -5.629  -3.448
  356    HB3  ALA  48          3HB       ALA  48  -3.549  -4.174  -2.729
  357    H    LYS  49           HN       LYS  49  -4.992  -6.108   0.418
  358    HA   LYS  49           HA       LYS  49  -6.440  -8.504  -0.431
  359    HB2  LYS  49          2HB       LYS  49  -4.149  -8.664   0.596
  360    HB3  LYS  49          3HB       LYS  49  -4.847  -8.080   2.102
  361    HG2  LYS  49          2HG       LYS  49  -5.403 -10.148   2.643
  362    HG3  LYS  49          3HG       LYS  49  -6.430 -10.251   1.211
  363    HD2  LYS  49          2HD       LYS  49  -3.511 -10.596   0.818
  364    HD3  LYS  49          3HD       LYS  49  -4.375 -11.901   1.633
  365    HE2  LYS  49          2HE       LYS  49  -6.057 -11.536  -0.384
  366    HE3  LYS  49          3HE       LYS  49  -4.601 -10.914  -1.161
  367    HZ1  LYS  49          1HZ       LYS  49  -3.670 -13.170  -0.114
  368    HZ2  LYS  49          2HZ       LYS  49  -4.321 -13.073  -1.673
  369    HZ3  LYS  49          3HZ       LYS  49  -5.274 -13.632  -0.391
  370    H    GLU  50           HN       GLU  50  -8.508  -8.719   0.083
  371    HA   GLU  50           HA       GLU  50 -10.039  -6.997   1.567
  372    HB2  GLU  50          2HB       GLU  50 -11.708  -8.801   1.720
  373    HB3  GLU  50          3HB       GLU  50 -11.015  -8.680   0.108
  374    HG2  GLU  50          2HG       GLU  50  -9.367 -10.506   1.224
  375    HG3  GLU  50          3HG       GLU  50 -10.873 -10.857   2.071
  376    H    ILE  51           HN       ILE  51  -9.670  -6.368   3.592
  377    HA   ILE  51           HA       ILE  51  -8.267  -7.713   5.557
  378    HB   ILE  51           HB       ILE  51  -8.865  -5.318   5.673
  379   HG12  ILE  51          2HG1      ILE  51  -9.982  -6.519   8.170
  380   HG13  ILE  51          3HG1      ILE  51  -8.336  -6.933   7.704
  381   HG21  ILE  51          1HG2      ILE  51 -10.965  -4.595   5.600
  382   HG22  ILE  51          2HG2      ILE  51 -11.467  -6.261   5.321
  383   HG23  ILE  51          3HG2      ILE  51 -11.422  -5.617   6.962
  384   HD11  ILE  51          1HD1      ILE  51  -8.116  -5.124   9.156
  385   HD12  ILE  51          2HD1      ILE  51  -7.935  -4.423   7.548
  386   HD13  ILE  51          3HD1      ILE  51  -9.459  -4.252   8.418
  387    H    GLU  52           HN       GLU  52  -8.778  -9.081   7.223
  388    HA   GLU  52           HA       GLU  52 -11.218 -10.622   6.886
  389    HB2  GLU  52          2HB       GLU  52  -9.759 -12.244   7.387
  390    HB3  GLU  52          3HB       GLU  52  -8.571 -11.090   7.977
  391    HG2  GLU  52          2HG       GLU  52  -9.565 -11.078  10.152
  392    HG3  GLU  52          3HG       GLU  52 -10.917 -12.059   9.588
  393    H    LEU  53           HN       LEU  53  -9.633  -8.672   9.383
  394    HA   LEU  53           HA       LEU  53 -11.474  -9.062  11.442
  395    HB2  LEU  53          2HB       LEU  53  -9.179  -7.593  11.085
  396    HB3  LEU  53          3HB       LEU  53 -10.409  -6.348  11.293
  397    HG   LEU  53           HG       LEU  53  -9.458  -6.755  13.425
  398   HD11  LEU  53          1HD1      LEU  53 -12.129  -8.104  13.114
  399   HD12  LEU  53          2HD1      LEU  53 -11.801  -6.435  13.580
  400   HD13  LEU  53          3HD1      LEU  53 -11.394  -7.753  14.678
  401   HD21  LEU  53          1HD2      LEU  53  -8.779  -8.747  14.233
  402   HD22  LEU  53          2HD2      LEU  53  -8.810  -9.213  12.531
  403   HD23  LEU  53          3HD2      LEU  53 -10.171  -9.610  13.581
  Start of MODEL   13
    1    H1   SER   1           HN       SER   1   9.454   9.829  12.592
    2    HA   SER   1           HA       SER   1   7.803   9.830  10.402
    3    HB2  SER   1          2HB       SER   1   8.524  12.680  11.120
    4    HB3  SER   1          3HB       SER   1   7.607  12.144   9.712
    5    HG   SER   1           HG       SER   1   6.099  12.757  11.169
    6    H    ASP   2           HN       ASP   2   9.794   8.527  10.153
    7    HA   ASP   2           HA       ASP   2  12.002  10.142   9.057
    8    HB2  ASP   2          2HB       ASP   2  11.977   7.664  10.702
    9    HB3  ASP   2          3HB       ASP   2  13.218   7.793   9.459
   10    H    ARG   3           HN       ARG   3   9.427   8.394   8.139
   11    HA   ARG   3           HA       ARG   3   8.813   7.691   6.037
   12    HB2  ARG   3          2HB       ARG   3  11.684   7.603   5.163
   13    HB3  ARG   3          3HB       ARG   3  10.241   7.874   4.194
   14    HG2  ARG   3          2HG       ARG   3  10.317   9.972   6.045
   15    HG3  ARG   3          3HG       ARG   3  11.971   9.777   5.458
   16    HD2  ARG   3          2HD       ARG   3  10.830   9.664   3.119
   17    HD3  ARG   3          3HD       ARG   3   9.484  10.450   3.943
   18    HE   ARG   3           HE       ARG   3  11.911  11.665   3.125
   19   HH11  ARG   3          1HH1      ARG   3   9.530  11.695   5.664
   20   HH12  ARG   3          2HH1      ARG   3   9.820  13.348   6.095
   21   HH21  ARG   3          1HH2      ARG   3  12.303  13.841   3.684
   22   HH22  ARG   3          2HH2      ARG   3  11.397  14.568   4.968
   23    H    THR   4           HN       THR   4   8.411   5.804   7.460
   24    HA   THR   4           HA       THR   4  10.077   3.521   6.625
   25    HB   THR   4           HB       THR   4   8.689   3.034   9.126
   26    HG1  THR   4          1HG       THR   4  10.719   5.030   9.201
   27   HG21  THR   4          1HG2      THR   4  10.424   1.571   8.449
   28   HG22  THR   4          2HG2      THR   4  11.070   2.480   9.816
   29   HG23  THR   4          3HG2      THR   4  11.542   2.904   8.171
   30    H    CYS   5           HN       CYS   5   9.016   1.611   6.135
   31    HA   CYS   5           HA       CYS   5   6.554   1.717   4.924
   32    HB2  CYS   5          2HB       CYS   5   8.273  -0.130   4.756
   33    HB3  CYS   5          3HB       CYS   5   7.641  -0.755   6.276
   34    H    ALA   6           HN       ALA   6   4.461   1.483   5.518
   35    HA   ALA   6           HA       ALA   6   3.877   1.615   8.365
   36    HB1  ALA   6          1HB       ALA   6   2.685   2.654   6.004
   37    HB2  ALA   6          2HB       ALA   6   1.497   1.645   6.828
   38    HB3  ALA   6          3HB       ALA   6   2.267   2.979   7.686
   39    H    ARG   7           HN       ARG   7   4.722  -0.899   6.884
   40    HA   ARG   7           HA       ARG   7   2.552  -2.590   7.916
   41    HB2  ARG   7          2HB       ARG   7   4.053  -3.322   5.414
   42    HB3  ARG   7          3HB       ARG   7   2.548  -3.995   6.027
   43    HG2  ARG   7          2HG       ARG   7   2.861  -1.185   4.993
   44    HG3  ARG   7          3HG       ARG   7   2.263  -2.546   4.042
   45    HD2  ARG   7          2HD       ARG   7   0.273  -2.629   5.158
   46    HD3  ARG   7          3HD       ARG   7   0.964  -2.005   6.655
   47    HE   ARG   7           HE       ARG   7   0.833  -0.107   4.478
   48   HH11  ARG   7          1HH1      ARG   7  -0.745  -1.434   7.283
   49   HH12  ARG   7          2HH1      ARG   7  -1.754  -0.047   7.533
   50   HH21  ARG   7          1HH2      ARG   7  -0.490   1.724   4.796
   51   HH22  ARG   7          2HH2      ARG   7  -1.609   1.747   6.117
   52    H    CYS   8           HN       CYS   8   5.911  -2.540   6.746
   53    HA   CYS   8           HA       CYS   8   6.538  -4.721   8.613
   54    HB2  CYS   8          2HB       CYS   8   8.634  -4.960   7.292
   55    HB3  CYS   8          3HB       CYS   8   7.179  -5.201   6.329
   56    H    GLN   9           HN       GLN   9   7.060  -1.377   7.974
   57    HA   GLN   9           HA       GLN   9   8.004   0.251   9.269
   58    HB2  GLN   9          2HB       GLN   9   7.565  -1.791  11.090
   59    HB3  GLN   9          3HB       GLN   9   9.275  -1.429  11.283
   60    HG2  GLN   9          2HG       GLN   9   7.491   0.905  11.175
   61    HG3  GLN   9          3HG       GLN   9   7.296  -0.145  12.578
   62   HE21  GLN   9          1HE2      GLN   9   9.162   2.273  11.104
   63   HE22  GLN   9          2HE2      GLN   9  10.423   2.355  12.282
   64    H    GLU  10           HN       GLU  10   9.355  -0.676   7.093
   65    HA   GLU  10           HA       GLU  10  12.151  -0.912   7.972
   66    HB2  GLU  10          2HB       GLU  10  10.631  -1.982   5.700
   67    HB3  GLU  10          3HB       GLU  10  12.196  -1.312   5.262
   68    HG2  GLU  10          2HG       GLU  10  12.297  -3.022   7.616
   69    HG3  GLU  10          3HG       GLU  10  11.729  -3.853   6.169
   70    H    SER  11           HN       SER  11  13.771   0.343   6.883
   71    HA   SER  11           HA       SER  11  13.083   3.065   6.620
   72    HB2  SER  11          2HB       SER  11  15.310   2.401   7.338
   73    HB3  SER  11          3HB       SER  11  15.600   1.600   5.794
   74    HG   SER  11           HG       SER  11  16.286   3.455   5.116
   75    H    LEU  12           HN       LEU  12  12.781   4.367   4.867
   76    HA   LEU  12           HA       LEU  12  12.320   2.993   2.318
   77    HB2  LEU  12          2HB       LEU  12  11.298   5.538   3.521
   78    HB3  LEU  12          3HB       LEU  12  11.205   5.267   1.782
   79    HG   LEU  12           HG       LEU  12   9.173   4.719   3.337
   80   HD11  LEU  12          1HD1      LEU  12   8.607   2.802   1.780
   81   HD12  LEU  12          2HD1      LEU  12  10.206   3.035   1.073
   82   HD13  LEU  12          3HD1      LEU  12   9.021   4.339   1.018
   83   HD21  LEU  12          1HD2      LEU  12   9.117   2.601   4.311
   84   HD22  LEU  12          2HD2      LEU  12  10.708   3.222   4.749
   85   HD23  LEU  12          3HD2      LEU  12  10.547   2.056   3.435
   86    H    GLY  13           HN       GLY  13  14.836   4.399   3.690
   87    HA2  GLY  13          1HA       GLY  13  15.857   6.490   2.388
   88    HA3  GLY  13          2HA       GLY  13  16.827   5.053   2.672
   89    H    ARG  14           HN       ARG  14  17.147   3.566   0.995
   90    HA   ARG  14           HA       ARG  14  17.117   4.736  -1.622
   91    HB2  ARG  14          2HB       ARG  14  18.923   3.219  -0.683
   92    HB3  ARG  14          3HB       ARG  14  17.807   1.883  -0.928
   93    HG2  ARG  14          2HG       ARG  14  18.009   1.945  -3.198
   94    HG3  ARG  14          3HG       ARG  14  18.370   3.672  -3.229
   95    HD2  ARG  14          2HD       ARG  14  20.562   3.287  -3.195
   96    HD3  ARG  14          3HD       ARG  14  20.410   2.214  -1.803
   97    HE   ARG  14           HE       ARG  14  19.560   0.880  -4.138
   98   HH11  ARG  14          1HH1      ARG  14  22.443   2.043  -2.571
   99   HH12  ARG  14          2HH1      ARG  14  23.473   0.852  -3.293
  100   HH21  ARG  14          1HH2      ARG  14  20.905  -0.694  -5.095
  101   HH22  ARG  14          2HH2      ARG  14  22.597  -0.704  -4.729
  102    H    LEU  15           HN       LEU  15  14.534   4.674  -0.921
  103    HA   LEU  15           HA       LEU  15  13.429   2.689  -2.763
  104    HB2  LEU  15          2HB       LEU  15  13.110   2.610   0.058
  105    HB3  LEU  15          3HB       LEU  15  11.559   3.056  -0.652
  106    HG   LEU  15           HG       LEU  15  13.160   0.559  -1.202
  107   HD11  LEU  15          1HD1      LEU  15  10.561  -0.060  -0.443
  108   HD12  LEU  15          2HD1      LEU  15  11.044   1.244   0.642
  109   HD13  LEU  15          3HD1      LEU  15  12.018  -0.222   0.536
  110   HD21  LEU  15          1HD2      LEU  15  11.969   0.165  -3.047
  111   HD22  LEU  15          2HD2      LEU  15  11.570   1.883  -3.016
  112   HD23  LEU  15          3HD2      LEU  15  10.468   0.707  -2.298
  113    H    SER  16           HN       SER  16  13.907   5.755  -2.335
  114    HA   SER  16           HA       SER  16  12.800   7.729  -2.720
  115    HB2  SER  16          2HB       SER  16  12.291   5.844  -4.890
  116    HB3  SER  16          3HB       SER  16  11.059   7.100  -4.784
  117    HG   SER  16           HG       SER  16  12.637   8.649  -5.004
  118    HA   PRO  17           HA       PRO  17   9.040   6.642  -0.281
  119    HB2  PRO  17          2HB       PRO  17   9.378   8.636   1.530
  120    HB3  PRO  17          3HB       PRO  17  10.163   7.060   1.680
  121    HG2  PRO  17          2HG       PRO  17  11.276   9.640   0.646
  122    HG3  PRO  17          3HG       PRO  17  12.029   8.446   1.721
  123    HD2  PRO  17          2HD       PRO  17  12.592   8.583  -0.923
  124    HD3  PRO  17          3HD       PRO  17  12.608   7.054  -0.021
  125    H    LYS  18           HN       LYS  18   8.390   7.611  -2.559
  126    HA   LYS  18           HA       LYS  18   6.880  10.051  -1.971
  127    HB2  LYS  18          2HB       LYS  18   8.783  10.865  -3.195
  128    HB3  LYS  18          3HB       LYS  18   8.606   9.604  -4.408
  129    HG2  LYS  18          2HG       LYS  18   7.066  10.750  -5.550
  130    HG3  LYS  18          3HG       LYS  18   6.234  11.282  -4.087
  131    HD2  LYS  18          2HD       LYS  18   8.332  12.813  -3.800
  132    HD3  LYS  18          3HD       LYS  18   8.528  12.539  -5.532
  133    HE2  LYS  18          2HE       LYS  18   7.062  14.175  -5.878
  134    HE3  LYS  18          3HE       LYS  18   5.823  13.131  -5.184
  135    HZ1  LYS  18          1HZ       LYS  18   7.276  14.319  -3.098
  136    HZ2  LYS  18          2HZ       LYS  18   5.641  14.518  -3.486
  137    HZ3  LYS  18          3HZ       LYS  18   6.803  15.539  -4.173
  138    H    THR  19           HN       THR  19   7.419   7.492  -4.386
  139    HA   THR  19           HA       THR  19   4.580   7.574  -5.089
  140    HB   THR  19           HB       THR  19   5.125   6.757  -7.119
  141    HG1  THR  19          1HG       THR  19   6.223   4.911  -7.369
  142   HG21  THR  19          1HG2      THR  19   8.030   7.101  -6.615
  143   HG22  THR  19          2HG2      THR  19   6.988   8.495  -6.331
  144   HG23  THR  19          3HG2      THR  19   7.025   7.731  -7.919
  145    H    ASN  20           HN       ASN  20   6.376   6.109  -2.806
  146    HA   ASN  20           HA       ASN  20   5.082   3.493  -3.011
  147    HB2  ASN  20          2HB       ASN  20   7.346   4.563  -1.342
  148    HB3  ASN  20          3HB       ASN  20   6.554   3.044  -0.936
  149   HD21  ASN  20          1HD2      ASN  20   9.292   3.520  -1.749
  150   HD22  ASN  20          2HD2      ASN  20   9.547   2.582  -3.178
  151    H    THR  21           HN       THR  21   3.579   5.916  -2.371
  152    HA   THR  21           HA       THR  21   2.788   5.359   0.408
  153    HB   THR  21           HB       THR  21   2.086   7.793  -1.242
  154    HG1  THR  21          1HG       THR  21   4.337   7.705  -0.803
  155   HG21  THR  21          1HG2      THR  21   0.977   6.804   1.116
  156   HG22  THR  21          2HG2      THR  21   0.802   8.435   0.468
  157   HG23  THR  21          3HG2      THR  21   2.075   8.082   1.637
  158    H    CYS  22           HN       CYS  22   1.113   4.025   0.562
  159    HA   CYS  22           HA       CYS  22  -0.599   3.241  -1.459
  160    HB2  CYS  22          2HB       CYS  22  -0.327   2.084   0.728
  161    HB3  CYS  22          3HB       CYS  22  -1.269   3.362   1.488
  162    H    ARG  23           HN       ARG  23  -2.317   4.100  -2.439
  163    HA   ARG  23           HA       ARG  23  -3.138   6.775  -1.761
  164    HB2  ARG  23          2HB       ARG  23  -4.741   5.320  -3.749
  165    HB3  ARG  23          3HB       ARG  23  -3.939   6.881  -3.869
  166    HG2  ARG  23          2HG       ARG  23  -1.795   5.265  -3.897
  167    HG3  ARG  23          3HG       ARG  23  -2.995   4.199  -4.632
  168    HD2  ARG  23          2HD       ARG  23  -1.780   6.685  -5.654
  169    HD3  ARG  23          3HD       ARG  23  -2.326   5.250  -6.520
  170    HE   ARG  23           HE       ARG  23  -3.807   7.641  -6.064
  171   HH11  ARG  23          1HH1      ARG  23  -4.108   4.192  -6.428
  172   HH12  ARG  23          2HH1      ARG  23  -5.741   4.264  -7.005
  173   HH21  ARG  23          1HH2      ARG  23  -5.957   7.749  -6.821
  174   HH22  ARG  23          2HH2      ARG  23  -6.791   6.288  -7.229
  175    H    GLY  24           HN       GLY  24  -4.083   3.681  -0.815
  176    HA2  GLY  24          1HA       GLY  24  -6.844   4.499  -0.250
  177    HA3  GLY  24          2HA       GLY  24  -6.218   2.860  -0.157
  178    H    CYS  25           HN       CYS  25  -3.832   4.339   1.280
  179    HA   CYS  25           HA       CYS  25  -5.141   4.459   3.918
  180    HB2  CYS  25          2HB       CYS  25  -2.491   3.204   3.184
  181    HB3  CYS  25          3HB       CYS  25  -2.993   3.519   4.842
  182    H    ASN  26           HN       ASN  26  -2.638   5.670   1.791
  183    HA   ASN  26           HA       ASN  26  -1.712   7.769   1.700
  184    HB2  ASN  26          2HB       ASN  26  -2.706   8.543   4.405
  185    HB3  ASN  26          3HB       ASN  26  -2.565   9.512   2.941
  186   HD21  ASN  26          1HD2      ASN  26  -3.933   7.902   1.155
  187   HD22  ASN  26          2HD2      ASN  26  -5.600   7.857   1.603
  188    H    HIS  27           HN       HIS  27  -0.705   5.320   3.134
  189    HA   HIS  27           HA       HIS  27   1.346   6.651   4.780
  190    HB2  HIS  27          2HB       HIS  27   0.122   3.904   5.052
  191    HB3  HIS  27          3HB       HIS  27   1.605   4.376   5.878
  192    HD1  HIS  27          1HD       HIS  27   1.302   6.549   7.511
  193    HD2  HIS  27          2HD       HIS  27  -2.142   4.496   6.421
  194    HE1  HIS  27          1HE       HIS  27  -0.448   7.234   9.183
  195    H    LEU  28           HN       LEU  28   3.468   5.538   4.794
  196    HA   LEU  28           HA       LEU  28   4.305   5.012   2.102
  197    HB2  LEU  28          2HB       LEU  28   5.687   5.160   4.754
  198    HB3  LEU  28          3HB       LEU  28   6.534   4.547   3.335
  199    HG   LEU  28           HG       LEU  28   5.359   7.307   3.659
  200   HD11  LEU  28          1HD1      LEU  28   7.401   8.050   4.226
  201   HD12  LEU  28          2HD1      LEU  28   8.225   6.926   3.147
  202   HD13  LEU  28          3HD1      LEU  28   7.666   6.380   4.728
  203   HD21  LEU  28          1HD2      LEU  28   5.397   7.473   1.449
  204   HD22  LEU  28          2HD2      LEU  28   5.961   5.808   1.310
  205   HD23  LEU  28          3HD2      LEU  28   7.125   7.125   1.462
  206    H    VAL  29           HN       VAL  29   5.208   3.117   1.275
  207    HA   VAL  29           HA       VAL  29   5.226   0.700   2.861
  208    HB   VAL  29           HB       VAL  29   3.751   0.015   0.514
  209   HG11  VAL  29          1HG1      VAL  29   2.679   0.003   3.314
  210   HG12  VAL  29          2HG1      VAL  29   2.406  -1.159   2.014
  211   HG13  VAL  29          3HG1      VAL  29   3.971  -1.094   2.826
  212   HG21  VAL  29          1HG2      VAL  29   3.000   2.390   0.637
  213   HG22  VAL  29          2HG2      VAL  29   1.699   1.213   0.819
  214   HG23  VAL  29          3HG2      VAL  29   2.337   2.046   2.236
  215    H    CYS  30           HN       CYS  30   7.054  -0.271   2.316
  216    HA   CYS  30           HA       CYS  30   8.699   0.365   0.200
  217    HB2  CYS  30          2HB       CYS  30   9.917  -1.661   0.677
  218    HB3  CYS  30          3HB       CYS  30   9.345  -0.985   2.198
  219    H    ARG  31           HN       ARG  31   9.431  -1.432  -1.455
  220    HA   ARG  31           HA       ARG  31   7.155  -1.837  -3.193
  221    HB2  ARG  31          2HB       ARG  31   8.800  -2.497  -4.866
  222    HB3  ARG  31          3HB       ARG  31   9.277  -0.989  -4.097
  223    HG2  ARG  31          2HG       ARG  31  10.904  -2.142  -2.742
  224    HG3  ARG  31          3HG       ARG  31  10.370  -3.700  -3.377
  225    HD2  ARG  31          2HD       ARG  31  11.214  -3.227  -5.526
  226    HD3  ARG  31          3HD       ARG  31  11.403  -1.513  -5.159
  227    HE   ARG  31           HE       ARG  31  13.067  -2.654  -3.391
  228   HH11  ARG  31          1HH1      ARG  31  12.649  -3.096  -6.818
  229   HH12  ARG  31          2HH1      ARG  31  14.307  -3.510  -7.100
  230   HH21  ARG  31          1HH2      ARG  31  15.254  -3.199  -3.748
  231   HH22  ARG  31          2HH2      ARG  31  15.787  -3.570  -5.353
  232    H    ASP  32           HN       ASP  32   7.576  -3.438  -0.676
  233    HA   ASP  32           HA       ASP  32   7.376  -6.098  -1.927
  234    HB2  ASP  32          2HB       ASP  32   9.504  -5.762  -0.620
  235    HB3  ASP  32          3HB       ASP  32   8.512  -5.568   0.823
  236    H    CYS  33           HN       CYS  33   5.902  -3.713  -0.084
  237    HA   CYS  33           HA       CYS  33   4.009  -5.631   1.102
  238    HB2  CYS  33          2HB       CYS  33   4.768  -2.819   1.885
  239    HB3  CYS  33          3HB       CYS  33   3.326  -3.612   2.512
  240    H    ARG  34           HN       ARG  34   4.258  -4.152  -1.653
  241    HA   ARG  34           HA       ARG  34   1.550  -3.012  -1.699
  242    HB2  ARG  34          2HB       ARG  34   2.997  -2.692  -4.173
  243    HB3  ARG  34          3HB       ARG  34   2.339  -1.464  -3.102
  244    HG2  ARG  34          2HG       ARG  34   4.353  -1.527  -1.751
  245    HG3  ARG  34          3HG       ARG  34   5.010  -2.812  -2.768
  246    HD2  ARG  34          2HD       ARG  34   4.180  -0.173  -3.926
  247    HD3  ARG  34          3HD       ARG  34   5.773  -0.394  -3.203
  248    HE   ARG  34           HE       ARG  34   5.195  -2.419  -5.120
  249   HH11  ARG  34          1HH1      ARG  34   6.210   0.893  -4.777
  250   HH12  ARG  34          2HH1      ARG  34   7.066   0.923  -6.283
  251   HH21  ARG  34          1HH2      ARG  34   6.319  -2.392  -7.104
  252   HH22  ARG  34          2HH2      ARG  34   7.127  -0.947  -7.607
  253    H    ILE  35           HN       ILE  35   0.013  -3.730  -3.157
  254    HA   ILE  35           HA       ILE  35   0.627  -6.300  -4.461
  255    HB   ILE  35           HB       ILE  35  -1.779  -5.339  -2.996
  256   HG12  ILE  35          2HG1      ILE  35  -1.793  -7.845  -2.440
  257   HG13  ILE  35          3HG1      ILE  35  -0.230  -7.913  -3.246
  258   HG21  ILE  35          1HG2      ILE  35  -1.838  -6.872  -5.534
  259   HG22  ILE  35          2HG2      ILE  35  -2.917  -7.388  -4.240
  260   HG23  ILE  35          3HG2      ILE  35  -3.014  -5.741  -4.864
  261   HD11  ILE  35          1HD1      ILE  35  -0.524  -5.832  -1.187
  262   HD12  ILE  35          2HD1      ILE  35  -0.533  -7.503  -0.621
  263   HD13  ILE  35          3HD1      ILE  35   0.835  -6.894  -1.551
  264    H    GLN  36           HN       GLN  36   1.182  -5.601  -6.487
  265    HA   GLN  36           HA       GLN  36   0.263  -3.566  -8.006
  266    HB2  GLN  36          2HB       GLN  36   0.486  -6.223  -9.351
  267    HB3  GLN  36          3HB       GLN  36   1.100  -4.657  -9.863
  268    HG2  GLN  36          2HG       GLN  36   3.043  -5.700  -9.289
  269    HG3  GLN  36          3HG       GLN  36   2.639  -4.917  -7.763
  270   HE21  GLN  36          1HE2      GLN  36   0.398  -6.906  -7.448
  271   HE22  GLN  36          2HE2      GLN  36   1.173  -8.333  -6.862
  272    H    GLU  37           HN       GLU  37  -1.733  -2.878  -8.376
  273    HA   GLU  37           HA       GLU  37  -3.974  -4.703  -8.363
  274    HB2  GLU  37          2HB       GLU  37  -3.901  -1.725  -8.879
  275    HB3  GLU  37          3HB       GLU  37  -5.346  -2.688  -8.605
  276    HG2  GLU  37          2HG       GLU  37  -3.405  -3.006  -6.479
  277    HG3  GLU  37          3HG       GLU  37  -3.885  -1.324  -6.702
  278    H    SER  38           HN       SER  38  -1.897  -3.287 -10.684
  279    HA   SER  38           HA       SER  38  -1.800  -3.392 -12.955
  280    HB2  SER  38          2HB       SER  38  -3.229  -5.766 -12.136
  281    HB3  SER  38          3HB       SER  38  -3.819  -5.203 -13.700
  282    HG   SER  38           HG       SER  38  -2.073  -6.535 -14.063
  283    H    ASN  39           HN       ASN  39  -4.151  -2.005 -11.338
  284    HA   ASN  39           HA       ASN  39  -5.837  -1.397 -13.667
  285    HB2  ASN  39          2HB       ASN  39  -6.946  -2.198 -11.563
  286    HB3  ASN  39          3HB       ASN  39  -6.372  -0.735 -10.766
  287   HD21  ASN  39          1HD2      ASN  39  -8.049   0.544 -10.476
  288   HD22  ASN  39          2HD2      ASN  39  -9.238   0.942 -11.663
  289    H    GLY  40           HN       GLY  40  -3.132  -0.310 -13.167
  290    HA2  GLY  40          1HA       GLY  40  -2.407   1.815 -13.981
  291    HA3  GLY  40          2HA       GLY  40  -3.876   2.527 -13.329
  292    H    THR  41           HN       THR  41  -3.184   0.707 -10.870
  293    HA   THR  41           HA       THR  41  -0.928   2.152  -9.755
  294    HB   THR  41           HB       THR  41  -2.933   3.622  -9.365
  295    HG1  THR  41          1HG       THR  41  -2.423   3.275  -6.829
  296   HG21  THR  41          1HG2      THR  41  -4.253   1.327  -8.778
  297   HG22  THR  41          2HG2      THR  41  -4.774   2.929  -8.256
  298   HG23  THR  41          3HG2      THR  41  -3.852   1.902  -7.160
  299    H    TRP  42           HN       TRP  42  -1.451   1.565  -7.057
  300    HA   TRP  42           HA       TRP  42  -1.897  -1.311  -6.912
  301    HB2  TRP  42          2HB       TRP  42   0.244  -1.709  -5.755
  302    HB3  TRP  42          3HB       TRP  42   0.490  -1.145  -7.405
  303    HD1  TRP  42          1HD       TRP  42   1.999   0.927  -7.715
  304    HE1  TRP  42          1HE       TRP  42   3.149   2.592  -6.124
  305    HE3  TRP  42          3HE       TRP  42  -0.184  -0.509  -3.320
  306    HZ2  TRP  42          2HZ       TRP  42   3.134   3.213  -3.371
  307    HZ3  TRP  42          3HZ       TRP  42   0.439   0.672  -1.253
  308    HH2  TRP  42          2HH       TRP  42   2.064   2.494  -1.279
  309    H    ARG  43           HN       ARG  43  -1.893  -2.092  -4.637
  310    HA   ARG  43           HA       ARG  43  -2.386   0.005  -2.657
  311    HB2  ARG  43          2HB       ARG  43  -4.332  -2.179  -3.403
  312    HB3  ARG  43          3HB       ARG  43  -4.437  -1.268  -1.903
  313    HG2  ARG  43          2HG       ARG  43  -4.228   0.422  -4.270
  314    HG3  ARG  43          3HG       ARG  43  -5.657  -0.614  -4.260
  315    HD2  ARG  43          2HD       ARG  43  -5.115   0.664  -1.690
  316    HD3  ARG  43          3HD       ARG  43  -5.427   1.808  -2.994
  317    HE   ARG  43           HE       ARG  43  -7.305  -0.042  -1.808
  318   HH11  ARG  43          1HH1      ARG  43  -6.570   2.022  -4.514
  319   HH12  ARG  43          2HH1      ARG  43  -8.223   2.181  -5.009
  320   HH21  ARG  43          1HH2      ARG  43  -9.484   0.158  -2.451
  321   HH22  ARG  43          2HH2      ARG  43  -9.880   1.120  -3.835
  322    H    CYS  44           HN       CYS  44  -1.605  -0.475  -0.692
  323    HA   CYS  44           HA       CYS  44   0.206  -2.430  -0.185
  324    HB2  CYS  44          2HB       CYS  44  -0.003  -1.950   2.125
  325    HB3  CYS  44          3HB       CYS  44  -0.439  -0.459   1.294
  326    H    LYS  45           HN       LYS  45   0.045  -4.286   1.384
  327    HA   LYS  45           HA       LYS  45  -1.729  -6.233   0.359
  328    HB2  LYS  45          2HB       LYS  45  -0.467  -6.678   3.012
  329    HB3  LYS  45          3HB       LYS  45  -0.554  -7.744   1.616
  330    HG2  LYS  45          2HG       LYS  45   1.096  -6.106   0.522
  331    HG3  LYS  45          3HG       LYS  45   1.367  -5.515   2.163
  332    HD2  LYS  45          2HD       LYS  45   3.007  -7.126   1.973
  333    HD3  LYS  45          3HD       LYS  45   1.696  -8.045   2.716
  334    HE2  LYS  45          2HE       LYS  45   1.107  -8.404   0.115
  335    HE3  LYS  45          3HE       LYS  45   2.859  -8.233   0.008
  336    HZ1  LYS  45          1HZ       LYS  45   2.762 -10.435   0.420
  337    HZ2  LYS  45          2HZ       LYS  45   1.270 -10.354   1.212
  338    HZ3  LYS  45          3HZ       LYS  45   2.687  -9.925   2.030
  339    H    VAL  46           HN       VAL  46  -2.054  -3.897   2.835
  340    HA   VAL  46           HA       VAL  46  -4.105  -5.305   4.304
  341    HB   VAL  46           HB       VAL  46  -3.521  -2.362   4.517
  342   HG11  VAL  46          1HG1      VAL  46  -5.345  -2.789   5.845
  343   HG12  VAL  46          2HG1      VAL  46  -4.831  -4.437   6.209
  344   HG13  VAL  46          3HG1      VAL  46  -4.033  -3.072   6.989
  345   HG21  VAL  46          1HG2      VAL  46  -2.047  -4.583   5.928
  346   HG22  VAL  46          2HG2      VAL  46  -1.391  -3.599   4.620
  347   HG23  VAL  46          3HG2      VAL  46  -1.809  -2.852   6.160
  348    H    CYS  47           HN       CYS  47  -3.931  -3.210   1.583
  349    HA   CYS  47           HA       CYS  47  -6.783  -2.567   1.735
  350    HB2  CYS  47          2HB       CYS  47  -4.487  -1.507   0.119
  351    HB3  CYS  47          3HB       CYS  47  -6.142  -1.241  -0.418
  352    H    ALA  48           HN       ALA  48  -4.449  -3.912  -0.597
  353    HA   ALA  48           HA       ALA  48  -6.446  -4.814  -2.409
  354    HB1  ALA  48          1HB       ALA  48  -4.722  -5.272  -3.754
  355    HB2  ALA  48          2HB       ALA  48  -3.727  -4.491  -2.523
  356    HB3  ALA  48          3HB       ALA  48  -3.908  -6.245  -2.528
  357    H    LYS  49           HN       LYS  49  -5.478  -5.950   0.594
  358    HA   LYS  49           HA       LYS  49  -6.849  -8.493   0.116
  359    HB2  LYS  49          2HB       LYS  49  -4.116  -8.412   0.270
  360    HB3  LYS  49          3HB       LYS  49  -4.558  -8.713   1.946
  361    HG2  LYS  49          2HG       LYS  49  -4.276 -10.834   1.033
  362    HG3  LYS  49          3HG       LYS  49  -6.025 -10.596   1.035
  363    HD2  LYS  49          2HD       LYS  49  -5.964 -11.154  -1.127
  364    HD3  LYS  49          3HD       LYS  49  -5.234  -9.571  -1.406
  365    HE2  LYS  49          2HE       LYS  49  -3.701 -10.952  -2.418
  366    HE3  LYS  49          3HE       LYS  49  -3.018 -10.818  -0.798
  367    HZ1  LYS  49          1HZ       LYS  49  -4.863 -12.957  -0.905
  368    HZ2  LYS  49          2HZ       LYS  49  -3.215 -12.994  -0.529
  369    HZ3  LYS  49          3HZ       LYS  49  -3.717 -13.134  -2.138
  370    H    GLU  50           HN       GLU  50  -8.129  -9.153   1.773
  371    HA   GLU  50           HA       GLU  50  -7.892  -7.794   4.358
  372    HB2  GLU  50          2HB       GLU  50  -9.879  -7.190   2.445
  373    HB3  GLU  50          3HB       GLU  50 -10.671  -8.126   3.705
  374    HG2  GLU  50          2HG       GLU  50  -9.986  -6.571   5.385
  375    HG3  GLU  50          3HG       GLU  50  -8.978  -5.697   4.232
  376    H    ILE  51           HN       ILE  51  -8.736  -8.943   6.120
  377    HA   ILE  51           HA       ILE  51  -9.256 -11.786   5.555
  378    HB   ILE  51           HB       ILE  51  -8.674 -11.729   8.216
  379   HG12  ILE  51          2HG1      ILE  51  -6.706  -9.821   6.956
  380   HG13  ILE  51          3HG1      ILE  51  -8.094  -9.261   7.883
  381   HG21  ILE  51          1HG2      ILE  51  -7.789 -13.149   6.282
  382   HG22  ILE  51          2HG2      ILE  51  -6.506 -11.947   6.154
  383   HG23  ILE  51          3HG2      ILE  51  -6.709 -12.864   7.646
  384   HD11  ILE  51          1HD1      ILE  51  -7.195 -10.772   9.748
  385   HD12  ILE  51          2HD1      ILE  51  -5.695 -10.779   8.819
  386   HD13  ILE  51          3HD1      ILE  51  -6.357  -9.257   9.416
  387    H    GLU  52           HN       GLU  52 -10.391  -8.943   7.231
  388    HA   GLU  52           HA       GLU  52 -13.030  -9.977   7.437
  389    HB2  GLU  52          2HB       GLU  52 -11.601 -10.990   9.417
  390    HB3  GLU  52          3HB       GLU  52 -11.885  -9.412  10.136
  391    HG2  GLU  52          2HG       GLU  52 -13.920 -10.006  10.753
  392    HG3  GLU  52          3HG       GLU  52 -14.342 -10.437   9.097
  393    H    LEU  53           HN       LEU  53 -12.124  -7.741   6.219
  394    HA   LEU  53           HA       LEU  53 -12.863  -5.579   5.976
  395    HB2  LEU  53          2HB       LEU  53 -14.585  -6.426   7.814
  396    HB3  LEU  53          3HB       LEU  53 -13.656  -5.322   8.825
  397    HG   LEU  53           HG       LEU  53 -14.150  -3.610   6.913
  398   HD11  LEU  53          1HD1      LEU  53 -16.433  -5.549   6.566
  399   HD12  LEU  53          2HD1      LEU  53 -15.141  -5.279   5.398
  400   HD13  LEU  53          3HD1      LEU  53 -16.259  -3.974   5.791
  401   HD21  LEU  53          1HD2      LEU  53 -15.788  -2.720   8.242
  402   HD22  LEU  53          2HD2      LEU  53 -15.055  -3.862   9.369
  403   HD23  LEU  53          3HD2      LEU  53 -16.553  -4.282   8.538
  Start of MODEL   14
    1    H1   SER   1           HN       SER   1   8.161  12.128  11.881
    2    HA   SER   1           HA       SER   1   7.787  10.154  10.650
    3    HB2  SER   1          2HB       SER   1   6.688  12.147   8.809
    4    HB3  SER   1          3HB       SER   1   7.555  10.851   7.986
    5    HG   SER   1           HG       SER   1   6.020   9.508   8.506
    6    H    ASP   2           HN       ASP   2   9.418   8.942   9.818
    7    HA   ASP   2           HA       ASP   2  11.780  10.408   8.841
    8    HB2  ASP   2          2HB       ASP   2  11.488   8.058  10.661
    9    HB3  ASP   2          3HB       ASP   2  12.921   8.159   9.642
   10    H    ARG   3           HN       ARG   3   9.308   8.562   7.790
   11    HA   ARG   3           HA       ARG   3   8.962   7.663   5.699
   12    HB2  ARG   3          2HB       ARG   3  11.914   7.446   5.216
   13    HB3  ARG   3          3HB       ARG   3  10.614   7.660   4.053
   14    HG2  ARG   3          2HG       ARG   3  10.642   9.899   5.812
   15    HG3  ARG   3          3HG       ARG   3  12.276   9.624   5.202
   16    HD2  ARG   3          2HD       ARG   3  11.681  10.027   3.029
   17    HD3  ARG   3          3HD       ARG   3  10.014   9.507   3.275
   18    HE   ARG   3           HE       ARG   3  10.100  11.748   4.730
   19   HH11  ARG   3          1HH1      ARG   3  11.188  11.058   1.496
   20   HH12  ARG   3          2HH1      ARG   3  10.921  12.671   0.922
   21   HH21  ARG   3          1HH2      ARG   3   9.744  13.876   3.986
   22   HH22  ARG   3          2HH2      ARG   3  10.100  14.273   2.340
   23    H    THR   4           HN       THR   4   8.425   5.980   7.408
   24    HA   THR   4           HA       THR   4  10.087   3.587   6.956
   25    HB   THR   4           HB       THR   4   8.488   3.349   9.344
   26    HG1  THR   4          1HG       THR   4   8.941   5.155  10.349
   27   HG21  THR   4          1HG2      THR   4  10.360   1.919   8.952
   28   HG22  THR   4          2HG2      THR   4  10.762   2.934  10.337
   29   HG23  THR   4          3HG2      THR   4  11.443   3.294   8.751
   30    H    CYS   5           HN       CYS   5   9.061   1.726   6.387
   31    HA   CYS   5           HA       CYS   5   6.663   1.756   5.060
   32    HB2  CYS   5          2HB       CYS   5   8.398  -0.078   5.043
   33    HB3  CYS   5          3HB       CYS   5   7.709  -0.650   6.559
   34    H    ALA   6           HN       ALA   6   4.555   0.986   5.542
   35    HA   ALA   6           HA       ALA   6   3.771   1.514   8.311
   36    HB1  ALA   6          1HB       ALA   6   1.442   1.167   6.896
   37    HB2  ALA   6          2HB       ALA   6   2.227   2.712   7.230
   38    HB3  ALA   6          3HB       ALA   6   2.526   1.883   5.703
   39    H    ARG   7           HN       ARG   7   4.710  -1.098   6.652
   40    HA   ARG   7           HA       ARG   7   2.839  -2.873   8.079
   41    HB2  ARG   7          2HB       ARG   7   4.251  -3.718   5.568
   42    HB3  ARG   7          3HB       ARG   7   2.797  -4.386   6.299
   43    HG2  ARG   7          2HG       ARG   7   3.036  -1.741   4.882
   44    HG3  ARG   7          3HG       ARG   7   2.241  -3.195   4.277
   45    HD2  ARG   7          2HD       ARG   7   1.373  -1.298   6.408
   46    HD3  ARG   7          3HD       ARG   7   0.449  -1.986   5.074
   47    HE   ARG   7           HE       ARG   7   0.929  -4.153   6.552
   48   HH11  ARG   7          1HH1      ARG   7  -0.187  -0.979   7.442
   49   HH12  ARG   7          2HH1      ARG   7  -1.116  -1.541   8.793
   50   HH21  ARG   7          1HH2      ARG   7  -0.290  -4.907   8.328
   51   HH22  ARG   7          2HH2      ARG   7  -1.173  -3.775   9.296
   52    H    CYS   8           HN       CYS   8   6.129  -2.407   6.881
   53    HA   CYS   8           HA       CYS   8   7.068  -4.577   8.617
   54    HB2  CYS   8          2HB       CYS   8   8.700  -3.036   6.600
   55    HB3  CYS   8          3HB       CYS   8   9.083  -4.587   7.340
   56    H    GLN   9           HN       GLN   9   7.030  -1.147   8.291
   57    HA   GLN   9           HA       GLN   9   7.713   0.521   9.684
   58    HB2  GLN   9          2HB       GLN   9   7.675  -1.840  11.383
   59    HB3  GLN   9          3HB       GLN   9   8.898  -0.685  11.892
   60    HG2  GLN   9          2HG       GLN   9   7.383   0.815  12.593
   61    HG3  GLN   9          3HG       GLN   9   6.269   0.467  11.272
   62   HE21  GLN   9          1HE2      GLN   9   4.776  -1.201  11.497
   63   HE22  GLN   9          2HE2      GLN   9   4.383  -1.879  13.037
   64    H    GLU  10           HN       GLU  10   9.475  -0.731   7.710
   65    HA   GLU  10           HA       GLU  10  12.116  -0.356   8.928
   66    HB2  GLU  10          2HB       GLU  10  11.098  -1.820   6.555
   67    HB3  GLU  10          3HB       GLU  10  12.707  -1.125   6.426
   68    HG2  GLU  10          2HG       GLU  10  13.105  -2.303   8.709
   69    HG3  GLU  10          3HG       GLU  10  11.714  -3.276   8.235
   70    H    SER  11           HN       SER  11  13.670   1.026   7.970
   71    HA   SER  11           HA       SER  11  12.754   3.555   7.263
   72    HB2  SER  11          2HB       SER  11  15.226   3.724   6.309
   73    HB3  SER  11          3HB       SER  11  14.921   3.625   8.043
   74    HG   SER  11           HG       SER  11  16.116   1.907   7.987
   75    H    LEU  12           HN       LEU  12  12.646   4.687   5.323
   76    HA   LEU  12           HA       LEU  12  12.365   2.988   2.945
   77    HB2  LEU  12          2HB       LEU  12  11.163   5.611   3.755
   78    HB3  LEU  12          3HB       LEU  12  11.173   5.102   2.068
   79    HG   LEU  12           HG       LEU  12   9.163   4.613   3.827
   80   HD11  LEU  12          1HD1      LEU  12   9.594   2.549   1.756
   81   HD12  LEU  12          2HD1      LEU  12   9.588   4.229   1.219
   82   HD13  LEU  12          3HD1      LEU  12   8.192   3.570   2.070
   83   HD21  LEU  12          1HD2      LEU  12  10.647   3.079   5.105
   84   HD22  LEU  12          2HD2      LEU  12  10.751   2.055   3.672
   85   HD23  LEU  12          3HD2      LEU  12   9.197   2.302   4.468
   86    H    GLY  13           HN       GLY  13  14.916   4.067   4.007
   87    HA2  GLY  13          1HA       GLY  13  16.057   6.208   2.900
   88    HA3  GLY  13          2HA       GLY  13  16.870   4.650   2.883
   89    H    ARG  14           HN       ARG  14  16.854   3.399   0.995
   90    HA   ARG  14           HA       ARG  14  16.601   4.962  -1.426
   91    HB2  ARG  14          2HB       ARG  14  18.143   2.723  -0.575
   92    HB3  ARG  14          3HB       ARG  14  17.219   2.238  -1.990
   93    HG2  ARG  14          2HG       ARG  14  18.603   3.331  -3.325
   94    HG3  ARG  14          3HG       ARG  14  18.357   4.828  -2.424
   95    HD2  ARG  14          2HD       ARG  14  19.981   3.546  -0.721
   96    HD3  ARG  14          3HD       ARG  14  20.522   2.823  -2.235
   97    HE   ARG  14           HE       ARG  14  21.625   4.767  -2.640
   98   HH11  ARG  14          1HH1      ARG  14  18.880   5.477  -0.619
   99   HH12  ARG  14          2HH1      ARG  14  19.238   7.169  -0.504
  100   HH21  ARG  14          1HH2      ARG  14  22.106   6.992  -2.497
  101   HH22  ARG  14          2HH2      ARG  14  21.072   8.029  -1.573
  102    H    LEU  15           HN       LEU  15  14.237   3.926   0.200
  103    HA   LEU  15           HA       LEU  15  12.921   2.028  -1.495
  104    HB2  LEU  15          2HB       LEU  15  12.334   3.475   0.988
  105    HB3  LEU  15          3HB       LEU  15  10.925   3.158  -0.023
  106    HG   LEU  15           HG       LEU  15  11.261   1.445   1.711
  107   HD11  LEU  15          1HD1      LEU  15  10.783  -0.388   0.345
  108   HD12  LEU  15          2HD1      LEU  15  11.799   0.207  -0.966
  109   HD13  LEU  15          3HD1      LEU  15  10.271   1.007  -0.605
  110   HD21  LEU  15          1HD2      LEU  15  13.362   0.879   2.193
  111   HD22  LEU  15          2HD2      LEU  15  13.968   1.517   0.663
  112   HD23  LEU  15          3HD2      LEU  15  13.319  -0.122   0.741
  113    H    SER  16           HN       SER  16  12.855   5.526  -1.092
  114    HA   SER  16           HA       SER  16  12.262   7.133  -2.631
  115    HB2  SER  16          2HB       SER  16  12.493   5.000  -4.279
  116    HB3  SER  16          3HB       SER  16  10.763   5.308  -4.420
  117    HG   SER  16           HG       SER  16  11.199   7.003  -5.572
  118    HA   PRO  17           HA       PRO  17   8.161   6.784  -0.506
  119    HB2  PRO  17          2HB       PRO  17   8.403   9.134   0.833
  120    HB3  PRO  17          3HB       PRO  17   9.044   7.607   1.449
  121    HG2  PRO  17          2HG       PRO  17  10.469   9.822   0.027
  122    HG3  PRO  17          3HG       PRO  17  10.985   8.888   1.443
  123    HD2  PRO  17          2HD       PRO  17  11.899   8.374  -1.053
  124    HD3  PRO  17          3HD       PRO  17  11.685   7.102   0.167
  125    H    LYS  18           HN       LYS  18   9.546   8.591  -2.906
  126    HA   LYS  18           HA       LYS  18   7.772  10.776  -3.158
  127    HB2  LYS  18          2HB       LYS  18   9.990   9.717  -4.581
  128    HB3  LYS  18          3HB       LYS  18   8.675   9.913  -5.732
  129    HG2  LYS  18          2HG       LYS  18   8.728  12.165  -5.619
  130    HG3  LYS  18          3HG       LYS  18   9.157  12.180  -3.906
  131    HD2  LYS  18          2HD       LYS  18  11.232  12.693  -4.535
  132    HD3  LYS  18          3HD       LYS  18  11.362  11.051  -5.172
  133    HE2  LYS  18          2HE       LYS  18  10.645  13.579  -6.631
  134    HE3  LYS  18          3HE       LYS  18  11.973  12.465  -6.951
  135    HZ1  LYS  18          1HZ       LYS  18  10.632  11.580  -8.469
  136    HZ2  LYS  18          2HZ       LYS  18   9.265  12.379  -7.874
  137    HZ3  LYS  18          3HZ       LYS  18   9.753  10.913  -7.187
  138    H    THR  19           HN       THR  19   7.611   7.436  -4.190
  139    HA   THR  19           HA       THR  19   4.842   7.898  -5.057
  140    HB   THR  19           HB       THR  19   5.298   7.356  -7.166
  141    HG1  THR  19          1HG       THR  19   5.864   5.189  -7.613
  142   HG21  THR  19          1HG2      THR  19   8.100   6.576  -6.360
  143   HG22  THR  19          2HG2      THR  19   7.585   8.232  -6.681
  144   HG23  THR  19          3HG2      THR  19   7.540   7.029  -7.969
  145    H    ASN  20           HN       ASN  20   6.817   6.379  -2.958
  146    HA   ASN  20           HA       ASN  20   5.506   3.791  -2.949
  147    HB2  ASN  20          2HB       ASN  20   7.759   5.037  -1.421
  148    HB3  ASN  20          3HB       ASN  20   6.953   3.619  -0.758
  149   HD21  ASN  20          1HD2      ASN  20   9.304   2.947  -1.086
  150   HD22  ASN  20          2HD2      ASN  20   9.659   2.155  -2.580
  151    H    THR  21           HN       THR  21   3.642   5.762  -2.623
  152    HA   THR  21           HA       THR  21   2.882   5.449   0.206
  153    HB   THR  21           HB       THR  21   2.273   7.843  -1.539
  154    HG1  THR  21          1HG       THR  21   4.271   8.287  -0.915
  155   HG21  THR  21          1HG2      THR  21   0.512   7.339   0.102
  156   HG22  THR  21          2HG2      THR  21   1.363   8.832   0.496
  157   HG23  THR  21          3HG2      THR  21   1.717   7.354   1.389
  158    H    CYS  22           HN       CYS  22   1.364   3.901   0.157
  159    HA   CYS  22           HA       CYS  22  -0.287   3.142  -1.889
  160    HB2  CYS  22          2HB       CYS  22  -0.024   1.949   0.284
  161    HB3  CYS  22          3HB       CYS  22  -1.059   3.160   1.036
  162    H    ARG  23           HN       ARG  23  -1.981   3.978  -2.920
  163    HA   ARG  23           HA       ARG  23  -2.948   6.586  -2.198
  164    HB2  ARG  23          2HB       ARG  23  -4.437   5.128  -4.264
  165    HB3  ARG  23          3HB       ARG  23  -3.675   6.712  -4.329
  166    HG2  ARG  23          2HG       ARG  23  -1.468   5.287  -4.389
  167    HG3  ARG  23          3HG       ARG  23  -2.560   4.039  -4.995
  168    HD2  ARG  23          2HD       ARG  23  -1.832   5.079  -6.938
  169    HD3  ARG  23          3HD       ARG  23  -3.376   5.871  -6.622
  170    HE   ARG  23           HE       ARG  23  -2.240   7.831  -6.428
  171   HH11  ARG  23          1HH1      ARG  23  -0.034   5.218  -5.772
  172   HH12  ARG  23          2HH1      ARG  23   1.344   6.253  -5.594
  173   HH21  ARG  23          1HH2      ARG  23  -0.432   9.204  -6.197
  174   HH22  ARG  23          2HH2      ARG  23   1.116   8.521  -5.836
  175    H    GLY  24           HN       GLY  24  -3.607   3.718  -0.888
  176    HA2  GLY  24          1HA       GLY  24  -6.515   4.097  -0.720
  177    HA3  GLY  24          2HA       GLY  24  -5.638   2.654  -0.236
  178    H    CYS  25           HN       CYS  25  -3.730   3.579   1.440
  179    HA   CYS  25           HA       CYS  25  -5.334   4.671   3.647
  180    HB2  CYS  25          2HB       CYS  25  -3.382   3.724   5.042
  181    HB3  CYS  25          3HB       CYS  25  -4.510   2.581   4.318
  182    H    ASN  26           HN       ASN  26  -2.703   5.342   1.568
  183    HA   ASN  26           HA       ASN  26  -1.493   7.264   1.294
  184    HB2  ASN  26          2HB       ASN  26  -3.627   8.170   2.734
  185    HB3  ASN  26          3HB       ASN  26  -2.293   8.563   3.815
  186   HD21  ASN  26          1HD2      ASN  26  -3.221   8.799   0.403
  187   HD22  ASN  26          2HD2      ASN  26  -2.519  10.357   0.143
  188    H    HIS  27           HN       HIS  27  -0.794   4.901   3.013
  189    HA   HIS  27           HA       HIS  27   1.245   6.150   4.726
  190    HB2  HIS  27          2HB       HIS  27   0.089   3.356   4.777
  191    HB3  HIS  27          3HB       HIS  27   1.395   3.914   5.819
  192    HD1  HIS  27          1HD       HIS  27   0.266   6.639   6.670
  193    HD2  HIS  27          2HD       HIS  27  -1.959   3.133   6.552
  194    HE1  HIS  27          1HE       HIS  27  -1.646   7.003   8.262
  195    H    LEU  28           HN       LEU  28   3.372   5.135   4.787
  196    HA   LEU  28           HA       LEU  28   4.363   4.657   2.147
  197    HB2  LEU  28          2HB       LEU  28   5.598   4.725   4.877
  198    HB3  LEU  28          3HB       LEU  28   6.526   4.194   3.475
  199    HG   LEU  28           HG       LEU  28   5.272   6.913   3.852
  200   HD11  LEU  28          1HD1      LEU  28   7.451   6.093   5.113
  201   HD12  LEU  28          2HD1      LEU  28   7.315   7.720   4.447
  202   HD13  LEU  28          3HD1      LEU  28   8.192   6.474   3.559
  203   HD21  LEU  28          1HD2      LEU  28   6.411   5.529   1.518
  204   HD22  LEU  28          2HD2      LEU  28   7.004   7.167   1.794
  205   HD23  LEU  28          3HD2      LEU  28   5.275   6.876   1.601
  206    H    VAL  29           HN       VAL  29   5.144   2.789   1.247
  207    HA   VAL  29           HA       VAL  29   5.133   0.326   2.799
  208    HB   VAL  29           HB       VAL  29   3.842  -0.267   0.315
  209   HG11  VAL  29          1HG1      VAL  29   3.908  -1.470   2.596
  210   HG12  VAL  29          2HG1      VAL  29   2.556  -0.419   3.016
  211   HG13  VAL  29          3HG1      VAL  29   2.420  -1.529   1.652
  212   HG21  VAL  29          1HG2      VAL  29   3.099   2.145   0.604
  213   HG22  VAL  29          2HG2      VAL  29   1.822   0.941   0.430
  214   HG23  VAL  29          3HG2      VAL  29   2.210   1.593   2.022
  215    H    CYS  30           HN       CYS  30   7.026  -0.585   2.384
  216    HA   CYS  30           HA       CYS  30   8.843   0.088   0.458
  217    HB2  CYS  30          2HB       CYS  30   9.888  -2.117   0.838
  218    HB3  CYS  30          3HB       CYS  30   9.409  -1.346   2.346
  219    H    ARG  31           HN       ARG  31   9.688  -1.529  -1.277
  220    HA   ARG  31           HA       ARG  31   7.591  -1.771  -3.236
  221    HB2  ARG  31          2HB       ARG  31  10.412  -2.763  -3.574
  222    HB3  ARG  31          3HB       ARG  31   9.298  -2.185  -4.806
  223    HG2  ARG  31          2HG       ARG  31   9.620  -0.038  -3.060
  224    HG3  ARG  31          3HG       ARG  31  11.232  -0.731  -3.251
  225    HD2  ARG  31          2HD       ARG  31   9.430   0.490  -5.290
  226    HD3  ARG  31          3HD       ARG  31  11.152   0.749  -5.014
  227    HE   ARG  31           HE       ARG  31   9.950  -1.242  -6.692
  228   HH11  ARG  31          1HH1      ARG  31  12.748  -0.440  -4.782
  229   HH12  ARG  31          2HH1      ARG  31  13.812  -1.483  -5.665
  230   HH21  ARG  31          1HH2      ARG  31  11.341  -2.618  -7.863
  231   HH22  ARG  31          2HH2      ARG  31  13.011  -2.720  -7.420
  232    H    ASP  32           HN       ASP  32   8.047  -3.608  -0.732
  233    HA   ASP  32           HA       ASP  32   7.677  -6.141  -2.195
  234    HB2  ASP  32          2HB       ASP  32   9.752  -6.154  -0.888
  235    HB3  ASP  32          3HB       ASP  32   8.849  -5.735   0.565
  236    H    CYS  33           HN       CYS  33   6.202  -3.823  -0.307
  237    HA   CYS  33           HA       CYS  33   4.235  -5.729   0.769
  238    HB2  CYS  33          2HB       CYS  33   5.014  -2.938   1.591
  239    HB3  CYS  33          3HB       CYS  33   3.503  -3.666   2.123
  240    H    ARG  34           HN       ARG  34   4.656  -4.071  -1.930
  241    HA   ARG  34           HA       ARG  34   1.982  -2.907  -2.102
  242    HB2  ARG  34          2HB       ARG  34   3.817  -2.916  -4.442
  243    HB3  ARG  34          3HB       ARG  34   2.734  -1.655  -3.867
  244    HG2  ARG  34          2HG       ARG  34   4.275  -1.084  -2.098
  245    HG3  ARG  34          3HG       ARG  34   5.338  -2.414  -2.562
  246    HD2  ARG  34          2HD       ARG  34   4.598  -0.172  -4.429
  247    HD3  ARG  34          3HD       ARG  34   6.012  -0.119  -3.375
  248    HE   ARG  34           HE       ARG  34   6.129  -2.498  -4.813
  249   HH11  ARG  34          1HH1      ARG  34   6.242   0.929  -5.418
  250   HH12  ARG  34          2HH1      ARG  34   7.244   0.779  -6.823
  251   HH21  ARG  34          1HH2      ARG  34   7.449  -2.708  -6.661
  252   HH22  ARG  34          2HH2      ARG  34   7.930  -1.289  -7.530
  253    H    ILE  35           HN       ILE  35   0.371  -3.691  -3.378
  254    HA   ILE  35           HA       ILE  35   0.896  -6.255  -4.733
  255    HB   ILE  35           HB       ILE  35  -1.453  -5.334  -3.122
  256   HG12  ILE  35          2HG1      ILE  35  -1.220  -7.835  -2.438
  257   HG13  ILE  35          3HG1      ILE  35   0.356  -7.731  -3.215
  258   HG21  ILE  35          1HG2      ILE  35  -2.646  -5.956  -5.001
  259   HG22  ILE  35          2HG2      ILE  35  -1.486  -7.204  -5.452
  260   HG23  ILE  35          3HG2      ILE  35  -2.576  -7.464  -4.090
  261   HD11  ILE  35          1HD1      ILE  35   1.219  -6.403  -1.593
  262   HD12  ILE  35          2HD1      ILE  35  -0.333  -5.649  -1.226
  263   HD13  ILE  35          3HD1      ILE  35   0.019  -7.274  -0.637
  264    H    GLN  36           HN       GLN  36   1.196  -5.595  -6.810
  265    HA   GLN  36           HA       GLN  36   0.225  -3.565  -8.252
  266    HB2  GLN  36          2HB       GLN  36   0.008  -6.252  -9.539
  267    HB3  GLN  36          3HB       GLN  36   0.683  -4.760 -10.177
  268    HG2  GLN  36          2HG       GLN  36   2.587  -5.964  -9.853
  269    HG3  GLN  36          3HG       GLN  36   2.472  -5.136  -8.300
  270   HE21  GLN  36          1HE2      GLN  36   0.135  -6.903  -7.624
  271   HE22  GLN  36          2HE2      GLN  36   0.853  -8.395  -7.130
  272    H    GLU  37           HN       GLU  37  -1.624  -2.942  -9.303
  273    HA   GLU  37           HA       GLU  37  -4.021  -4.591  -8.849
  274    HB2  GLU  37          2HB       GLU  37  -3.768  -1.590  -8.603
  275    HB3  GLU  37          3HB       GLU  37  -5.296  -2.460  -8.588
  276    HG2  GLU  37          2HG       GLU  37  -3.228  -3.313  -6.651
  277    HG3  GLU  37          3HG       GLU  37  -4.022  -1.764  -6.369
  278    H    SER  38           HN       SER  38  -5.905  -3.539 -10.251
  279    HA   SER  38           HA       SER  38  -4.887  -3.552 -12.993
  280    HB2  SER  38          2HB       SER  38  -7.691  -3.544 -13.061
  281    HB3  SER  38          3HB       SER  38  -6.629  -4.932 -13.292
  282    HG   SER  38           HG       SER  38  -8.210  -5.201 -11.604
  283    H    ASN  39           HN       ASN  39  -5.943  -1.373 -10.662
  284    HA   ASN  39           HA       ASN  39  -7.153   0.524 -12.476
  285    HB2  ASN  39          2HB       ASN  39  -6.383   0.714  -9.557
  286    HB3  ASN  39          3HB       ASN  39  -7.173   2.010 -10.451
  287   HD21  ASN  39          1HD2      ASN  39  -7.703  -0.459  -8.394
  288   HD22  ASN  39          2HD2      ASN  39  -9.358  -0.799  -8.750
  289    H    GLY  40           HN       GLY  40  -4.523  -0.240 -13.213
  290    HA2  GLY  40          1HA       GLY  40  -2.521   0.671 -13.872
  291    HA3  GLY  40          2HA       GLY  40  -3.379   2.205 -13.852
  292    H    THR  41           HN       THR  41  -3.083   0.358 -10.933
  293    HA   THR  41           HA       THR  41  -0.754   1.845 -10.032
  294    HB   THR  41           HB       THR  41  -2.748   3.311  -9.563
  295    HG1  THR  41          1HG       THR  41  -0.911   3.573  -8.297
  296   HG21  THR  41          1HG2      THR  41  -3.414   1.195  -7.516
  297   HG22  THR  41          2HG2      THR  41  -4.302   1.437  -9.021
  298   HG23  THR  41          3HG2      THR  41  -4.272   2.709  -7.801
  299    H    TRP  42           HN       TRP  42  -1.094   1.354  -7.284
  300    HA   TRP  42           HA       TRP  42  -1.424  -1.543  -7.056
  301    HB2  TRP  42          2HB       TRP  42   0.734  -1.774  -5.889
  302    HB3  TRP  42          3HB       TRP  42   0.949  -1.226  -7.549
  303    HD1  TRP  42          1HD       TRP  42   2.244   0.993  -7.905
  304    HE1  TRP  42          1HE       TRP  42   3.302   2.738  -6.337
  305    HE3  TRP  42          3HE       TRP  42   0.320  -0.640  -3.459
  306    HZ2  TRP  42          2HZ       TRP  42   3.319   3.342  -3.580
  307    HZ3  TRP  42          3HZ       TRP  42   0.906   0.578  -1.403
  308    HH2  TRP  42          2HH       TRP  42   2.376   2.527  -1.464
  309    H    ARG  43           HN       ARG  43  -1.439  -2.277  -4.786
  310    HA   ARG  43           HA       ARG  43  -2.034  -0.174  -2.839
  311    HB2  ARG  43          2HB       ARG  43  -3.896  -2.366  -3.708
  312    HB3  ARG  43          3HB       ARG  43  -4.006  -1.679  -2.093
  313    HG2  ARG  43          2HG       ARG  43  -3.894   0.464  -3.947
  314    HG3  ARG  43          3HG       ARG  43  -5.096  -0.697  -4.516
  315    HD2  ARG  43          2HD       ARG  43  -5.073   0.087  -1.638
  316    HD3  ARG  43          3HD       ARG  43  -5.752   1.198  -2.826
  317    HE   ARG  43           HE       ARG  43  -6.883  -1.289  -3.302
  318   HH11  ARG  43          1HH1      ARG  43  -6.806   1.072  -0.746
  319   HH12  ARG  43          2HH1      ARG  43  -8.376   0.659  -0.140
  320   HH21  ARG  43          1HH2      ARG  43  -8.951  -1.842  -2.514
  321   HH22  ARG  43          2HH2      ARG  43  -9.594  -1.000  -1.145
  322    H    CYS  44           HN       CYS  44  -1.547  -0.691  -0.735
  323    HA   CYS  44           HA       CYS  44   0.440  -2.539  -0.213
  324    HB2  CYS  44          2HB       CYS  44   0.022  -2.137   2.147
  325    HB3  CYS  44          3HB       CYS  44  -0.122  -0.626   1.254
  326    H    LYS  45           HN       LYS  45   0.291  -4.368   1.403
  327    HA   LYS  45           HA       LYS  45  -1.457  -6.362   0.372
  328    HB2  LYS  45          2HB       LYS  45  -0.136  -6.867   2.967
  329    HB3  LYS  45          3HB       LYS  45  -0.161  -7.845   1.506
  330    HG2  LYS  45          2HG       LYS  45   1.407  -6.047   0.537
  331    HG3  LYS  45          3HG       LYS  45   1.649  -5.575   2.221
  332    HD2  LYS  45          2HD       LYS  45   3.347  -7.092   1.986
  333    HD3  LYS  45          3HD       LYS  45   2.054  -8.164   2.528
  334    HE2  LYS  45          2HE       LYS  45   1.548  -8.527   0.057
  335    HE3  LYS  45          3HE       LYS  45   3.100  -7.755  -0.260
  336    HZ1  LYS  45          1HZ       LYS  45   2.906 -10.335   0.011
  337    HZ2  LYS  45          2HZ       LYS  45   3.012  -9.968   1.659
  338    HZ3  LYS  45          3HZ       LYS  45   4.253  -9.502   0.608
  339    H    VAL  46           HN       VAL  46  -1.927  -3.939   2.630
  340    HA   VAL  46           HA       VAL  46  -3.894  -5.448   4.184
  341    HB   VAL  46           HB       VAL  46  -3.128  -2.558   4.570
  342   HG11  VAL  46          1HG1      VAL  46  -3.765  -3.493   7.004
  343   HG12  VAL  46          2HG1      VAL  46  -4.944  -2.780   5.901
  344   HG13  VAL  46          3HG1      VAL  46  -4.785  -4.533   6.010
  345   HG21  VAL  46          1HG2      VAL  46  -1.925  -4.215   6.532
  346   HG22  VAL  46          2HG2      VAL  46  -1.487  -4.850   4.945
  347   HG23  VAL  46          3HG2      VAL  46  -1.140  -3.168   5.349
  348    H    CYS  47           HN       CYS  47  -3.684  -3.270   1.557
  349    HA   CYS  47           HA       CYS  47  -6.513  -2.527   1.798
  350    HB2  CYS  47          2HB       CYS  47  -4.229  -1.409   0.183
  351    HB3  CYS  47          3HB       CYS  47  -5.902  -0.998  -0.178
  352    H    ALA  48           HN       ALA  48  -4.238  -4.278  -0.196
  353    HA   ALA  48           HA       ALA  48  -6.151  -4.760  -2.307
  354    HB1  ALA  48          1HB       ALA  48  -3.455  -6.035  -1.872
  355    HB2  ALA  48          2HB       ALA  48  -4.409  -6.052  -3.356
  356    HB3  ALA  48          3HB       ALA  48  -3.730  -4.537  -2.760
  357    H    LYS  49           HN       LYS  49  -5.232  -6.236   0.657
  358    HA   LYS  49           HA       LYS  49  -7.033  -8.479   0.080
  359    HB2  LYS  49          2HB       LYS  49  -4.185  -8.630   0.613
  360    HB3  LYS  49          3HB       LYS  49  -5.109  -9.526   1.812
  361    HG2  LYS  49          2HG       LYS  49  -5.669 -11.132   0.360
  362    HG3  LYS  49          3HG       LYS  49  -5.960  -9.986  -0.950
  363    HD2  LYS  49          2HD       LYS  49  -3.429  -9.754  -1.094
  364    HD3  LYS  49          3HD       LYS  49  -3.348 -11.180  -0.058
  365    HE2  LYS  49          2HE       LYS  49  -4.175 -10.925  -2.890
  366    HE3  LYS  49          3HE       LYS  49  -3.286 -12.215  -2.081
  367    HZ1  LYS  49          1HZ       LYS  49  -6.210 -11.724  -1.943
  368    HZ2  LYS  49          2HZ       LYS  49  -5.394 -12.892  -1.031
  369    HZ3  LYS  49          3HZ       LYS  49  -5.436 -13.014  -2.718
  370    H    GLU  50           HN       GLU  50  -8.566  -8.664   1.572
  371    HA   GLU  50           HA       GLU  50  -8.524  -7.031   3.926
  372    HB2  GLU  50          2HB       GLU  50 -10.466  -8.762   2.541
  373    HB3  GLU  50          3HB       GLU  50 -10.659  -8.679   4.287
  374    HG2  GLU  50          2HG       GLU  50 -12.049  -7.011   3.359
  375    HG3  GLU  50          3HG       GLU  50 -10.668  -6.185   4.078
  376    H    ILE  51           HN       ILE  51  -6.605  -7.925   4.928
  377    HA   ILE  51           HA       ILE  51  -6.997 -10.565   6.155
  378    HB   ILE  51           HB       ILE  51  -4.879 -10.127   4.873
  379   HG12  ILE  51          2HG1      ILE  51  -3.528 -10.720   7.224
  380   HG13  ILE  51          3HG1      ILE  51  -5.183 -11.213   7.564
  381   HG21  ILE  51          1HG2      ILE  51  -4.856  -7.747   6.210
  382   HG22  ILE  51          2HG2      ILE  51  -3.660  -8.683   7.105
  383   HG23  ILE  51          3HG2      ILE  51  -3.476  -8.451   5.366
  384   HD11  ILE  51          1HD1      ILE  51  -3.350 -12.201   5.410
  385   HD12  ILE  51          2HD1      ILE  51  -4.126 -13.113   6.705
  386   HD13  ILE  51          3HD1      ILE  51  -5.090 -12.482   5.370
  387    H    GLU  52           HN       GLU  52  -7.077  -7.235   6.824
  388    HA   GLU  52           HA       GLU  52  -7.176  -7.811   9.706
  389    HB2  GLU  52          2HB       GLU  52  -5.144  -6.383   8.539
  390    HB3  GLU  52          3HB       GLU  52  -6.260  -5.110   9.013
  391    HG2  GLU  52          2HG       GLU  52  -6.042  -5.566  11.258
  392    HG3  GLU  52          3HG       GLU  52  -5.518  -7.225  10.978
  393    H    LEU  53           HN       LEU  53  -8.818  -6.871  10.815
  394    HA   LEU  53           HA       LEU  53 -10.785  -5.396   9.225
  395    HB2  LEU  53          2HB       LEU  53 -11.071  -6.661  11.945
  396    HB3  LEU  53          3HB       LEU  53 -12.367  -5.949  10.985
  397    HG   LEU  53           HG       LEU  53 -10.801  -8.254   9.898
  398   HD11  LEU  53          1HD1      LEU  53 -13.135  -9.292  11.034
  399   HD12  LEU  53          2HD1      LEU  53 -12.385  -8.314  12.296
  400   HD13  LEU  53          3HD1      LEU  53 -11.469  -9.608  11.522
  401   HD21  LEU  53          1HD2      LEU  53 -13.728  -7.844   9.585
  402   HD22  LEU  53          2HD2      LEU  53 -12.547  -8.494   8.448
  403   HD23  LEU  53          3HD2      LEU  53 -12.636  -6.755   8.730
  Start of MODEL   15
    1    H1   SER   1           HN       SER   1   7.972   8.430  10.336
    2    HA   SER   1           HA       SER   1   7.901  10.949  10.590
    3    HB2  SER   1          2HB       SER   1   9.673  10.280  12.949
    4    HB3  SER   1          3HB       SER   1   9.150  11.883  12.434
    5    HG   SER   1           HG       SER   1   7.652  11.488  13.885
    6    H    ASP   2           HN       ASP   2  10.003   8.299  10.414
    7    HA   ASP   2           HA       ASP   2  12.108   9.932   9.163
    8    HB2  ASP   2          2HB       ASP   2  12.280   7.106  10.231
    9    HB3  ASP   2          3HB       ASP   2  13.611   8.030   9.540
   10    H    ARG   3           HN       ARG   3   9.464   8.242   8.330
   11    HA   ARG   3           HA       ARG   3   8.721   7.625   6.243
   12    HB2  ARG   3          2HB       ARG   3  11.533   7.557   5.195
   13    HB3  ARG   3          3HB       ARG   3  10.037   7.876   4.327
   14    HG2  ARG   3          2HG       ARG   3  10.368   9.869   6.334
   15    HG3  ARG   3          3HG       ARG   3  11.865   9.729   5.412
   16    HD2  ARG   3          2HD       ARG   3  10.323   9.775   3.342
   17    HD3  ARG   3          3HD       ARG   3   9.110  10.413   4.452
   18    HE   ARG   3           HE       ARG   3  11.382  11.800   3.393
   19   HH11  ARG   3          1HH1      ARG   3   9.172  11.606   6.077
   20   HH12  ARG   3          2HH1      ARG   3   9.384  13.262   6.540
   21   HH21  ARG   3          1HH2      ARG   3  11.669  13.983   3.993
   22   HH22  ARG   3          2HH2      ARG   3  10.803  14.614   5.354
   23    H    THR   4           HN       THR   4   8.601   5.719   7.858
   24    HA   THR   4           HA       THR   4  10.173   3.461   6.805
   25    HB   THR   4           HB       THR   4   8.789   2.868   9.281
   26    HG1  THR   4          1HG       THR   4   9.124   5.078   9.728
   27   HG21  THR   4          1HG2      THR   4  11.076   2.212   9.973
   28   HG22  THR   4          2HG2      THR   4  11.699   2.904   8.475
   29   HG23  THR   4          3HG2      THR   4  10.607   1.520   8.421
   30    H    CYS   5           HN       CYS   5   9.133   1.554   6.255
   31    HA   CYS   5           HA       CYS   5   6.737   1.617   4.979
   32    HB2  CYS   5          2HB       CYS   5   8.456  -0.275   5.064
   33    HB3  CYS   5          3HB       CYS   5   7.612  -0.830   6.506
   34    H    ALA   6           HN       ALA   6   4.599   0.969   5.454
   35    HA   ALA   6           HA       ALA   6   3.839   1.476   8.237
   36    HB1  ALA   6          1HB       ALA   6   2.837   2.832   6.386
   37    HB2  ALA   6          2HB       ALA   6   2.027   1.365   5.835
   38    HB3  ALA   6          3HB       ALA   6   1.666   2.027   7.429
   39    H    ARG   7           HN       ARG   7   4.780  -1.133   6.818
   40    HA   ARG   7           HA       ARG   7   2.760  -2.822   8.106
   41    HB2  ARG   7          2HB       ARG   7   3.924  -3.413   5.380
   42    HB3  ARG   7          3HB       ARG   7   2.744  -4.383   6.251
   43    HG2  ARG   7          2HG       ARG   7   2.235  -1.555   5.367
   44    HG3  ARG   7          3HG       ARG   7   1.819  -2.973   4.404
   45    HD2  ARG   7          2HD       ARG   7   0.741  -2.178   7.098
   46    HD3  ARG   7          3HD       ARG   7  -0.142  -2.337   5.581
   47    HE   ARG   7           HE       ARG   7   0.769  -4.825   5.937
   48   HH11  ARG   7          1HH1      ARG   7  -0.817  -2.619   8.115
   49   HH12  ARG   7          2HH1      ARG   7  -1.574  -3.872   9.041
   50   HH21  ARG   7          1HH2      ARG   7  -0.223  -6.484   7.149
   51   HH22  ARG   7          2HH2      ARG   7  -1.234  -6.070   8.491
   52    H    CYS   8           HN       CYS   8   6.007  -2.501   6.771
   53    HA   CYS   8           HA       CYS   8   6.887  -4.688   8.541
   54    HB2  CYS   8          2HB       CYS   8   8.703  -5.117   7.010
   55    HB3  CYS   8          3HB       CYS   8   7.195  -5.111   6.102
   56    H    GLN   9           HN       GLN   9   6.873  -1.400   8.187
   57    HA   GLN   9           HA       GLN   9   8.104   0.329   9.021
   58    HB2  GLN   9          2HB       GLN   9   8.209  -1.835  11.035
   59    HB3  GLN   9          3HB       GLN   9   9.376  -0.535  11.243
   60    HG2  GLN   9          2HG       GLN   9   6.622   0.331  10.707
   61    HG3  GLN   9          3HG       GLN   9   6.867  -0.515  12.234
   62   HE21  GLN   9          1HE2      GLN   9   7.057   2.421  10.642
   63   HE22  GLN   9          2HE2      GLN   9   7.961   3.300  11.821
   64    H    GLU  10           HN       GLU  10   9.420  -0.431   6.936
   65    HA   GLU  10           HA       GLU  10  12.206  -0.896   7.771
   66    HB2  GLU  10          2HB       GLU  10  10.689  -1.614   5.289
   67    HB3  GLU  10          3HB       GLU  10  12.432  -1.398   5.210
   68    HG2  GLU  10          2HG       GLU  10  12.716  -3.111   6.933
   69    HG3  GLU  10          3HG       GLU  10  10.969  -3.335   6.990
   70    H    SER  11           HN       SER  11  13.875   0.288   6.663
   71    HA   SER  11           HA       SER  11  13.323   3.049   6.470
   72    HB2  SER  11          2HB       SER  11  15.737   2.909   5.308
   73    HB3  SER  11          3HB       SER  11  15.516   2.757   7.051
   74    HG   SER  11           HG       SER  11  16.805   1.068   6.228
   75    H    LEU  12           HN       LEU  12  12.694   4.273   4.814
   76    HA   LEU  12           HA       LEU  12  12.342   3.007   2.207
   77    HB2  LEU  12          2HB       LEU  12  11.255   5.497   3.481
   78    HB3  LEU  12          3HB       LEU  12  11.110   5.215   1.747
   79    HG   LEU  12           HG       LEU  12   9.127   4.616   3.278
   80   HD11  LEU  12          1HD1      LEU  12  10.290   2.816   1.175
   81   HD12  LEU  12          2HD1      LEU  12   9.011   4.019   1.013
   82   HD13  LEU  12          3HD1      LEU  12   8.706   2.523   1.895
   83   HD21  LEU  12          1HD2      LEU  12  10.675   2.069   3.644
   84   HD22  LEU  12          2HD2      LEU  12   9.162   2.559   4.405
   85   HD23  LEU  12          3HD2      LEU  12  10.673   3.347   4.859
   86    H    GLY  13           HN       GLY  13  14.854   4.371   3.555
   87    HA2  GLY  13          1HA       GLY  13  15.774   6.576   2.343
   88    HA3  GLY  13          2HA       GLY  13  16.793   5.159   2.546
   89    H    ARG  14           HN       ARG  14  17.171   3.791   0.796
   90    HA   ARG  14           HA       ARG  14  16.976   5.069  -1.771
   91    HB2  ARG  14          2HB       ARG  14  18.392   3.355  -2.572
   92    HB3  ARG  14          3HB       ARG  14  18.939   3.686  -0.934
   93    HG2  ARG  14          2HG       ARG  14  18.647   1.568  -0.371
   94    HG3  ARG  14          3HG       ARG  14  16.952   1.639  -0.856
   95    HD2  ARG  14          2HD       ARG  14  17.344   0.637  -2.835
   96    HD3  ARG  14          3HD       ARG  14  18.879   1.474  -3.069
   97    HE   ARG  14           HE       ARG  14  19.906  -0.404  -2.306
   98   HH11  ARG  14          1HH1      ARG  14  16.696  -0.300  -0.964
   99   HH12  ARG  14          2HH1      ARG  14  16.850  -1.818  -0.142
  100   HH21  ARG  14          1HH2      ARG  14  20.121  -2.403  -1.230
  101   HH22  ARG  14          2HH2      ARG  14  18.798  -3.013  -0.295
  102    H    LEU  15           HN       LEU  15  14.429   4.698  -0.939
  103    HA   LEU  15           HA       LEU  15  13.472   2.578  -2.740
  104    HB2  LEU  15          2HB       LEU  15  13.223   2.027  -0.292
  105    HB3  LEU  15          3HB       LEU  15  12.096   3.378  -0.185
  106    HG   LEU  15           HG       LEU  15  10.430   2.252  -1.266
  107   HD11  LEU  15          1HD1      LEU  15  11.509   1.874  -3.353
  108   HD12  LEU  15          2HD1      LEU  15  10.852   0.332  -2.810
  109   HD13  LEU  15          3HD1      LEU  15  12.577   0.660  -2.649
  110   HD21  LEU  15          1HD2      LEU  15  10.397   0.850   0.495
  111   HD22  LEU  15          2HD2      LEU  15  12.106   0.440   0.339
  112   HD23  LEU  15          3HD2      LEU  15  10.911  -0.342  -0.698
  113    H    SER  16           HN       SER  16  13.590   5.814  -2.074
  114    HA   SER  16           HA       SER  16  12.441   7.652  -2.774
  115    HB2  SER  16          2HB       SER  16  11.685   5.653  -4.907
  116    HB3  SER  16          3HB       SER  16  11.213   7.350  -4.986
  117    HG   SER  16           HG       SER  16  13.895   6.803  -4.494
  118    HA   PRO  17           HA       PRO  17   8.573   6.286  -0.642
  119    HB2  PRO  17          2HB       PRO  17   8.623   8.281   1.198
  120    HB3  PRO  17          3HB       PRO  17   9.493   6.757   1.410
  121    HG2  PRO  17          2HG       PRO  17  10.522   9.412   0.487
  122    HG3  PRO  17          3HG       PRO  17  11.253   8.260   1.619
  123    HD2  PRO  17          2HD       PRO  17  12.035   8.456  -0.966
  124    HD3  PRO  17          3HD       PRO  17  12.072   6.923  -0.072
  125    H    LYS  18           HN       LYS  18   9.537   8.757  -2.616
  126    HA   LYS  18           HA       LYS  18   7.337  10.565  -2.257
  127    HB2  LYS  18          2HB       LYS  18   8.750  10.554  -4.850
  128    HB3  LYS  18          3HB       LYS  18   8.394  11.892  -3.766
  129    HG2  LYS  18          2HG       LYS  18  10.682   9.960  -3.662
  130    HG3  LYS  18          3HG       LYS  18  10.723  11.721  -3.775
  131    HD2  LYS  18          2HD       LYS  18   9.330  11.267  -1.439
  132    HD3  LYS  18          3HD       LYS  18  10.559   9.999  -1.430
  133    HE2  LYS  18          2HE       LYS  18  10.986  12.974  -1.647
  134    HE3  LYS  18          3HE       LYS  18  11.460  11.916  -0.319
  135    HZ1  LYS  18          1HZ       LYS  18  13.334  12.474  -1.746
  136    HZ2  LYS  18          2HZ       LYS  18  12.547  11.796  -3.080
  137    HZ3  LYS  18          3HZ       LYS  18  13.017  10.812  -1.786
  138    H    THR  19           HN       THR  19   7.388   7.504  -3.346
  139    HA   THR  19           HA       THR  19   4.915   7.856  -4.820
  140    HB   THR  19           HB       THR  19   5.581   7.235  -6.874
  141    HG1  THR  19          1HG       THR  19   6.102   5.166  -6.729
  142   HG21  THR  19          1HG2      THR  19   7.174   8.992  -6.482
  143   HG22  THR  19          2HG2      THR  19   7.976   7.715  -7.397
  144   HG23  THR  19          3HG2      THR  19   8.270   7.877  -5.666
  145    H    ASN  20           HN       ASN  20   6.183   6.520  -2.348
  146    HA   ASN  20           HA       ASN  20   5.095   3.823  -2.827
  147    HB2  ASN  20          2HB       ASN  20   7.325   4.772  -1.038
  148    HB3  ASN  20          3HB       ASN  20   6.522   3.229  -0.767
  149   HD21  ASN  20          1HD2      ASN  20   9.280   4.114  -1.692
  150   HD22  ASN  20          2HD2      ASN  20   9.573   3.144  -3.091
  151    H    THR  21           HN       THR  21   3.675   6.299  -2.029
  152    HA   THR  21           HA       THR  21   2.807   5.581   0.685
  153    HB   THR  21           HB       THR  21   2.142   8.094  -0.858
  154    HG1  THR  21          1HG       THR  21   4.416   7.861  -0.352
  155   HG21  THR  21          1HG2      THR  21   0.550   8.063   0.781
  156   HG22  THR  21          2HG2      THR  21   1.873   8.786   1.696
  157   HG23  THR  21          3HG2      THR  21   1.525   7.065   1.860
  158    H    CYS  22           HN       CYS  22   1.294   4.019   0.495
  159    HA   CYS  22           HA       CYS  22  -0.424   3.383  -1.472
  160    HB2  CYS  22          2HB       CYS  22  -0.221   2.277   0.792
  161    HB3  CYS  22          3HB       CYS  22  -1.324   3.503   1.410
  162    H    ARG  23           HN       ARG  23  -2.354   4.048  -2.315
  163    HA   ARG  23           HA       ARG  23  -3.141   6.787  -1.676
  164    HB2  ARG  23          2HB       ARG  23  -3.918   6.967  -3.815
  165    HB3  ARG  23          3HB       ARG  23  -2.739   5.687  -4.066
  166    HG2  ARG  23          2HG       ARG  23  -4.455   4.012  -3.996
  167    HG3  ARG  23          3HG       ARG  23  -5.667   5.216  -3.553
  168    HD2  ARG  23          2HD       ARG  23  -5.003   6.376  -5.754
  169    HD3  ARG  23          3HD       ARG  23  -4.253   4.835  -6.171
  170    HE   ARG  23           HE       ARG  23  -6.959   4.529  -5.311
  171   HH11  ARG  23          1HH1      ARG  23  -4.945   5.371  -8.022
  172   HH12  ARG  23          2HH1      ARG  23  -6.124   4.912  -9.207
  173   HH21  ARG  23          1HH2      ARG  23  -8.518   3.920  -6.861
  174   HH22  ARG  23          2HH2      ARG  23  -8.156   4.088  -8.545
  175    H    GLY  24           HN       GLY  24  -3.930   3.858  -0.534
  176    HA2  GLY  24          1HA       GLY  24  -6.825   4.351  -0.431
  177    HA3  GLY  24          2HA       GLY  24  -6.028   2.837  -0.029
  178    H    CYS  25           HN       CYS  25  -3.978   4.193   1.594
  179    HA   CYS  25           HA       CYS  25  -5.654   4.951   3.899
  180    HB2  CYS  25          2HB       CYS  25  -3.717   3.934   5.267
  181    HB3  CYS  25          3HB       CYS  25  -4.847   2.832   4.487
  182    H    ASN  26           HN       ASN  26  -2.844   5.580   1.978
  183    HA   ASN  26           HA       ASN  26  -1.670   7.549   1.772
  184    HB2  ASN  26          2HB       ASN  26  -2.757   8.551   4.387
  185    HB3  ASN  26          3HB       ASN  26  -2.233   9.472   2.982
  186   HD21  ASN  26          1HD2      ASN  26  -4.497  10.292   3.889
  187   HD22  ASN  26          2HD2      ASN  26  -5.846   9.722   2.972
  188    H    HIS  27           HN       HIS  27  -0.926   5.109   3.247
  189    HA   HIS  27           HA       HIS  27   1.069   6.236   5.096
  190    HB2  HIS  27          2HB       HIS  27  -0.063   3.434   4.973
  191    HB3  HIS  27          3HB       HIS  27   1.190   3.970   6.088
  192    HD1  HIS  27          1HD       HIS  27   0.032   6.572   7.116
  193    HD2  HIS  27          2HD       HIS  27  -2.237   3.137   6.559
  194    HE1  HIS  27          1HE       HIS  27  -1.964   6.832   8.624
  195    H    LEU  28           HN       LEU  28   3.171   5.098   5.149
  196    HA   LEU  28           HA       LEU  28   4.186   4.796   2.479
  197    HB2  LEU  28          2HB       LEU  28   5.399   4.729   5.217
  198    HB3  LEU  28          3HB       LEU  28   6.334   4.244   3.804
  199    HG   LEU  28           HG       LEU  28   5.221   6.962   4.456
  200   HD11  LEU  28          1HD1      LEU  28   7.437   7.660   4.543
  201   HD12  LEU  28          2HD1      LEU  28   8.020   6.250   3.659
  202   HD13  LEU  28          3HD1      LEU  28   7.475   6.082   5.328
  203   HD21  LEU  28          1HD2      LEU  28   4.810   7.131   2.249
  204   HD22  LEU  28          2HD2      LEU  28   5.839   5.758   1.841
  205   HD23  LEU  28          3HD2      LEU  28   6.558   7.340   2.142
  206    H    VAL  29           HN       VAL  29   4.980   2.969   1.499
  207    HA   VAL  29           HA       VAL  29   5.046   0.442   2.902
  208    HB   VAL  29           HB       VAL  29   3.527  -0.129   0.576
  209   HG11  VAL  29          1HG1      VAL  29   2.386  -1.470   2.001
  210   HG12  VAL  29          2HG1      VAL  29   3.751  -1.107   3.059
  211   HG13  VAL  29          3HG1      VAL  29   2.236  -0.219   3.233
  212   HG21  VAL  29          1HG2      VAL  29   1.468   1.074   0.977
  213   HG22  VAL  29          2HG2      VAL  29   2.195   1.927   2.339
  214   HG23  VAL  29          3HG2      VAL  29   2.778   2.222   0.701
  215    H    CYS  30           HN       CYS  30   6.951  -0.324   2.278
  216    HA   CYS  30           HA       CYS  30   8.469   0.436   0.121
  217    HB2  CYS  30          2HB       CYS  30   9.783  -1.567   0.466
  218    HB3  CYS  30          3HB       CYS  30   9.272  -0.941   2.030
  219    H    ARG  31           HN       ARG  31   9.224  -1.341  -1.589
  220    HA   ARG  31           HA       ARG  31   6.919  -1.734  -3.291
  221    HB2  ARG  31          2HB       ARG  31   8.592  -2.439  -4.977
  222    HB3  ARG  31          3HB       ARG  31   8.938  -0.857  -4.294
  223    HG2  ARG  31          2HG       ARG  31  10.584  -1.927  -2.779
  224    HG3  ARG  31          3HG       ARG  31  10.293  -3.456  -3.613
  225    HD2  ARG  31          2HD       ARG  31  11.344  -2.766  -5.531
  226    HD3  ARG  31          3HD       ARG  31  10.998  -1.063  -5.236
  227    HE   ARG  31           HE       ARG  31  12.731  -1.749  -3.249
  228   HH11  ARG  31          1HH1      ARG  31  12.784  -1.949  -6.724
  229   HH12  ARG  31          2HH1      ARG  31  14.504  -1.774  -6.838
  230   HH21  ARG  31          1HH2      ARG  31  14.996  -1.518  -3.385
  231   HH22  ARG  31          2HH2      ARG  31  15.761  -1.529  -4.939
  232    H    ASP  32           HN       ASP  32   7.444  -3.385  -0.809
  233    HA   ASP  32           HA       ASP  32   7.242  -6.022  -2.108
  234    HB2  ASP  32          2HB       ASP  32   9.341  -5.436  -0.617
  235    HB3  ASP  32          3HB       ASP  32   8.228  -5.786   0.704
  236    H    CYS  33           HN       CYS  33   5.962  -3.752   0.145
  237    HA   CYS  33           HA       CYS  33   4.045  -5.695   1.201
  238    HB2  CYS  33          2HB       CYS  33   4.750  -2.868   1.983
  239    HB3  CYS  33          3HB       CYS  33   3.351  -3.706   2.644
  240    H    ARG  34           HN       ARG  34   4.190  -4.195  -1.549
  241    HA   ARG  34           HA       ARG  34   1.453  -3.122  -1.520
  242    HB2  ARG  34          2HB       ARG  34   2.925  -2.777  -4.008
  243    HB3  ARG  34          3HB       ARG  34   2.118  -1.579  -3.005
  244    HG2  ARG  34          2HG       ARG  34   4.062  -1.428  -1.568
  245    HG3  ARG  34          3HG       ARG  34   4.868  -2.694  -2.497
  246    HD2  ARG  34          2HD       ARG  34   3.922  -0.117  -3.726
  247    HD3  ARG  34          3HD       ARG  34   5.531  -0.308  -3.030
  248    HE   ARG  34           HE       ARG  34   5.341  -2.379  -4.770
  249   HH11  ARG  34          1HH1      ARG  34   4.862   1.058  -5.051
  250   HH12  ARG  34          2HH1      ARG  34   5.347   1.122  -6.713
  251   HH21  ARG  34          1HH2      ARG  34   5.981  -2.307  -6.958
  252   HH22  ARG  34          2HH2      ARG  34   5.982  -0.794  -7.797
  253    H    ILE  35           HN       ILE  35  -0.007  -3.707  -3.215
  254    HA   ILE  35           HA       ILE  35   0.580  -6.346  -4.393
  255    HB   ILE  35           HB       ILE  35  -1.900  -5.277  -3.119
  256   HG12  ILE  35          2HG1      ILE  35  -1.964  -7.722  -2.372
  257   HG13  ILE  35          3HG1      ILE  35  -0.361  -7.870  -3.083
  258   HG21  ILE  35          1HG2      ILE  35  -2.885  -5.785  -5.153
  259   HG22  ILE  35          2HG2      ILE  35  -1.783  -7.125  -5.466
  260   HG23  ILE  35          3HG2      ILE  35  -3.057  -7.295  -4.258
  261   HD11  ILE  35          1HD1      ILE  35  -0.837  -5.681  -1.138
  262   HD12  ILE  35          2HD1      ILE  35  -0.695  -7.333  -0.536
  263   HD13  ILE  35          3HD1      ILE  35   0.623  -6.614  -1.461
  264    H    GLN  36           HN       GLN  36   1.036  -6.023  -6.478
  265    HA   GLN  36           HA       GLN  36   0.329  -3.888  -8.072
  266    HB2  GLN  36          2HB       GLN  36   1.391  -6.572  -8.495
  267    HB3  GLN  36          3HB       GLN  36   0.432  -6.003  -9.855
  268    HG2  GLN  36          2HG       GLN  36   2.912  -4.793  -8.683
  269    HG3  GLN  36          3HG       GLN  36   2.639  -5.374 -10.325
  270   HE21  GLN  36          1HE2      GLN  36   0.126  -4.175 -10.741
  271   HE22  GLN  36          2HE2      GLN  36   0.359  -2.468 -10.855
  272    H    GLU  37           HN       GLU  37  -1.665  -3.153  -8.412
  273    HA   GLU  37           HA       GLU  37  -3.951  -4.897  -8.449
  274    HB2  GLU  37          2HB       GLU  37  -3.653  -1.936  -8.963
  275    HB3  GLU  37          3HB       GLU  37  -5.196  -2.777  -8.974
  276    HG2  GLU  37          2HG       GLU  37  -3.321  -2.625  -6.625
  277    HG3  GLU  37          3HG       GLU  37  -4.755  -1.626  -6.854
  278    H    SER  38           HN       SER  38  -1.824  -3.497 -10.784
  279    HA   SER  38           HA       SER  38  -1.644  -3.760 -13.038
  280    HB2  SER  38          2HB       SER  38  -2.408  -6.153 -12.339
  281    HB3  SER  38          3HB       SER  38  -3.956  -5.679 -13.041
  282    HG   SER  38           HG       SER  38  -1.592  -5.279 -14.502
  283    H    ASN  39           HN       ASN  39  -3.994  -2.242 -11.540
  284    HA   ASN  39           HA       ASN  39  -5.651  -1.716 -13.901
  285    HB2  ASN  39          2HB       ASN  39  -7.353  -1.091 -12.496
  286    HB3  ASN  39          3HB       ASN  39  -6.498  -2.195 -11.424
  287   HD21  ASN  39          1HD2      ASN  39  -7.627   0.950 -11.883
  288   HD22  ASN  39          2HD2      ASN  39  -6.906   1.677 -10.491
  289    H    GLY  40           HN       GLY  40  -2.843  -0.634 -12.822
  290    HA2  GLY  40          1HA       GLY  40  -1.946   1.323 -14.002
  291    HA3  GLY  40          2HA       GLY  40  -3.435   2.158 -13.587
  292    H    THR  41           HN       THR  41  -3.098   0.640 -10.876
  293    HA   THR  41           HA       THR  41  -0.987   2.327  -9.734
  294    HB   THR  41           HB       THR  41  -3.306   3.393  -9.501
  295    HG1  THR  41          1HG       THR  41  -1.626   4.093  -8.190
  296   HG21  THR  41          1HG2      THR  41  -4.910   2.470  -8.171
  297   HG22  THR  41          2HG2      THR  41  -3.739   1.635  -7.150
  298   HG23  THR  41          3HG2      THR  41  -4.153   0.980  -8.734
  299    H    TRP  42           HN       TRP  42  -1.657   1.693  -7.033
  300    HA   TRP  42           HA       TRP  42  -1.643  -1.197  -6.822
  301    HB2  TRP  42          2HB       TRP  42   0.500  -1.268  -5.597
  302    HB3  TRP  42          3HB       TRP  42   0.710  -0.740  -7.264
  303    HD1  TRP  42          1HD       TRP  42   1.667   1.675  -7.668
  304    HE1  TRP  42          1HE       TRP  42   2.655   3.469  -6.110
  305    HE3  TRP  42          3HE       TRP  42   0.240  -0.284  -3.166
  306    HZ2  TRP  42          2HZ       TRP  42   2.810   3.985  -3.339
  307    HZ3  TRP  42          3HZ       TRP  42   0.847   0.922  -1.110
  308    HH2  TRP  42          2HH       TRP  42   2.107   3.012  -1.197
  309    H    ARG  43           HN       ARG  43  -1.702  -1.930  -4.567
  310    HA   ARG  43           HA       ARG  43  -2.376   0.115  -2.596
  311    HB2  ARG  43          2HB       ARG  43  -4.249  -2.024  -3.577
  312    HB3  ARG  43          3HB       ARG  43  -4.406  -1.346  -1.962
  313    HG2  ARG  43          2HG       ARG  43  -4.225   0.584  -4.189
  314    HG3  ARG  43          3HG       ARG  43  -5.697  -0.382  -4.089
  315    HD2  ARG  43          2HD       ARG  43  -5.152   0.468  -1.474
  316    HD3  ARG  43          3HD       ARG  43  -4.878   1.872  -2.504
  317    HE   ARG  43           HE       ARG  43  -7.140   2.049  -2.612
  318   HH11  ARG  43          1HH1      ARG  43  -6.330  -1.324  -2.313
  319   HH12  ARG  43          2HH1      ARG  43  -7.976  -1.858  -2.364
  320   HH21  ARG  43          1HH2      ARG  43  -9.313   1.357  -2.680
  321   HH22  ARG  43          2HH2      ARG  43  -9.673  -0.332  -2.574
  322    H    CYS  44           HN       CYS  44  -1.653  -0.380  -0.614
  323    HA   CYS  44           HA       CYS  44   0.151  -2.359  -0.090
  324    HB2  CYS  44          2HB       CYS  44  -0.176  -1.923   2.262
  325    HB3  CYS  44          3HB       CYS  44  -0.335  -0.406   1.383
  326    H    LYS  45           HN       LYS  45  -0.096  -4.168   1.561
  327    HA   LYS  45           HA       LYS  45  -1.939  -6.075   0.528
  328    HB2  LYS  45          2HB       LYS  45  -0.616  -6.600   3.129
  329    HB3  LYS  45          3HB       LYS  45  -0.753  -7.627   1.708
  330    HG2  LYS  45          2HG       LYS  45   0.900  -5.926   0.647
  331    HG3  LYS  45          3HG       LYS  45   1.251  -5.504   2.325
  332    HD2  LYS  45          2HD       LYS  45   2.826  -7.152   1.830
  333    HD3  LYS  45          3HD       LYS  45   1.554  -8.037   2.675
  334    HE2  LYS  45          2HE       LYS  45   0.601  -8.602   0.415
  335    HE3  LYS  45          3HE       LYS  45   2.068  -7.925  -0.291
  336    HZ1  LYS  45          1HZ       LYS  45   3.234  -9.561   1.315
  337    HZ2  LYS  45          2HZ       LYS  45   2.579 -10.147  -0.130
  338    HZ3  LYS  45          3HZ       LYS  45   1.744 -10.362   1.326
  339    H    VAL  46           HN       VAL  46  -2.365  -3.590   2.676
  340    HA   VAL  46           HA       VAL  46  -4.364  -4.997   4.290
  341    HB   VAL  46           HB       VAL  46  -3.508  -2.122   4.592
  342   HG11  VAL  46          1HG1      VAL  46  -5.403  -3.848   5.914
  343   HG12  VAL  46          2HG1      VAL  46  -4.196  -3.242   7.050
  344   HG13  VAL  46          3HG1      VAL  46  -5.151  -2.111   6.090
  345   HG21  VAL  46          1HG2      VAL  46  -1.950  -2.858   6.310
  346   HG22  VAL  46          2HG2      VAL  46  -2.363  -4.542   5.986
  347   HG23  VAL  46          3HG2      VAL  46  -1.541  -3.583   4.755
  348    H    CYS  47           HN       CYS  47  -4.079  -2.890   1.608
  349    HA   CYS  47           HA       CYS  47  -6.904  -2.107   1.804
  350    HB2  CYS  47          2HB       CYS  47  -4.578  -0.987   0.250
  351    HB3  CYS  47          3HB       CYS  47  -6.242  -0.563  -0.141
  352    H    ALA  48           HN       ALA  48  -4.602  -3.894  -0.111
  353    HA   ALA  48           HA       ALA  48  -6.496  -4.358  -2.261
  354    HB1  ALA  48          1HB       ALA  48  -4.693  -5.692  -3.263
  355    HB2  ALA  48          2HB       ALA  48  -4.155  -4.069  -2.829
  356    HB3  ALA  48          3HB       ALA  48  -3.719  -5.444  -1.814
  357    H    LYS  49           HN       LYS  49  -5.579  -5.815   0.697
  358    HA   LYS  49           HA       LYS  49  -7.240  -8.152   0.049
  359    HB2  LYS  49          2HB       LYS  49  -4.541  -8.138   1.390
  360    HB3  LYS  49          3HB       LYS  49  -5.665  -9.479   1.560
  361    HG2  LYS  49          2HG       LYS  49  -5.460 -10.106  -0.653
  362    HG3  LYS  49          3HG       LYS  49  -4.891  -8.513  -1.158
  363    HD2  LYS  49          2HD       LYS  49  -3.016  -9.974  -1.231
  364    HD3  LYS  49          3HD       LYS  49  -2.810  -8.946   0.189
  365    HE2  LYS  49          2HE       LYS  49  -4.277 -11.195   1.032
  366    HE3  LYS  49          3HE       LYS  49  -2.966 -11.805   0.022
  367    HZ1  LYS  49          1HZ       LYS  49  -2.862 -10.565   2.629
  368    HZ2  LYS  49          2HZ       LYS  49  -1.700  -9.992   1.542
  369    HZ3  LYS  49          3HZ       LYS  49  -1.783 -11.644   1.900
  370    H    GLU  50           HN       GLU  50  -8.599  -6.319   1.180
  371    HA   GLU  50           HA       GLU  50  -9.493  -7.285   3.607
  372    HB2  GLU  50          2HB       GLU  50  -7.903  -6.606   5.043
  373    HB3  GLU  50          3HB       GLU  50  -7.175  -5.529   3.860
  374    HG2  GLU  50          2HG       GLU  50  -7.956  -4.321   5.825
  375    HG3  GLU  50          3HG       GLU  50  -8.812  -3.817   4.369
  376    H    ILE  51           HN       ILE  51  -8.847  -4.157   2.036
  377    HA   ILE  51           HA       ILE  51 -10.203  -2.292   1.867
  378    HB   ILE  51           HB       ILE  51 -10.744  -3.328  -0.173
  379   HG12  ILE  51          2HG1      ILE  51 -12.956  -2.601  -0.587
  380   HG13  ILE  51          3HG1      ILE  51 -13.475  -2.980   1.052
  381   HG21  ILE  51          1HG2      ILE  51 -10.989  -5.606   0.666
  382   HG22  ILE  51          2HG2      ILE  51 -12.561  -5.192   1.349
  383   HG23  ILE  51          3HG2      ILE  51 -12.327  -5.175  -0.399
  384   HD11  ILE  51          1HD1      ILE  51 -11.341  -0.972   0.837
  385   HD12  ILE  51          2HD1      ILE  51 -12.910  -0.503   0.181
  386   HD13  ILE  51          3HD1      ILE  51 -12.774  -1.011   1.864
  387    H    GLU  52           HN       GLU  52 -10.673  -1.706   3.991
  388    HA   GLU  52           HA       GLU  52 -12.873  -2.909   5.407
  389    HB2  GLU  52          2HB       GLU  52 -10.796  -1.934   6.483
  390    HB3  GLU  52          3HB       GLU  52 -11.441  -0.344   6.099
  391    HG2  GLU  52          2HG       GLU  52 -13.012  -0.434   7.715
  392    HG3  GLU  52          3HG       GLU  52 -13.248  -2.172   7.544
  393    H    LEU  53           HN       LEU  53 -12.244   0.283   3.963
  394    HA   LEU  53           HA       LEU  53 -14.856   1.281   4.455
  395    HB2  LEU  53          2HB       LEU  53 -12.547   2.138   2.767
  396    HB3  LEU  53          3HB       LEU  53 -14.112   2.919   2.564
  397    HG   LEU  53           HG       LEU  53 -13.670   3.015   5.298
  398   HD11  LEU  53          1HD1      LEU  53 -11.388   2.373   5.141
  399   HD12  LEU  53          2HD1      LEU  53 -11.421   4.115   5.409
  400   HD13  LEU  53          3HD1      LEU  53 -11.103   3.478   3.796
  401   HD21  LEU  53          1HD2      LEU  53 -13.917   5.252   4.992
  402   HD22  LEU  53          2HD2      LEU  53 -14.445   4.711   3.398
  403   HD23  LEU  53          3HD2      LEU  53 -12.800   5.305   3.629
  Start of MODEL   16
    1    H1   SER   1           HN       SER   1  10.101  12.153  12.329
    2    HA   SER   1           HA       SER   1   8.600  10.012  11.047
    3    HB2  SER   1          2HB       SER   1   8.172  11.390   9.026
    4    HB3  SER   1          3HB       SER   1   7.312  11.990  10.444
    5    HG   SER   1           HG       SER   1   8.247  13.753   9.531
    6    H    ASP   2           HN       ASP   2  10.063   8.683  10.235
    7    HA   ASP   2           HA       ASP   2  12.559   9.821   9.158
    8    HB2  ASP   2          2HB       ASP   2  12.042   7.382  10.808
    9    HB3  ASP   2          3HB       ASP   2  13.376   7.361   9.658
   10    H    ARG   3           HN       ARG   3   9.717   8.293   8.365
   11    HA   ARG   3           HA       ARG   3   8.972   7.627   6.292
   12    HB2  ARG   3          2HB       ARG   3  11.774   7.291   5.286
   13    HB3  ARG   3          3HB       ARG   3  10.320   7.722   4.398
   14    HG2  ARG   3          2HG       ARG   3  10.820   9.743   6.335
   15    HG3  ARG   3          3HG       ARG   3  12.311   9.427   5.445
   16    HD2  ARG   3          2HD       ARG   3  11.062   9.691   3.330
   17    HD3  ARG   3          3HD       ARG   3   9.618  10.091   4.260
   18    HE   ARG   3           HE       ARG   3  11.570  11.844   5.101
   19   HH11  ARG   3          1HH1      ARG   3   9.989  11.057   2.101
   20   HH12  ARG   3          2HH1      ARG   3  10.148  12.654   1.447
   21   HH21  ARG   3          1HH2      ARG   3  11.786  13.950   4.251
   22   HH22  ARG   3          2HH2      ARG   3  11.170  14.298   2.672
   23    H    THR   4           HN       THR   4   8.518   5.796   7.796
   24    HA   THR   4           HA       THR   4  10.038   3.397   6.999
   25    HB   THR   4           HB       THR   4   8.464   3.042   9.415
   26    HG1  THR   4          1HG       THR   4  10.688   4.712   9.820
   27   HG21  THR   4          1HG2      THR   4  10.877   2.444  10.213
   28   HG22  THR   4          2HG2      THR   4  11.274   2.580   8.499
   29   HG23  THR   4          3HG2      THR   4  10.064   1.414   9.035
   30    H    CYS   5           HN       CYS   5   8.910   1.577   6.396
   31    HA   CYS   5           HA       CYS   5   6.513   1.826   5.075
   32    HB2  CYS   5          2HB       CYS   5   8.136  -0.091   4.910
   33    HB3  CYS   5          3HB       CYS   5   7.457  -0.716   6.411
   34    H    ALA   6           HN       ALA   6   4.371   1.506   5.545
   35    HA   ALA   6           HA       ALA   6   3.670   1.641   8.378
   36    HB1  ALA   6          1HB       ALA   6   1.888   2.025   5.977
   37    HB2  ALA   6          2HB       ALA   6   1.511   2.417   7.655
   38    HB3  ALA   6          3HB       ALA   6   2.760   3.321   6.798
   39    H    ARG   7           HN       ARG   7   4.430  -0.843   6.730
   40    HA   ARG   7           HA       ARG   7   2.163  -2.474   7.649
   41    HB2  ARG   7          2HB       ARG   7   3.702  -3.164   5.159
   42    HB3  ARG   7          3HB       ARG   7   2.146  -3.784   5.695
   43    HG2  ARG   7          2HG       ARG   7   2.648  -0.958   4.788
   44    HG3  ARG   7          3HG       ARG   7   1.977  -2.243   3.780
   45    HD2  ARG   7          2HD       ARG   7  -0.032  -2.229   4.862
   46    HD3  ARG   7          3HD       ARG   7   0.673  -1.712   6.393
   47    HE   ARG   7           HE       ARG   7   0.708   0.274   4.292
   48   HH11  ARG   7          1HH1      ARG   7  -1.010  -1.055   7.013
   49   HH12  ARG   7          2HH1      ARG   7  -1.930   0.385   7.300
   50   HH21  ARG   7          1HH2      ARG   7  -0.497   2.174   4.661
   51   HH22  ARG   7          2HH2      ARG   7  -1.639   2.221   5.962
   52    H    CYS   8           HN       CYS   8   5.592  -2.283   6.872
   53    HA   CYS   8           HA       CYS   8   6.049  -4.624   8.605
   54    HB2  CYS   8          2HB       CYS   8   8.023  -5.147   7.304
   55    HB3  CYS   8          3HB       CYS   8   6.640  -5.016   6.221
   56    H    GLN   9           HN       GLN   9   6.536  -1.311   8.173
   57    HA   GLN   9           HA       GLN   9   7.689   0.269   9.332
   58    HB2  GLN   9          2HB       GLN   9   7.624  -2.029  11.235
   59    HB3  GLN   9          3HB       GLN   9   8.664  -0.661  11.613
   60    HG2  GLN   9          2HG       GLN   9   6.053   0.244  10.820
   61    HG3  GLN   9          3HG       GLN   9   5.938  -0.924  12.135
   62   HE21  GLN   9          1HE2      GLN   9   8.186   1.686  11.271
   63   HE22  GLN   9          2HE2      GLN   9   8.135   2.470  12.810
   64    H    GLU  10           HN       GLU  10   9.122  -0.539   7.311
   65    HA   GLU  10           HA       GLU  10  11.807  -1.127   8.372
   66    HB2  GLU  10          2HB       GLU  10  10.433  -1.897   5.838
   67    HB3  GLU  10          3HB       GLU  10  12.175  -1.656   5.803
   68    HG2  GLU  10          2HG       GLU  10  10.925  -3.429   7.859
   69    HG3  GLU  10          3HG       GLU  10  11.233  -4.018   6.227
   70    H    SER  11           HN       SER  11  13.611  -0.104   7.206
   71    HA   SER  11           HA       SER  11  13.220   2.696   6.994
   72    HB2  SER  11          2HB       SER  11  15.674   2.317   5.879
   73    HB3  SER  11          3HB       SER  11  15.379   2.385   7.616
   74    HG   SER  11           HG       SER  11  16.028   0.234   6.008
   75    H    LEU  12           HN       LEU  12  12.704   3.920   5.302
   76    HA   LEU  12           HA       LEU  12  12.226   2.664   2.741
   77    HB2  LEU  12          2HB       LEU  12  11.686   5.380   3.888
   78    HB3  LEU  12          3HB       LEU  12  11.501   5.069   2.163
   79    HG   LEU  12           HG       LEU  12   9.488   4.888   3.919
   80   HD11  LEU  12          1HD1      LEU  12   8.514   4.545   1.959
   81   HD12  LEU  12          2HD1      LEU  12   8.968   2.844   2.060
   82   HD13  LEU  12          3HD1      LEU  12  10.036   3.996   1.257
   83   HD21  LEU  12          1HD2      LEU  12  10.686   3.037   5.118
   84   HD22  LEU  12          2HD2      LEU  12  10.450   2.045   3.679
   85   HD23  LEU  12          3HD2      LEU  12   9.055   2.644   4.575
   86    H    GLY  13           HN       GLY  13  15.002   3.122   3.799
   87    HA2  GLY  13          1HA       GLY  13  16.262   5.181   2.346
   88    HA3  GLY  13          2HA       GLY  13  17.054   3.747   2.985
   89    H    ARG  14           HN       ARG  14  17.126   5.311   0.345
   90    HA   ARG  14           HA       ARG  14  17.268   4.892  -1.897
   91    HB2  ARG  14          2HB       ARG  14  18.412   2.530  -0.508
   92    HB3  ARG  14          3HB       ARG  14  18.117   2.368  -2.234
   93    HG2  ARG  14          2HG       ARG  14  19.444   4.862  -1.579
   94    HG3  ARG  14          3HG       ARG  14  20.356   3.448  -1.046
   95    HD2  ARG  14          2HD       ARG  14  19.239   3.157  -3.723
   96    HD3  ARG  14          3HD       ARG  14  20.359   4.511  -3.582
   97    HE   ARG  14           HE       ARG  14  21.059   1.799  -3.702
   98   HH11  ARG  14          1HH1      ARG  14  21.838   4.683  -1.913
   99   HH12  ARG  14          2HH1      ARG  14  23.462   4.187  -1.568
  100   HH21  ARG  14          1HH2      ARG  14  23.195   1.136  -3.254
  101   HH22  ARG  14          2HH2      ARG  14  24.233   2.170  -2.332
  102    H    LEU  15           HN       LEU  15  14.702   4.861  -1.340
  103    HA   LEU  15           HA       LEU  15  13.668   2.551  -2.838
  104    HB2  LEU  15          2HB       LEU  15  12.757   3.672  -0.243
  105    HB3  LEU  15          3HB       LEU  15  11.528   3.098  -1.367
  106    HG   LEU  15           HG       LEU  15  13.728   1.501  -0.069
  107   HD11  LEU  15          1HD1      LEU  15  12.161   0.717   1.316
  108   HD12  LEU  15          2HD1      LEU  15  10.968   0.560   0.027
  109   HD13  LEU  15          3HD1      LEU  15  11.212   2.118   0.818
  110   HD21  LEU  15          1HD2      LEU  15  12.584  -0.415  -1.325
  111   HD22  LEU  15          2HD2      LEU  15  13.682   0.623  -2.234
  112   HD23  LEU  15          3HD2      LEU  15  11.937   0.838  -2.384
  113    H    SER  16           HN       SER  16  11.641   5.055  -1.525
  114    HA   SER  16           HA       SER  16  11.628   7.065  -3.316
  115    HB2  SER  16          2HB       SER  16  11.426   5.845  -5.276
  116    HB3  SER  16          3HB       SER  16  10.420   4.607  -4.524
  117    HG   SER  16           HG       SER  16   9.675   7.221  -5.316
  118    HA   PRO  17           HA       PRO  17   8.266   6.991  -0.129
  119    HB2  PRO  17          2HB       PRO  17   8.985   9.349   1.010
  120    HB3  PRO  17          3HB       PRO  17   9.695   7.800   1.479
  121    HG2  PRO  17          2HG       PRO  17  10.780   9.902  -0.356
  122    HG3  PRO  17          3HG       PRO  17  11.619   8.968   0.896
  123    HD2  PRO  17          2HD       PRO  17  11.781   8.353  -1.737
  124    HD3  PRO  17          3HD       PRO  17  11.850   7.119  -0.462
  125    H    LYS  18           HN       LYS  18   8.985   8.621  -2.897
  126    HA   LYS  18           HA       LYS  18   6.937  10.682  -2.595
  127    HB2  LYS  18          2HB       LYS  18   9.133  11.198  -3.679
  128    HB3  LYS  18          3HB       LYS  18   8.699  10.098  -4.981
  129    HG2  LYS  18          2HG       LYS  18   6.700  12.164  -4.394
  130    HG3  LYS  18          3HG       LYS  18   8.244  12.764  -5.002
  131    HD2  LYS  18          2HD       LYS  18   7.802  10.682  -6.682
  132    HD3  LYS  18          3HD       LYS  18   6.148  11.204  -6.356
  133    HE2  LYS  18          2HE       LYS  18   8.100  13.340  -6.943
  134    HE3  LYS  18          3HE       LYS  18   7.703  12.265  -8.282
  135    HZ1  LYS  18          1HZ       LYS  18   5.277  12.808  -7.281
  136    HZ2  LYS  18          2HZ       LYS  18   5.991  13.660  -8.557
  137    HZ3  LYS  18          3HZ       LYS  18   6.077  14.269  -6.982
  138    H    THR  19           HN       THR  19   7.390   7.550  -3.945
  139    HA   THR  19           HA       THR  19   4.713   7.709  -5.162
  140    HB   THR  19           HB       THR  19   5.363   6.302  -6.979
  141    HG1  THR  19          1HG       THR  19   8.046   6.164  -6.535
  142   HG21  THR  19          1HG2      THR  19   5.864   8.612  -7.388
  143   HG22  THR  19          2HG2      THR  19   7.185   7.645  -8.047
  144   HG23  THR  19          3HG2      THR  19   7.389   8.487  -6.512
  145    H    ASN  20           HN       ASN  20   6.335   6.498  -2.672
  146    HA   ASN  20           HA       ASN  20   5.144   3.817  -2.801
  147    HB2  ASN  20          2HB       ASN  20   7.440   4.999  -1.300
  148    HB3  ASN  20          3HB       ASN  20   6.582   3.638  -0.582
  149   HD21  ASN  20          1HD2      ASN  20   9.198   4.371  -2.293
  150   HD22  ASN  20          2HD2      ASN  20   9.387   2.932  -3.229
  151    H    THR  21           HN       THR  21   3.561   6.200  -2.344
  152    HA   THR  21           HA       THR  21   2.750   5.830   0.460
  153    HB   THR  21           HB       THR  21   1.958   8.096  -1.374
  154    HG1  THR  21          1HG       THR  21   3.607   9.258  -0.438
  155   HG21  THR  21          1HG2      THR  21   0.390   7.951   0.376
  156   HG22  THR  21          2HG2      THR  21   1.535   9.186   0.901
  157   HG23  THR  21          3HG2      THR  21   1.629   7.555   1.566
  158    H    CYS  22           HN       CYS  22   1.283   4.225   0.507
  159    HA   CYS  22           HA       CYS  22  -0.401   3.283  -1.389
  160    HB2  CYS  22          2HB       CYS  22  -0.133   2.387   0.939
  161    HB3  CYS  22          3HB       CYS  22  -1.227   3.650   1.496
  162    H    ARG  23           HN       ARG  23  -2.398   3.748  -2.234
  163    HA   ARG  23           HA       ARG  23  -3.278   6.509  -1.927
  164    HB2  ARG  23          2HB       ARG  23  -4.181   6.349  -4.020
  165    HB3  ARG  23          3HB       ARG  23  -2.956   5.094  -4.153
  166    HG2  ARG  23          2HG       ARG  23  -4.585   3.380  -3.747
  167    HG3  ARG  23          3HG       ARG  23  -5.828   4.586  -3.409
  168    HD2  ARG  23          2HD       ARG  23  -5.197   5.426  -5.822
  169    HD3  ARG  23          3HD       ARG  23  -4.620   3.770  -6.008
  170    HE   ARG  23           HE       ARG  23  -7.098   3.413  -5.025
  171   HH11  ARG  23          1HH1      ARG  23  -5.866   5.338  -7.652
  172   HH12  ARG  23          2HH1      ARG  23  -7.319   5.222  -8.590
  173   HH21  ARG  23          1HH2      ARG  23  -9.015   3.254  -6.250
  174   HH22  ARG  23          2HH2      ARG  23  -9.110   4.038  -7.790
  175    H    GLY  24           HN       GLY  24  -4.081   3.428  -0.771
  176    HA2  GLY  24          1HA       GLY  24  -6.874   4.183  -0.259
  177    HA3  GLY  24          2HA       GLY  24  -6.204   2.567  -0.100
  178    H    CYS  25           HN       CYS  25  -3.870   4.212   1.272
  179    HA   CYS  25           HA       CYS  25  -5.182   4.372   3.906
  180    HB2  CYS  25          2HB       CYS  25  -2.460   3.231   3.246
  181    HB3  CYS  25          3HB       CYS  25  -3.038   3.531   4.882
  182    H    ASN  26           HN       ASN  26  -2.750   5.610   1.720
  183    HA   ASN  26           HA       ASN  26  -1.876   7.722   1.554
  184    HB2  ASN  26          2HB       ASN  26  -2.979   8.587   4.190
  185    HB3  ASN  26          3HB       ASN  26  -2.817   9.495   2.690
  186   HD21  ASN  26          1HD2      ASN  26  -4.033   7.411   1.076
  187   HD22  ASN  26          2HD2      ASN  26  -5.726   7.463   1.414
  188    H    HIS  27           HN       HIS  27  -0.789   5.400   3.107
  189    HA   HIS  27           HA       HIS  27   1.139   6.890   4.765
  190    HB2  HIS  27          2HB       HIS  27   0.117   4.062   5.065
  191    HB3  HIS  27          3HB       HIS  27   1.494   4.701   5.961
  192    HD1  HIS  27          1HD       HIS  27   0.702   7.186   7.176
  193    HD2  HIS  27          2HD       HIS  27  -2.096   4.172   6.590
  194    HE1  HIS  27          1HE       HIS  27  -1.160   7.675   8.793
  195    H    LEU  28           HN       LEU  28   3.270   5.597   4.983
  196    HA   LEU  28           HA       LEU  28   4.299   5.250   2.318
  197    HB2  LEU  28          2HB       LEU  28   5.504   5.195   5.061
  198    HB3  LEU  28          3HB       LEU  28   6.435   4.705   3.647
  199    HG   LEU  28           HG       LEU  28   5.294   7.430   4.243
  200   HD11  LEU  28          1HD1      LEU  28   8.094   7.196   3.519
  201   HD12  LEU  28          2HD1      LEU  28   7.690   6.264   4.961
  202   HD13  LEU  28          3HD1      LEU  28   7.344   7.992   4.903
  203   HD21  LEU  28          1HD2      LEU  28   6.343   6.251   1.704
  204   HD22  LEU  28          2HD2      LEU  28   6.595   7.960   2.058
  205   HD23  LEU  28          3HD2      LEU  28   4.957   7.311   1.960
  206    H    VAL  29           HN       VAL  29   5.351   3.386   1.513
  207    HA   VAL  29           HA       VAL  29   5.176   0.888   2.942
  208    HB   VAL  29           HB       VAL  29   3.914   0.313   0.461
  209   HG11  VAL  29          1HG1      VAL  29   3.878  -0.779   2.832
  210   HG12  VAL  29          2HG1      VAL  29   2.478   0.267   3.077
  211   HG13  VAL  29          3HG1      VAL  29   2.476  -0.919   1.772
  212   HG21  VAL  29          1HG2      VAL  29   2.473   2.424   2.063
  213   HG22  VAL  29          2HG2      VAL  29   3.162   2.642   0.454
  214   HG23  VAL  29          3HG2      VAL  29   1.814   1.532   0.692
  215    H    CYS  30           HN       CYS  30   7.011  -0.117   2.489
  216    HA   CYS  30           HA       CYS  30   8.843   0.626   0.556
  217    HB2  CYS  30          2HB       CYS  30  10.004  -1.441   1.033
  218    HB3  CYS  30          3HB       CYS  30   9.337  -0.804   2.532
  219    H    ARG  31           HN       ARG  31   9.704  -1.083  -1.119
  220    HA   ARG  31           HA       ARG  31   7.571  -1.414  -3.044
  221    HB2  ARG  31          2HB       ARG  31   9.402  -2.097  -4.577
  222    HB3  ARG  31          3HB       ARG  31   9.670  -0.524  -3.837
  223    HG2  ARG  31          2HG       ARG  31  11.202  -1.546  -2.226
  224    HG3  ARG  31          3HG       ARG  31  10.945  -3.116  -2.990
  225    HD2  ARG  31          2HD       ARG  31  11.614  -1.416  -5.085
  226    HD3  ARG  31          3HD       ARG  31  12.686  -0.939  -3.768
  227    HE   ARG  31           HE       ARG  31  12.964  -3.593  -3.741
  228   HH11  ARG  31          1HH1      ARG  31  13.013  -1.312  -6.369
  229   HH12  ARG  31          2HH1      ARG  31  14.102  -2.251  -7.336
  230   HH21  ARG  31          1HH2      ARG  31  14.399  -4.838  -5.003
  231   HH22  ARG  31          2HH2      ARG  31  14.889  -4.257  -6.559
  232    H    ASP  32           HN       ASP  32   7.871  -3.137  -0.565
  233    HA   ASP  32           HA       ASP  32   7.753  -5.732  -1.954
  234    HB2  ASP  32          2HB       ASP  32   9.773  -5.302  -0.386
  235    HB3  ASP  32          3HB       ASP  32   8.604  -5.485   0.919
  236    H    CYS  33           HN       CYS  33   6.181  -3.450  -0.035
  237    HA   CYS  33           HA       CYS  33   4.234  -5.425   0.946
  238    HB2  CYS  33          2HB       CYS  33   4.946  -2.641   1.840
  239    HB3  CYS  33          3HB       CYS  33   3.419  -3.383   2.305
  240    H    ARG  34           HN       ARG  34   4.647  -3.791  -1.739
  241    HA   ARG  34           HA       ARG  34   1.934  -2.700  -1.940
  242    HB2  ARG  34          2HB       ARG  34   3.622  -2.464  -4.311
  243    HB3  ARG  34          3HB       ARG  34   2.745  -1.223  -3.426
  244    HG2  ARG  34          2HG       ARG  34   4.559  -1.135  -1.776
  245    HG3  ARG  34          3HG       ARG  34   5.442  -2.350  -2.703
  246    HD2  ARG  34          2HD       ARG  34   4.564   0.308  -3.819
  247    HD3  ARG  34          3HD       ARG  34   6.154   0.017  -3.114
  248    HE   ARG  34           HE       ARG  34   6.747  -1.185  -4.993
  249   HH11  ARG  34          1HH1      ARG  34   3.344  -0.455  -5.058
  250   HH12  ARG  34          2HH1      ARG  34   3.138  -0.940  -6.708
  251   HH21  ARG  34          1HH2      ARG  34   6.489  -1.825  -7.166
  252   HH22  ARG  34          2HH2      ARG  34   4.928  -1.719  -7.907
  253    H    ILE  35           HN       ILE  35   0.408  -3.522  -3.291
  254    HA   ILE  35           HA       ILE  35   1.109  -6.017  -4.696
  255    HB   ILE  35           HB       ILE  35  -1.394  -5.207  -3.250
  256   HG12  ILE  35          2HG1      ILE  35  -1.123  -7.432  -2.227
  257   HG13  ILE  35          3HG1      ILE  35   0.293  -7.720  -3.234
  258   HG21  ILE  35          1HG2      ILE  35  -2.421  -5.943  -5.171
  259   HG22  ILE  35          2HG2      ILE  35  -1.125  -7.073  -5.559
  260   HG23  ILE  35          3HG2      ILE  35  -2.267  -7.450  -4.269
  261   HD11  ILE  35          1HD1      ILE  35   1.611  -6.305  -2.018
  262   HD12  ILE  35          2HD1      ILE  35   0.248  -5.332  -1.464
  263   HD13  ILE  35          3HD1      ILE  35   0.539  -6.922  -0.762
  264    H    GLN  36           HN       GLN  36   1.228  -5.712  -6.816
  265    HA   GLN  36           HA       GLN  36   0.301  -3.531  -8.246
  266    HB2  GLN  36          2HB       GLN  36   1.448  -6.120  -8.854
  267    HB3  GLN  36          3HB       GLN  36   0.249  -5.662 -10.057
  268    HG2  GLN  36          2HG       GLN  36   2.327  -3.692  -9.231
  269    HG3  GLN  36          3HG       GLN  36   2.745  -4.988 -10.351
  270   HE21  GLN  36          1HE2      GLN  36  -0.445  -3.630 -10.248
  271   HE22  GLN  36          2HE2      GLN  36  -0.360  -2.791 -11.756
  272    H    GLU  37           HN       GLU  37  -1.667  -2.855  -8.749
  273    HA   GLU  37           HA       GLU  37  -3.897  -4.753  -8.598
  274    HB2  GLU  37          2HB       GLU  37  -3.832  -1.734  -8.552
  275    HB3  GLU  37          3HB       GLU  37  -5.312  -2.682  -8.564
  276    HG2  GLU  37          2HG       GLU  37  -3.205  -2.992  -6.449
  277    HG3  GLU  37          3HG       GLU  37  -4.531  -1.837  -6.321
  278    H    SER  38           HN       SER  38  -5.495  -4.829 -10.231
  279    HA   SER  38           HA       SER  38  -4.420  -4.445 -12.887
  280    HB2  SER  38          2HB       SER  38  -6.075  -6.332 -11.791
  281    HB3  SER  38          3HB       SER  38  -7.224  -5.310 -12.657
  282    HG   SER  38           HG       SER  38  -6.536  -6.762 -14.138
  283    H    ASN  39           HN       ASN  39  -4.357  -2.105 -12.814
  284    HA   ASN  39           HA       ASN  39  -6.577  -0.924 -14.103
  285    HB2  ASN  39          2HB       ASN  39  -6.781   0.867 -12.151
  286    HB3  ASN  39          3HB       ASN  39  -7.767  -0.590 -12.169
  287   HD21  ASN  39          1HD2      ASN  39  -8.017  -0.578  -9.946
  288   HD22  ASN  39          2HD2      ASN  39  -6.733  -0.996  -8.869
  289    H    GLY  40           HN       GLY  40  -3.587  -0.527 -12.309
  290    HA2  GLY  40          1HA       GLY  40  -1.883   0.563 -13.904
  291    HA3  GLY  40          2HA       GLY  40  -2.999   1.919 -13.840
  292    H    THR  41           HN       THR  41  -3.297   0.697 -10.886
  293    HA   THR  41           HA       THR  41  -1.019   2.230  -9.809
  294    HB   THR  41           HB       THR  41  -3.238   3.367  -9.519
  295    HG1  THR  41          1HG       THR  41  -2.552   4.102  -7.619
  296   HG21  THR  41          1HG2      THR  41  -4.256   2.023  -7.296
  297   HG22  THR  41          2HG2      THR  41  -3.926   0.757  -8.478
  298   HG23  THR  41          3HG2      THR  41  -4.977   2.108  -8.902
  299    H    TRP  42           HN       TRP  42  -1.538   1.643  -7.102
  300    HA   TRP  42           HA       TRP  42  -1.538  -1.251  -6.846
  301    HB2  TRP  42          2HB       TRP  42   0.639  -1.288  -5.674
  302    HB3  TRP  42          3HB       TRP  42   0.798  -0.798  -7.358
  303    HD1  TRP  42          1HD       TRP  42   1.888   1.515  -7.834
  304    HE1  TRP  42          1HE       TRP  42   2.853   3.385  -6.352
  305    HE3  TRP  42          3HE       TRP  42   0.231  -0.118  -3.280
  306    HZ2  TRP  42          2HZ       TRP  42   2.907   4.077  -3.616
  307    HZ3  TRP  42          3HZ       TRP  42   0.783   1.205  -1.281
  308    HH2  TRP  42          2HH       TRP  42   2.093   3.259  -1.447
  309    H    ARG  43           HN       ARG  43  -1.406  -1.924  -4.534
  310    HA   ARG  43           HA       ARG  43  -2.085   0.142  -2.598
  311    HB2  ARG  43          2HB       ARG  43  -3.971  -1.978  -3.557
  312    HB3  ARG  43          3HB       ARG  43  -4.046  -1.448  -1.881
  313    HG2  ARG  43          2HG       ARG  43  -3.967   0.778  -3.742
  314    HG3  ARG  43          3HG       ARG  43  -5.339  -0.295  -4.021
  315    HD2  ARG  43          2HD       ARG  43  -4.787   0.390  -1.206
  316    HD3  ARG  43          3HD       ARG  43  -5.340   1.717  -2.226
  317    HE   ARG  43           HE       ARG  43  -6.872  -0.565  -1.356
  318   HH11  ARG  43          1HH1      ARG  43  -6.591   2.014  -3.677
  319   HH12  ARG  43          2HH1      ARG  43  -8.277   2.013  -4.078
  320   HH21  ARG  43          1HH2      ARG  43  -9.093  -0.577  -1.876
  321   HH22  ARG  43          2HH2      ARG  43  -9.699   0.538  -3.052
  322    H    CYS  44           HN       CYS  44  -1.194  -0.280  -0.680
  323    HA   CYS  44           HA       CYS  44   0.648  -2.171  -0.143
  324    HB2  CYS  44          2HB       CYS  44   0.467  -1.644   2.136
  325    HB3  CYS  44          3HB       CYS  44  -0.152  -0.210   1.323
  326    H    LYS  45           HN       LYS  45   0.661  -4.117   1.177
  327    HA   LYS  45           HA       LYS  45  -1.025  -6.111   0.230
  328    HB2  LYS  45          2HB       LYS  45   0.204  -6.405   2.937
  329    HB3  LYS  45          3HB       LYS  45   0.119  -7.564   1.615
  330    HG2  LYS  45          2HG       LYS  45   1.706  -5.826   0.436
  331    HG3  LYS  45          3HG       LYS  45   2.070  -5.378   2.104
  332    HD2  LYS  45          2HD       LYS  45   3.548  -7.054   2.077
  333    HD3  LYS  45          3HD       LYS  45   2.154  -8.134   2.155
  334    HE2  LYS  45          2HE       LYS  45   2.160  -8.477  -0.172
  335    HE3  LYS  45          3HE       LYS  45   3.222  -7.099  -0.456
  336    HZ1  LYS  45          1HZ       LYS  45   4.990  -8.326   0.711
  337    HZ2  LYS  45          2HZ       LYS  45   4.461  -9.123  -0.684
  338    HZ3  LYS  45          3HZ       LYS  45   3.965  -9.666   0.840
  339    H    VAL  46           HN       VAL  46  -1.294  -4.097   3.101
  340    HA   VAL  46           HA       VAL  46  -3.418  -5.510   4.325
  341    HB   VAL  46           HB       VAL  46  -2.824  -2.563   4.595
  342   HG11  VAL  46          1HG1      VAL  46  -3.891  -2.735   6.739
  343   HG12  VAL  46          2HG1      VAL  46  -4.984  -3.389   5.518
  344   HG13  VAL  46          3HG1      VAL  46  -4.069  -4.480   6.561
  345   HG21  VAL  46          1HG2      VAL  46  -0.834  -4.061   4.944
  346   HG22  VAL  46          2HG2      VAL  46  -1.287  -3.077   6.335
  347   HG23  VAL  46          3HG2      VAL  46  -1.709  -4.789   6.290
  348    H    CYS  47           HN       CYS  47  -3.285  -3.307   1.678
  349    HA   CYS  47           HA       CYS  47  -6.145  -2.746   1.791
  350    HB2  CYS  47          2HB       CYS  47  -3.833  -1.664   0.242
  351    HB3  CYS  47          3HB       CYS  47  -5.444  -1.520  -0.453
  352    H    ALA  48           HN       ALA  48  -3.804  -4.145  -0.500
  353    HA   ALA  48           HA       ALA  48  -5.728  -5.050  -2.355
  354    HB1  ALA  48          1HB       ALA  48  -2.859  -5.732  -1.839
  355    HB2  ALA  48          2HB       ALA  48  -3.800  -6.632  -3.029
  356    HB3  ALA  48          3HB       ALA  48  -3.578  -4.893  -3.213
  357    H    LYS  49           HN       LYS  49  -4.741  -6.255   0.698
  358    HA   LYS  49           HA       LYS  49  -6.287  -8.717   0.219
  359    HB2  LYS  49          2HB       LYS  49  -3.580  -8.618   0.779
  360    HB3  LYS  49          3HB       LYS  49  -4.303  -8.920   2.353
  361    HG2  LYS  49          2HG       LYS  49  -4.246 -11.067   1.763
  362    HG3  LYS  49          3HG       LYS  49  -5.647 -10.686   0.760
  363    HD2  LYS  49          2HD       LYS  49  -2.901 -10.248  -0.326
  364    HD3  LYS  49          3HD       LYS  49  -3.562 -11.884  -0.274
  365    HE2  LYS  49          2HE       LYS  49  -5.653 -10.558  -1.337
  366    HE3  LYS  49          3HE       LYS  49  -4.323  -9.574  -1.948
  367    HZ1  LYS  49          1HZ       LYS  49  -4.577 -12.515  -2.284
  368    HZ2  LYS  49          2HZ       LYS  49  -3.329 -11.551  -2.896
  369    HZ3  LYS  49          3HZ       LYS  49  -4.907 -11.359  -3.476
  370    H    GLU  50           HN       GLU  50  -7.752  -9.296   1.760
  371    HA   GLU  50           HA       GLU  50  -9.166  -9.094   3.531
  372    HB2  GLU  50          2HB       GLU  50  -6.911  -9.276   4.742
  373    HB3  GLU  50          3HB       GLU  50  -7.019  -7.534   4.954
  374    HG2  GLU  50          2HG       GLU  50  -8.354  -7.775   6.697
  375    HG3  GLU  50          3HG       GLU  50  -9.478  -8.755   5.757
  376    H    ILE  51           HN       ILE  51 -10.595  -7.738   2.417
  377    HA   ILE  51           HA       ILE  51 -10.303  -4.854   2.905
  378    HB   ILE  51           HB       ILE  51 -10.620  -5.102   0.619
  379   HG12  ILE  51          2HG1      ILE  51 -12.833  -4.239   0.127
  380   HG13  ILE  51          3HG1      ILE  51 -13.453  -4.861   1.652
  381   HG21  ILE  51          1HG2      ILE  51 -12.385  -7.386   1.368
  382   HG22  ILE  51          2HG2      ILE  51 -12.588  -6.612  -0.202
  383   HG23  ILE  51          3HG2      ILE  51 -11.038  -7.332   0.232
  384   HD11  ILE  51          1HD1      ILE  51 -11.287  -3.217   2.314
  385   HD12  ILE  51          2HD1      ILE  51 -12.212  -2.350   1.088
  386   HD13  ILE  51          3HD1      ILE  51 -13.004  -2.902   2.564
  387    H    GLU  52           HN       GLU  52 -11.373  -4.103   4.603
  388    HA   GLU  52           HA       GLU  52 -13.696  -5.530   5.623
  389    HB2  GLU  52          2HB       GLU  52 -12.462  -3.034   6.778
  390    HB3  GLU  52          3HB       GLU  52 -13.469  -4.221   7.595
  391    HG2  GLU  52          2HG       GLU  52 -11.527  -5.003   8.368
  392    HG3  GLU  52          3HG       GLU  52 -11.406  -5.773   6.787
  393    H    LEU  53           HN       LEU  53 -15.544  -5.088   4.596
  394    HA   LEU  53           HA       LEU  53 -17.351  -3.940   3.830
  395    HB2  LEU  53          2HB       LEU  53 -16.708  -2.658   6.061
  396    HB3  LEU  53          3HB       LEU  53 -16.354  -1.362   4.920
  397    HG   LEU  53           HG       LEU  53 -18.953  -2.518   4.408
  398   HD11  LEU  53          1HD1      LEU  53 -19.904  -1.413   6.547
  399   HD12  LEU  53          2HD1      LEU  53 -18.296  -1.705   7.210
  400   HD13  LEU  53          3HD1      LEU  53 -19.273  -3.057   6.634
  401   HD21  LEU  53          1HD2      LEU  53 -19.526  -0.040   4.935
  402   HD22  LEU  53          2HD2      LEU  53 -18.572  -0.425   3.503
  403   HD23  LEU  53          3HD2      LEU  53 -17.775   0.174   4.959
  Start of MODEL   17
    1    H1   SER   1           HN       SER   1   8.923  13.356  10.061
    2    HA   SER   1           HA       SER   1   8.564  10.716  11.287
    3    HB2  SER   1          2HB       SER   1   8.044  10.795   8.388
    4    HB3  SER   1          3HB       SER   1   7.213   9.900   9.660
    5    HG   SER   1           HG       SER   1   5.752  11.379   9.049
    6    H    ASP   2           HN       ASP   2   9.676   9.003   9.836
    7    HA   ASP   2           HA       ASP   2  12.227  10.122   8.872
    8    HB2  ASP   2          2HB       ASP   2  11.645   7.846  10.692
    9    HB3  ASP   2          3HB       ASP   2  12.972   7.641   9.553
   10    H    ARG   3           HN       ARG   3   9.458   8.495   8.009
   11    HA   ARG   3           HA       ARG   3   8.846   7.702   5.937
   12    HB2  ARG   3          2HB       ARG   3  11.718   7.388   5.130
   13    HB3  ARG   3          3HB       ARG   3  10.312   7.689   4.119
   14    HG2  ARG   3          2HG       ARG   3  10.652   9.854   5.959
   15    HG3  ARG   3          3HG       ARG   3  12.163   9.551   5.100
   16    HD2  ARG   3          2HD       ARG   3  10.408   9.384   3.060
   17    HD3  ARG   3          3HD       ARG   3   9.571  10.538   4.098
   18    HE   ARG   3           HE       ARG   3  11.869  11.041   2.518
   19   HH11  ARG   3          1HH1      ARG   3  10.402  11.829   5.574
   20   HH12  ARG   3          2HH1      ARG   3  11.177  13.374   5.696
   21   HH21  ARG   3          1HH2      ARG   3  12.895  13.072   2.666
   22   HH22  ARG   3          2HH2      ARG   3  12.594  14.081   4.040
   23    H    THR   4           HN       THR   4   8.460   5.983   7.681
   24    HA   THR   4           HA       THR   4  10.036   3.568   7.077
   25    HB   THR   4           HB       THR   4   8.285   3.297   9.373
   26    HG1  THR   4          1HG       THR   4   9.445   4.784  10.701
   27   HG21  THR   4          1HG2      THR   4  10.337   2.531  10.438
   28   HG22  THR   4          2HG2      THR   4  11.290   3.170   9.098
   29   HG23  THR   4          3HG2      THR   4  10.182   1.824   8.830
   30    H    CYS   5           HN       CYS   5   9.005   1.674   6.519
   31    HA   CYS   5           HA       CYS   5   6.658   1.817   5.042
   32    HB2  CYS   5          2HB       CYS   5   8.432   0.003   4.972
   33    HB3  CYS   5          3HB       CYS   5   7.660  -0.689   6.394
   34    H    ALA   6           HN       ALA   6   4.529   1.210   5.421
   35    HA   ALA   6           HA       ALA   6   3.661   1.512   8.175
   36    HB1  ALA   6          1HB       ALA   6   1.765   2.338   7.329
   37    HB2  ALA   6          2HB       ALA   6   2.628   2.374   5.790
   38    HB3  ALA   6          3HB       ALA   6   1.587   1.007   6.185
   39    H    ARG   7           HN       ARG   7   4.680  -1.030   6.409
   40    HA   ARG   7           HA       ARG   7   2.873  -2.896   7.798
   41    HB2  ARG   7          2HB       ARG   7   4.258  -3.548   5.206
   42    HB3  ARG   7          3HB       ARG   7   2.910  -4.384   5.965
   43    HG2  ARG   7          2HG       ARG   7   2.871  -1.707   4.599
   44    HG3  ARG   7          3HG       ARG   7   2.063  -3.193   4.094
   45    HD2  ARG   7          2HD       ARG   7   1.324  -1.240   6.195
   46    HD3  ARG   7          3HD       ARG   7   0.301  -2.145   5.081
   47    HE   ARG   7           HE       ARG   7   1.177  -4.086   6.687
   48   HH11  ARG   7          1HH1      ARG   7  -0.112  -0.932   7.401
   49   HH12  ARG   7          2HH1      ARG   7  -0.795  -1.412   8.919
   50   HH21  ARG   7          1HH2      ARG   7   0.282  -4.731   8.683
   51   HH22  ARG   7          2HH2      ARG   7  -0.571  -3.573   9.648
   52    H    CYS   8           HN       CYS   8   6.133  -2.199   6.697
   53    HA   CYS   8           HA       CYS   8   7.163  -4.480   8.227
   54    HB2  CYS   8          2HB       CYS   8   8.609  -2.649   6.300
   55    HB3  CYS   8          3HB       CYS   8   9.275  -4.093   7.054
   56    H    GLN   9           HN       GLN   9   7.031  -1.014   8.175
   57    HA   GLN   9           HA       GLN   9   7.651   0.565   9.690
   58    HB2  GLN   9          2HB       GLN   9   7.332  -1.861  11.235
   59    HB3  GLN   9          3HB       GLN   9   8.587  -0.839  11.923
   60    HG2  GLN   9          2HG       GLN   9   6.070   0.499  11.161
   61    HG3  GLN   9          3HG       GLN   9   5.997  -0.607  12.533
   62   HE21  GLN   9          1HE2      GLN   9   8.254   1.846  11.301
   63   HE22  GLN   9          2HE2      GLN   9   8.464   2.656  12.811
   64    H    GLU  10           HN       GLU  10   9.585  -0.723   7.857
   65    HA   GLU  10           HA       GLU  10  12.080  -0.294   9.355
   66    HB2  GLU  10          2HB       GLU  10  11.302  -2.092   7.164
   67    HB3  GLU  10          3HB       GLU  10  12.855  -1.301   6.931
   68    HG2  GLU  10          2HG       GLU  10  12.102  -2.842   9.401
   69    HG3  GLU  10          3HG       GLU  10  12.982  -3.522   8.034
   70    H    SER  11           HN       SER  11  13.674   1.081   8.555
   71    HA   SER  11           HA       SER  11  12.871   3.476   7.442
   72    HB2  SER  11          2HB       SER  11  14.960   3.357   8.617
   73    HB3  SER  11          3HB       SER  11  15.601   2.177   7.473
   74    HG   SER  11           HG       SER  11  16.264   3.798   6.333
   75    H    LEU  12           HN       LEU  12  12.510   4.218   5.443
   76    HA   LEU  12           HA       LEU  12  12.492   2.369   3.246
   77    HB2  LEU  12          2HB       LEU  12  11.726   5.244   3.588
   78    HB3  LEU  12          3HB       LEU  12  11.792   4.511   1.986
   79    HG   LEU  12           HG       LEU  12   9.568   4.631   3.503
   80   HD11  LEU  12          1HD1      LEU  12  10.145   3.749   1.078
   81   HD12  LEU  12          2HD1      LEU  12   8.607   3.384   1.858
   82   HD13  LEU  12          3HD1      LEU  12   9.900   2.185   1.855
   83   HD21  LEU  12          1HD2      LEU  12  10.614   3.146   5.207
   84   HD22  LEU  12          2HD2      LEU  12  10.671   1.869   3.993
   85   HD23  LEU  12          3HD2      LEU  12   9.116   2.513   4.525
   86    H    GLY  13           HN       GLY  13  14.376   5.216   4.164
   87    HA2  GLY  13          1HA       GLY  13  16.169   6.228   3.074
   88    HA3  GLY  13          2HA       GLY  13  16.798   4.595   3.232
   89    H    ARG  14           HN       ARG  14  17.777   4.072   1.394
   90    HA   ARG  14           HA       ARG  14  17.300   5.206  -1.108
   91    HB2  ARG  14          2HB       ARG  14  18.827   2.921  -0.060
   92    HB3  ARG  14          3HB       ARG  14  18.336   2.756  -1.741
   93    HG2  ARG  14          2HG       ARG  14  19.304   5.334  -1.608
   94    HG3  ARG  14          3HG       ARG  14  20.391   4.422  -0.557
   95    HD2  ARG  14          2HD       ARG  14  21.330   4.323  -2.725
   96    HD3  ARG  14          3HD       ARG  14  20.596   2.747  -2.433
   97    HE   ARG  14           HE       ARG  14  18.644   4.142  -3.701
   98   HH11  ARG  14          1HH1      ARG  14  21.978   3.445  -4.418
   99   HH12  ARG  14          2HH1      ARG  14  21.750   3.469  -6.136
  100   HH21  ARG  14          1HH2      ARG  14  18.330   4.178  -5.961
  101   HH22  ARG  14          2HH2      ARG  14  19.674   3.887  -7.012
  102    H    LEU  15           HN       LEU  15  15.115   5.212  -1.612
  103    HA   LEU  15           HA       LEU  15  14.149   2.881  -2.946
  104    HB2  LEU  15          2HB       LEU  15  13.524   2.156  -0.768
  105    HB3  LEU  15          3HB       LEU  15  12.860   3.738  -0.366
  106    HG   LEU  15           HG       LEU  15  10.979   3.393  -1.797
  107   HD11  LEU  15          1HD1      LEU  15  10.955   0.891  -2.788
  108   HD12  LEU  15          2HD1      LEU  15  12.674   1.261  -2.917
  109   HD13  LEU  15          3HD1      LEU  15  11.487   2.303  -3.701
  110   HD21  LEU  15          1HD2      LEU  15  11.518   1.855   0.450
  111   HD22  LEU  15          2HD2      LEU  15  10.875   0.707  -0.725
  112   HD23  LEU  15          3HD2      LEU  15   9.939   2.137  -0.283
  113    H    SER  16           HN       SER  16  11.919   5.043  -1.372
  114    HA   SER  16           HA       SER  16  11.755   7.247  -2.902
  115    HB2  SER  16          2HB       SER  16   9.976   6.452  -4.659
  116    HB3  SER  16          3HB       SER  16  11.694   6.247  -4.998
  117    HG   SER  16           HG       SER  16  10.006   4.257  -3.881
  118    HA   PRO  17           HA       PRO  17   8.381   6.558   0.180
  119    HB2  PRO  17          2HB       PRO  17   8.831   8.878   1.516
  120    HB3  PRO  17          3HB       PRO  17   9.705   7.382   1.867
  121    HG2  PRO  17          2HG       PRO  17  10.559   9.734   0.224
  122    HG3  PRO  17          3HG       PRO  17  11.492   8.797   1.406
  123    HD2  PRO  17          2HD       PRO  17  11.732   8.425  -1.265
  124    HD3  PRO  17          3HD       PRO  17  11.930   7.104  -0.095
  125    H    LYS  18           HN       LYS  18   8.928   8.480  -2.436
  126    HA   LYS  18           HA       LYS  18   6.636  10.243  -1.995
  127    HB2  LYS  18          2HB       LYS  18   8.817  11.098  -2.950
  128    HB3  LYS  18          3HB       LYS  18   8.464  10.161  -4.397
  129    HG2  LYS  18          2HG       LYS  18   6.233  11.837  -3.621
  130    HG3  LYS  18          3HG       LYS  18   7.708  12.769  -3.891
  131    HD2  LYS  18          2HD       LYS  18   7.934  11.445  -6.065
  132    HD3  LYS  18          3HD       LYS  18   6.259  10.957  -5.802
  133    HE2  LYS  18          2HE       LYS  18   7.178  13.825  -5.881
  134    HE3  LYS  18          3HE       LYS  18   6.564  12.955  -7.286
  135    HZ1  LYS  18          1HZ       LYS  18   4.978  13.104  -4.804
  136    HZ2  LYS  18          2HZ       LYS  18   4.450  12.832  -6.388
  137    HZ3  LYS  18          3HZ       LYS  18   4.950  14.378  -5.917
  138    H    THR  19           HN       THR  19   7.696   7.552  -3.983
  139    HA   THR  19           HA       THR  19   5.062   7.500  -5.295
  140    HB   THR  19           HB       THR  19   6.083   6.009  -6.967
  141    HG1  THR  19          1HG       THR  19   8.566   6.113  -6.773
  142   HG21  THR  19          1HG2      THR  19   6.607   8.765  -6.601
  143   HG22  THR  19          2HG2      THR  19   6.569   7.856  -8.113
  144   HG23  THR  19          3HG2      THR  19   8.083   8.033  -7.227
  145    H    ASN  20           HN       ASN  20   5.971   6.450  -2.566
  146    HA   ASN  20           HA       ASN  20   4.924   3.721  -2.933
  147    HB2  ASN  20          2HB       ASN  20   7.222   4.680  -1.255
  148    HB3  ASN  20          3HB       ASN  20   6.317   3.247  -0.778
  149   HD21  ASN  20          1HD2      ASN  20   9.090   3.503  -1.617
  150   HD22  ASN  20          2HD2      ASN  20   9.275   2.465  -2.986
  151    H    THR  21           HN       THR  21   3.520   6.208  -2.333
  152    HA   THR  21           HA       THR  21   2.681   5.775   0.448
  153    HB   THR  21           HB       THR  21   1.994   8.080  -1.385
  154    HG1  THR  21          1HG       THR  21   3.551   9.206  -0.142
  155   HG21  THR  21          1HG2      THR  21   1.217   9.181   0.644
  156   HG22  THR  21          2HG2      THR  21   1.638   7.759   1.597
  157   HG23  THR  21          3HG2      THR  21   0.347   7.667   0.400
  158    H    CYS  22           HN       CYS  22   1.317   4.024   0.278
  159    HA   CYS  22           HA       CYS  22  -0.444   3.221  -1.553
  160    HB2  CYS  22          2HB       CYS  22  -0.173   2.199   0.698
  161    HB3  CYS  22          3HB       CYS  22  -1.172   3.483   1.372
  162    H    ARG  23           HN       ARG  23  -2.133   3.988  -2.642
  163    HA   ARG  23           HA       ARG  23  -3.089   6.647  -2.117
  164    HB2  ARG  23          2HB       ARG  23  -4.583   5.035  -4.064
  165    HB3  ARG  23          3HB       ARG  23  -3.829   6.613  -4.248
  166    HG2  ARG  23          2HG       ARG  23  -1.634   5.073  -4.137
  167    HG3  ARG  23          3HG       ARG  23  -2.776   3.927  -4.840
  168    HD2  ARG  23          2HD       ARG  23  -2.963   5.092  -6.776
  169    HD3  ARG  23          3HD       ARG  23  -2.768   6.653  -5.980
  170    HE   ARG  23           HE       ARG  23  -0.338   5.213  -5.916
  171   HH11  ARG  23          1HH1      ARG  23  -2.410   6.981  -8.084
  172   HH12  ARG  23          2HH1      ARG  23  -1.120   7.454  -9.139
  173   HH21  ARG  23          1HH2      ARG  23   1.369   5.830  -7.298
  174   HH22  ARG  23          2HH2      ARG  23   1.028   6.798  -8.692
  175    H    GLY  24           HN       GLY  24  -3.732   3.949  -0.531
  176    HA2  GLY  24          1HA       GLY  24  -6.590   4.617  -0.183
  177    HA3  GLY  24          2HA       GLY  24  -5.988   2.968  -0.109
  178    H    CYS  25           HN       CYS  25  -3.556   4.414   1.290
  179    HA   CYS  25           HA       CYS  25  -4.813   4.532   3.952
  180    HB2  CYS  25          2HB       CYS  25  -2.192   3.252   3.164
  181    HB3  CYS  25          3HB       CYS  25  -2.662   3.560   4.832
  182    H    ASN  26           HN       ASN  26  -2.372   5.748   1.769
  183    HA   ASN  26           HA       ASN  26  -1.425   7.837   1.677
  184    HB2  ASN  26          2HB       ASN  26  -3.536   8.283   3.392
  185    HB3  ASN  26          3HB       ASN  26  -2.146   8.759   4.363
  186   HD21  ASN  26          1HD2      ASN  26  -0.559   9.578   2.094
  187   HD22  ASN  26          2HD2      ASN  26  -1.227  11.072   1.539
  188    H    HIS  27           HN       HIS  27  -0.499   5.337   3.214
  189    HA   HIS  27           HA       HIS  27   1.658   6.638   4.742
  190    HB2  HIS  27          2HB       HIS  27   0.569   3.830   5.022
  191    HB3  HIS  27          3HB       HIS  27   1.888   4.513   5.967
  192    HD1  HIS  27          1HD       HIS  27   0.843   7.114   6.933
  193    HD2  HIS  27          2HD       HIS  27  -1.570   3.742   6.661
  194    HE1  HIS  27          1HE       HIS  27  -1.062   7.520   8.525
  195    H    LEU  28           HN       LEU  28   3.752   5.446   4.716
  196    HA   LEU  28           HA       LEU  28   4.530   4.943   2.007
  197    HB2  LEU  28          2HB       LEU  28   6.059   4.703   4.593
  198    HB3  LEU  28          3HB       LEU  28   6.772   4.549   2.989
  199    HG   LEU  28           HG       LEU  28   5.555   7.027   4.203
  200   HD11  LEU  28          1HD1      LEU  28   7.727   7.891   4.284
  201   HD12  LEU  28          2HD1      LEU  28   8.366   6.630   3.231
  202   HD13  LEU  28          3HD1      LEU  28   7.887   6.241   4.883
  203   HD21  LEU  28          1HD2      LEU  28   6.671   6.566   1.439
  204   HD22  LEU  28          2HD2      LEU  28   6.267   8.141   2.122
  205   HD23  LEU  28          3HD2      LEU  28   4.999   6.945   1.851
  206    H    VAL  29           HN       VAL  29   5.356   3.033   1.124
  207    HA   VAL  29           HA       VAL  29   5.265   0.577   2.652
  208    HB   VAL  29           HB       VAL  29   3.767   0.112   0.228
  209   HG11  VAL  29          1HG1      VAL  29   2.590  -0.225   2.933
  210   HG12  VAL  29          2HG1      VAL  29   2.601  -1.328   1.556
  211   HG13  VAL  29          3HG1      VAL  29   4.047  -1.141   2.549
  212   HG21  VAL  29          1HG2      VAL  29   1.696   1.253   0.864
  213   HG22  VAL  29          2HG2      VAL  29   2.537   2.041   2.199
  214   HG23  VAL  29          3HG2      VAL  29   2.989   2.406   0.533
  215    H    CYS  30           HN       CYS  30   7.053  -0.458   2.099
  216    HA   CYS  30           HA       CYS  30   8.767   0.154   0.045
  217    HB2  CYS  30          2HB       CYS  30   9.769  -2.069   0.384
  218    HB3  CYS  30          3HB       CYS  30   9.400  -1.286   1.916
  219    H    ARG  31           HN       ARG  31   9.423  -1.674  -1.650
  220    HA   ARG  31           HA       ARG  31   7.174  -1.817  -3.470
  221    HB2  ARG  31          2HB       ARG  31   9.956  -2.853  -3.982
  222    HB3  ARG  31          3HB       ARG  31   8.753  -2.344  -5.159
  223    HG2  ARG  31          2HG       ARG  31   9.191  -0.113  -3.541
  224    HG3  ARG  31          3HG       ARG  31  10.786  -0.805  -3.839
  225    HD2  ARG  31          2HD       ARG  31  10.719   0.315  -5.774
  226    HD3  ARG  31          3HD       ARG  31   9.610  -0.947  -6.307
  227    HE   ARG  31           HE       ARG  31   8.082   0.970  -5.016
  228   HH11  ARG  31          1HH1      ARG  31  10.136   0.766  -7.820
  229   HH12  ARG  31          2HH1      ARG  31   9.280   1.990  -8.698
  230   HH21  ARG  31          1HH2      ARG  31   6.947   2.582  -6.161
  231   HH22  ARG  31          2HH2      ARG  31   7.466   3.024  -7.753
  232    H    ASP  32           HN       ASP  32   7.905  -3.651  -0.981
  233    HA   ASP  32           HA       ASP  32   7.351  -6.194  -2.364
  234    HB2  ASP  32          2HB       ASP  32   9.514  -5.996  -1.040
  235    HB3  ASP  32          3HB       ASP  32   8.513  -5.913   0.407
  236    H    CYS  33           HN       CYS  33   6.020  -3.817  -0.425
  237    HA   CYS  33           HA       CYS  33   4.083  -5.671   0.782
  238    HB2  CYS  33          2HB       CYS  33   4.931  -2.870   1.495
  239    HB3  CYS  33          3HB       CYS  33   3.447  -3.573   2.128
  240    H    ARG  34           HN       ARG  34   4.404  -3.994  -1.951
  241    HA   ARG  34           HA       ARG  34   1.652  -2.978  -2.013
  242    HB2  ARG  34          2HB       ARG  34   3.298  -2.567  -4.403
  243    HB3  ARG  34          3HB       ARG  34   2.343  -1.414  -3.481
  244    HG2  ARG  34          2HG       ARG  34   4.224  -1.504  -1.756
  245    HG3  ARG  34          3HG       ARG  34   5.169  -2.292  -3.021
  246    HD2  ARG  34          2HD       ARG  34   3.879   0.429  -3.169
  247    HD3  ARG  34          3HD       ARG  34   5.602   0.093  -3.014
  248    HE   ARG  34           HE       ARG  34   4.769  -1.206  -5.301
  249   HH11  ARG  34          1HH1      ARG  34   4.867   2.069  -4.124
  250   HH12  ARG  34          2HH1      ARG  34   5.040   2.768  -5.699
  251   HH21  ARG  34          1HH2      ARG  34   4.996  -0.297  -7.381
  252   HH22  ARG  34          2HH2      ARG  34   5.112   1.422  -7.551
  253    H    ILE  35           HN       ILE  35   0.147  -3.711  -3.477
  254    HA   ILE  35           HA       ILE  35   0.875  -6.173  -4.924
  255    HB   ILE  35           HB       ILE  35  -1.685  -5.376  -3.564
  256   HG12  ILE  35          2HG1      ILE  35  -1.412  -7.729  -2.653
  257   HG13  ILE  35          3HG1      ILE  35   0.177  -7.750  -3.410
  258   HG21  ILE  35          1HG2      ILE  35  -2.726  -7.374  -4.587
  259   HG22  ILE  35          2HG2      ILE  35  -2.344  -6.115  -5.760
  260   HG23  ILE  35          3HG2      ILE  35  -1.313  -7.540  -5.630
  261   HD11  ILE  35          1HD1      ILE  35  -0.535  -5.536  -1.548
  262   HD12  ILE  35          2HD1      ILE  35  -0.070  -7.114  -0.909
  263   HD13  ILE  35          3HD1      ILE  35   1.044  -6.215  -1.939
  264    H    GLN  36           HN       GLN  36   1.038  -5.840  -7.035
  265    HA   GLN  36           HA       GLN  36   0.184  -3.616  -8.442
  266    HB2  GLN  36          2HB       GLN  36   1.151  -6.307  -9.128
  267    HB3  GLN  36          3HB       GLN  36   0.170  -5.549 -10.373
  268    HG2  GLN  36          2HG       GLN  36   2.259  -3.851  -9.187
  269    HG3  GLN  36          3HG       GLN  36   2.826  -5.222 -10.140
  270   HE21  GLN  36          1HE2      GLN  36  -0.034  -3.185 -10.543
  271   HE22  GLN  36          2HE2      GLN  36   0.375  -2.618 -12.122
  272    H    GLU  37           HN       GLU  37  -1.825  -2.889  -8.644
  273    HA   GLU  37           HA       GLU  37  -4.072  -4.731  -8.646
  274    HB2  GLU  37          2HB       GLU  37  -3.904  -1.716  -8.643
  275    HB3  GLU  37          3HB       GLU  37  -5.422  -2.600  -8.706
  276    HG2  GLU  37          2HG       GLU  37  -3.631  -3.418  -6.539
  277    HG3  GLU  37          3HG       GLU  37  -4.203  -1.753  -6.437
  278    H    SER  38           HN       SER  38  -5.830  -4.430 -10.251
  279    HA   SER  38           HA       SER  38  -4.684  -4.365 -12.923
  280    HB2  SER  38          2HB       SER  38  -6.844  -5.302 -13.638
  281    HB3  SER  38          3HB       SER  38  -6.158  -6.234 -12.308
  282    HG   SER  38           HG       SER  38  -7.854  -4.143 -11.624
  283    H    ASN  39           HN       ASN  39  -5.272  -1.927 -11.203
  284    HA   ASN  39           HA       ASN  39  -7.026  -0.519 -13.105
  285    HB2  ASN  39          2HB       ASN  39  -7.780  -0.616 -10.701
  286    HB3  ASN  39          3HB       ASN  39  -6.365   0.346 -10.286
  287   HD21  ASN  39          1HD2      ASN  39  -6.368   2.500 -10.660
  288   HD22  ASN  39          2HD2      ASN  39  -7.726   3.369 -11.283
  289    H    GLY  40           HN       GLY  40  -3.997  -1.086 -13.015
  290    HA2  GLY  40          1HA       GLY  40  -2.222   0.056 -13.970
  291    HA3  GLY  40          2HA       GLY  40  -3.231   1.493 -14.043
  292    H    THR  41           HN       THR  41  -3.458   0.406 -10.959
  293    HA   THR  41           HA       THR  41  -1.163   2.030 -10.071
  294    HB   THR  41           HB       THR  41  -3.418   3.113  -9.727
  295    HG1  THR  41          1HG       THR  41  -2.171   4.032  -8.283
  296   HG21  THR  41          1HG2      THR  41  -5.074   2.075  -8.642
  297   HG22  THR  41          2HG2      THR  41  -4.006   1.614  -7.317
  298   HG23  THR  41          3HG2      THR  41  -4.114   0.601  -8.757
  299    H    TRP  42           HN       TRP  42  -1.508   1.566  -7.323
  300    HA   TRP  42           HA       TRP  42  -1.439  -1.314  -6.933
  301    HB2  TRP  42          2HB       TRP  42   0.792  -1.308  -5.935
  302    HB3  TRP  42          3HB       TRP  42   0.865  -0.761  -7.608
  303    HD1  TRP  42          1HD       TRP  42   1.978   1.531  -8.042
  304    HE1  TRP  42          1HE       TRP  42   2.924   3.401  -6.547
  305    HE3  TRP  42          3HE       TRP  42   0.321  -0.141  -3.503
  306    HZ2  TRP  42          2HZ       TRP  42   2.963   4.077  -3.807
  307    HZ3  TRP  42          3HZ       TRP  42   0.856   1.175  -1.495
  308    HH2  TRP  42          2HH       TRP  42   2.150   3.240  -1.646
  309    H    ARG  43           HN       ARG  43  -1.489  -1.938  -4.704
  310    HA   ARG  43           HA       ARG  43  -1.888   0.181  -2.741
  311    HB2  ARG  43          2HB       ARG  43  -3.998  -1.775  -3.609
  312    HB3  ARG  43          3HB       ARG  43  -3.999  -1.121  -1.976
  313    HG2  ARG  43          2HG       ARG  43  -3.791   0.815  -4.205
  314    HG3  ARG  43          3HG       ARG  43  -5.339   0.000  -3.975
  315    HD2  ARG  43          2HD       ARG  43  -4.990   0.670  -1.476
  316    HD3  ARG  43          3HD       ARG  43  -3.880   1.862  -2.150
  317    HE   ARG  43           HE       ARG  43  -5.678   3.046  -2.927
  318   HH11  ARG  43          1HH1      ARG  43  -6.712  -0.163  -2.058
  319   HH12  ARG  43          2HH1      ARG  43  -8.397   0.185  -2.258
  320   HH21  ARG  43          1HH2      ARG  43  -7.895   3.516  -3.193
  321   HH22  ARG  43          2HH2      ARG  43  -9.069   2.277  -2.904
  322    H    CYS  44           HN       CYS  44  -1.323  -0.396  -0.694
  323    HA   CYS  44           HA       CYS  44   0.464  -2.374  -0.178
  324    HB2  CYS  44          2HB       CYS  44   0.109  -2.012   2.140
  325    HB3  CYS  44          3HB       CYS  44  -0.254  -0.479   1.354
  326    H    LYS  45           HN       LYS  45   0.215  -4.302   1.288
  327    HA   LYS  45           HA       LYS  45  -1.547  -6.173   0.078
  328    HB2  LYS  45          2HB       LYS  45  -0.318  -6.824   2.699
  329    HB3  LYS  45          3HB       LYS  45  -0.384  -7.774   1.220
  330    HG2  LYS  45          2HG       LYS  45   1.296  -6.110   0.274
  331    HG3  LYS  45          3HG       LYS  45   1.512  -5.564   1.939
  332    HD2  LYS  45          2HD       LYS  45   3.170  -7.152   1.773
  333    HD3  LYS  45          3HD       LYS  45   1.840  -8.119   2.415
  334    HE2  LYS  45          2HE       LYS  45   1.301  -8.562  -0.086
  335    HE3  LYS  45          3HE       LYS  45   2.963  -8.038  -0.359
  336    HZ1  LYS  45          1HZ       LYS  45   1.999 -10.381   1.159
  337    HZ2  LYS  45          2HZ       LYS  45   3.546  -9.751   1.419
  338    HZ3  LYS  45          3HZ       LYS  45   3.115 -10.329  -0.111
  339    H    VAL  46           HN       VAL  46  -1.941  -3.952   2.612
  340    HA   VAL  46           HA       VAL  46  -3.986  -5.458   4.008
  341    HB   VAL  46           HB       VAL  46  -3.571  -2.534   4.452
  342   HG11  VAL  46          1HG1      VAL  46  -4.022  -3.137   6.760
  343   HG12  VAL  46          2HG1      VAL  46  -5.282  -3.780   5.705
  344   HG13  VAL  46          3HG1      VAL  46  -4.026  -4.848   6.333
  345   HG21  VAL  46          1HG2      VAL  46  -1.605  -4.707   5.077
  346   HG22  VAL  46          2HG2      VAL  46  -1.315  -3.109   4.388
  347   HG23  VAL  46          3HG2      VAL  46  -1.726  -3.273   6.096
  348    H    CYS  47           HN       CYS  47  -3.782  -3.234   1.400
  349    HA   CYS  47           HA       CYS  47  -6.642  -2.608   1.558
  350    HB2  CYS  47          2HB       CYS  47  -4.352  -1.421   0.005
  351    HB3  CYS  47          3HB       CYS  47  -6.024  -1.081  -0.425
  352    H    ALA  48           HN       ALA  48  -4.228  -3.867  -0.726
  353    HA   ALA  48           HA       ALA  48  -6.137  -4.581  -2.714
  354    HB1  ALA  48          1HB       ALA  48  -3.382  -4.393  -2.600
  355    HB2  ALA  48          2HB       ALA  48  -3.678  -6.119  -2.807
  356    HB3  ALA  48          3HB       ALA  48  -4.336  -4.966  -3.968
  357    H    LYS  49           HN       LYS  49  -5.231  -5.989   0.240
  358    HA   LYS  49           HA       LYS  49  -5.369  -8.703  -0.152
  359    HB2  LYS  49          2HB       LYS  49  -4.920  -8.226   2.038
  360    HB3  LYS  49          3HB       LYS  49  -6.059  -6.888   2.093
  361    HG2  LYS  49          2HG       LYS  49  -7.895  -8.336   2.410
  362    HG3  LYS  49          3HG       LYS  49  -6.937  -9.758   1.995
  363    HD2  LYS  49          2HD       LYS  49  -6.423 -10.025   4.140
  364    HD3  LYS  49          3HD       LYS  49  -5.637  -8.444   4.144
  365    HE2  LYS  49          2HE       LYS  49  -8.549  -9.011   4.695
  366    HE3  LYS  49          3HE       LYS  49  -7.328  -8.544   5.878
  367    HZ1  LYS  49          1HZ       LYS  49  -7.610  -6.415   5.380
  368    HZ2  LYS  49          2HZ       LYS  49  -8.963  -6.858   4.467
  369    HZ3  LYS  49          3HZ       LYS  49  -7.455  -6.693   3.718
  370    H    GLU  50           HN       GLU  50  -8.175  -6.755   0.888
  371    HA   GLU  50           HA       GLU  50  -9.900  -8.010  -1.033
  372    HB2  GLU  50          2HB       GLU  50 -11.222  -9.331   0.348
  373    HB3  GLU  50          3HB       GLU  50  -9.603  -9.650   0.953
  374    HG2  GLU  50          2HG       GLU  50 -10.498  -9.238   2.953
  375    HG3  GLU  50          3HG       GLU  50 -10.331  -7.543   2.496
  376    H    ILE  51           HN       ILE  51  -9.040  -5.338  -0.018
  377    HA   ILE  51           HA       ILE  51  -9.957  -3.268   0.219
  378    HB   ILE  51           HB       ILE  51 -12.642  -4.550  -0.276
  379   HG12  ILE  51          2HG1      ILE  51 -11.665  -3.372  -2.644
  380   HG13  ILE  51          3HG1      ILE  51 -10.353  -4.365  -2.018
  381   HG21  ILE  51          1HG2      ILE  51 -13.042  -2.364   0.369
  382   HG22  ILE  51          2HG2      ILE  51 -11.568  -1.762  -0.386
  383   HG23  ILE  51          3HG2      ILE  51 -12.945  -2.225  -1.386
  384   HD11  ILE  51          1HD1      ILE  51 -11.526  -6.314  -2.281
  385   HD12  ILE  51          2HD1      ILE  51 -13.094  -5.513  -2.177
  386   HD13  ILE  51          3HD1      ILE  51 -12.124  -5.367  -3.643
  387    H    GLU  52           HN       GLU  52  -9.608  -2.814   2.334
  388    HA   GLU  52           HA       GLU  52 -11.342  -3.918   4.384
  389    HB2  GLU  52          2HB       GLU  52  -8.690  -3.002   4.317
  390    HB3  GLU  52          3HB       GLU  52  -9.557  -1.848   5.321
  391    HG2  GLU  52          2HG       GLU  52 -10.102  -4.686   5.875
  392    HG3  GLU  52          3HG       GLU  52  -8.471  -4.126   6.241
  393    H    LEU  53           HN       LEU  53 -12.654  -2.271   2.498
  394    HA   LEU  53           HA       LEU  53 -14.232  -0.635   2.436
  395    HB2  LEU  53          2HB       LEU  53 -14.047  -1.395   5.153
  396    HB3  LEU  53          3HB       LEU  53 -14.168   0.363   5.109
  397    HG   LEU  53           HG       LEU  53 -16.124  -0.858   3.367
  398   HD11  LEU  53          1HD1      LEU  53 -17.507  -1.879   5.099
  399   HD12  LEU  53          2HD1      LEU  53 -16.217  -1.644   6.276
  400   HD13  LEU  53          3HD1      LEU  53 -15.977  -2.736   4.913
  401   HD21  LEU  53          1HD2      LEU  53 -16.705   0.672   5.869
  402   HD22  LEU  53          2HD2      LEU  53 -17.531   0.715   4.311
  403   HD23  LEU  53          3HD2      LEU  53 -15.950   1.477   4.493
  Start of MODEL   18
    1    H1   SER   1           HN       SER   1   7.529   9.695  12.332
    2    HA   SER   1           HA       SER   1   7.628  10.560  10.226
    3    HB2  SER   1          2HB       SER   1   8.731  12.935  11.747
    4    HB3  SER   1          3HB       SER   1   8.115  12.984  10.096
    5    HG   SER   1           HG       SER   1   6.708  13.413  12.167
    6    H    ASP   2           HN       ASP   2   9.484   8.862  10.158
    7    HA   ASP   2           HA       ASP   2  11.912  10.240   9.215
    8    HB2  ASP   2          2HB       ASP   2  11.731   7.536  10.561
    9    HB3  ASP   2          3HB       ASP   2  13.201   8.243   9.898
   10    H    ARG   3           HN       ARG   3   9.267   8.503   8.302
   11    HA   ARG   3           HA       ARG   3   8.692   7.743   6.207
   12    HB2  ARG   3          2HB       ARG   3  11.571   7.559   5.390
   13    HB3  ARG   3          3HB       ARG   3  10.153   7.862   4.395
   14    HG2  ARG   3          2HG       ARG   3  10.346   9.979   6.258
   15    HG3  ARG   3          3HG       ARG   3  11.948   9.729   5.563
   16    HD2  ARG   3          2HD       ARG   3  10.975   9.850   3.312
   17    HD3  ARG   3          3HD       ARG   3   9.386  10.132   4.023
   18    HE   ARG   3           HE       ARG   3   9.974  12.313   4.390
   19   HH11  ARG   3          1HH1      ARG   3  12.838  10.457   3.703
   20   HH12  ARG   3          2HH1      ARG   3  13.871  11.843   3.604
   21   HH21  ARG   3          1HH2      ARG   3  11.325  14.147   4.263
   22   HH22  ARG   3          2HH2      ARG   3  13.009  13.943   3.924
   23    H    THR   4           HN       THR   4   8.263   5.927   7.746
   24    HA   THR   4           HA       THR   4   9.953   3.602   7.089
   25    HB   THR   4           HB       THR   4   8.298   3.211   9.443
   26    HG1  THR   4          1HG       THR   4   9.115   4.769  10.729
   27   HG21  THR   4          1HG2      THR   4  10.367   2.399  10.384
   28   HG22  THR   4          2HG2      THR   4  11.297   3.167   9.096
   29   HG23  THR   4          3HG2      THR   4  10.226   1.816   8.725
   30    H    CYS   5           HN       CYS   5   8.948   1.684   6.534
   31    HA   CYS   5           HA       CYS   5   6.574   1.790   5.115
   32    HB2  CYS   5          2HB       CYS   5   8.338  -0.004   4.981
   33    HB3  CYS   5          3HB       CYS   5   7.669  -0.685   6.459
   34    H    ALA   6           HN       ALA   6   4.452   1.290   5.538
   35    HA   ALA   6           HA       ALA   6   3.640   1.510   8.314
   36    HB1  ALA   6          1HB       ALA   6   2.348   1.866   5.686
   37    HB2  ALA   6          2HB       ALA   6   1.311   1.294   6.993
   38    HB3  ALA   6          3HB       ALA   6   2.194   2.810   7.168
   39    H    ARG   7           HN       ARG   7   4.732  -0.999   6.706
   40    HA   ARG   7           HA       ARG   7   2.831  -2.865   7.957
   41    HB2  ARG   7          2HB       ARG   7   4.275  -3.673   5.472
   42    HB3  ARG   7          3HB       ARG   7   2.735  -4.238   6.105
   43    HG2  ARG   7          2HG       ARG   7   3.136  -1.484   4.970
   44    HG3  ARG   7          3HG       ARG   7   2.618  -2.868   4.006
   45    HD2  ARG   7          2HD       ARG   7   0.598  -3.070   5.181
   46    HD3  ARG   7          3HD       ARG   7   1.172  -2.061   6.508
   47    HE   ARG   7           HE       ARG   7   1.008  -0.709   3.967
   48   HH11  ARG   7          1HH1      ARG   7  -0.673  -1.580   6.889
   49   HH12  ARG   7          2HH1      ARG   7  -1.823  -0.289   6.768
   50   HH21  ARG   7          1HH2      ARG   7  -0.500   0.994   3.796
   51   HH22  ARG   7          2HH2      ARG   7  -1.724   1.174   5.007
   52    H    CYS   8           HN       CYS   8   6.125  -2.248   6.866
   53    HA   CYS   8           HA       CYS   8   7.082  -4.494   8.497
   54    HB2  CYS   8          2HB       CYS   8   8.648  -2.841   6.509
   55    HB3  CYS   8          3HB       CYS   8   9.149  -4.352   7.260
   56    H    GLN   9           HN       GLN   9   7.023  -1.047   8.285
   57    HA   GLN   9           HA       GLN   9   7.707   0.587   9.713
   58    HB2  GLN   9          2HB       GLN   9   7.626  -1.825  11.391
   59    HB3  GLN   9          3HB       GLN   9   8.697  -0.565  11.990
   60    HG2  GLN   9          2HG       GLN   9   6.198   0.575  11.167
   61    HG3  GLN   9          3HG       GLN   9   5.925  -0.750  12.298
   62   HE21  GLN   9          1HE2      GLN   9   8.069   2.046  11.870
   63   HE22  GLN   9          2HE2      GLN   9   8.054   2.527  13.529
   64    H    GLU  10           HN       GLU  10   9.566  -0.894   7.881
   65    HA   GLU  10           HA       GLU  10  12.125  -0.413   9.233
   66    HB2  GLU  10          2HB       GLU  10  11.222  -2.211   7.091
   67    HB3  GLU  10          3HB       GLU  10  12.772  -1.443   6.782
   68    HG2  GLU  10          2HG       GLU  10  13.544  -2.256   9.002
   69    HG3  GLU  10          3HG       GLU  10  12.030  -3.148   9.145
   70    H    SER  11           HN       SER  11  13.473   1.188   8.641
   71    HA   SER  11           HA       SER  11  12.719   3.493   7.477
   72    HB2  SER  11          2HB       SER  11  15.303   2.182   7.917
   73    HB3  SER  11          3HB       SER  11  15.328   3.350   6.595
   74    HG   SER  11           HG       SER  11  14.363   3.870   9.215
   75    H    LEU  12           HN       LEU  12  12.794   4.460   5.434
   76    HA   LEU  12           HA       LEU  12  12.468   2.578   3.227
   77    HB2  LEU  12          2HB       LEU  12  11.696   5.428   3.690
   78    HB3  LEU  12          3HB       LEU  12  11.764   4.786   2.050
   79    HG   LEU  12           HG       LEU  12   9.521   4.825   3.454
   80   HD11  LEU  12          1HD1      LEU  12  10.518   2.721   1.561
   81   HD12  LEU  12          2HD1      LEU  12   9.472   4.102   1.231
   82   HD13  LEU  12          3HD1      LEU  12   8.857   2.731   2.153
   83   HD21  LEU  12          1HD2      LEU  12  10.680   3.401   5.237
   84   HD22  LEU  12          2HD2      LEU  12  10.513   2.066   4.098
   85   HD23  LEU  12          3HD2      LEU  12   9.077   2.897   4.701
   86    H    GLY  13           HN       GLY  13  15.116   3.142   4.268
   87    HA2  GLY  13          1HA       GLY  13  16.663   4.973   2.983
   88    HA3  GLY  13          2HA       GLY  13  17.208   3.334   3.311
   89    H    ARG  14           HN       ARG  14  17.038   5.527   0.951
   90    HA   ARG  14           HA       ARG  14  16.887   5.500  -1.336
   91    HB2  ARG  14          2HB       ARG  14  18.156   2.780  -1.004
   92    HB3  ARG  14          3HB       ARG  14  18.318   3.873  -2.373
   93    HG2  ARG  14          2HG       ARG  14  19.348   5.507  -0.676
   94    HG3  ARG  14          3HG       ARG  14  19.521   4.087   0.357
   95    HD2  ARG  14          2HD       ARG  14  20.438   3.721  -2.407
   96    HD3  ARG  14          3HD       ARG  14  21.353   4.908  -1.477
   97    HE   ARG  14           HE       ARG  14  21.411   2.077  -1.165
   98   HH11  ARG  14          1HH1      ARG  14  21.677   5.085   0.568
   99   HH12  ARG  14          2HH1      ARG  14  22.660   4.421   1.831
  100   HH21  ARG  14          1HH2      ARG  14  22.705   1.192   0.491
  101   HH22  ARG  14          2HH2      ARG  14  23.245   2.206   1.785
  102    H    LEU  15           HN       LEU  15  14.581   5.368  -1.435
  103    HA   LEU  15           HA       LEU  15  13.680   2.967  -2.791
  104    HB2  LEU  15          2HB       LEU  15  13.249   3.019  -0.147
  105    HB3  LEU  15          3HB       LEU  15  11.831   3.917  -0.686
  106    HG   LEU  15           HG       LEU  15  12.036   1.574  -2.279
  107   HD11  LEU  15          1HD1      LEU  15  11.608   0.013  -0.218
  108   HD12  LEU  15          2HD1      LEU  15  12.633   1.182   0.613
  109   HD13  LEU  15          3HD1      LEU  15  13.247   0.317  -0.795
  110   HD21  LEU  15          1HD2      LEU  15  10.087   3.080  -1.191
  111   HD22  LEU  15          2HD2      LEU  15  10.058   1.698  -0.095
  112   HD23  LEU  15          3HD2      LEU  15   9.829   1.455  -1.828
  113    H    SER  16           HN       SER  16  13.013   6.226  -1.644
  114    HA   SER  16           HA       SER  16  12.133   8.002  -2.817
  115    HB2  SER  16          2HB       SER  16  11.101   6.165  -4.960
  116    HB3  SER  16          3HB       SER  16  11.591   7.854  -5.089
  117    HG   SER  16           HG       SER  16  13.705   6.541  -4.266
  118    HA   PRO  17           HA       PRO  17   8.187   6.598  -0.883
  119    HB2  PRO  17          2HB       PRO  17   7.994   8.735   0.780
  120    HB3  PRO  17          3HB       PRO  17   8.927   7.289   1.180
  121    HG2  PRO  17          2HG       PRO  17   9.876   9.917   0.106
  122    HG3  PRO  17          3HG       PRO  17  10.584   8.907   1.381
  123    HD2  PRO  17          2HD       PRO  17  11.541   8.939  -1.152
  124    HD3  PRO  17          3HD       PRO  17  11.596   7.489  -0.130
  125    H    LYS  18           HN       LYS  18   9.151   8.933  -3.006
  126    HA   LYS  18           HA       LYS  18   6.937  10.719  -2.952
  127    HB2  LYS  18          2HB       LYS  18   9.028  11.389  -3.978
  128    HB3  LYS  18          3HB       LYS  18   8.921  10.072  -5.138
  129    HG2  LYS  18          2HG       LYS  18   8.300  12.088  -6.242
  130    HG3  LYS  18          3HG       LYS  18   6.844  11.112  -6.032
  131    HD2  LYS  18          2HD       LYS  18   5.968  12.523  -4.434
  132    HD3  LYS  18          3HD       LYS  18   7.553  13.137  -3.956
  133    HE2  LYS  18          2HE       LYS  18   6.527  13.689  -6.705
  134    HE3  LYS  18          3HE       LYS  18   5.909  14.628  -5.347
  135    HZ1  LYS  18          1HZ       LYS  18   8.446  14.788  -6.663
  136    HZ2  LYS  18          2HZ       LYS  18   8.606  14.649  -4.985
  137    HZ3  LYS  18          3HZ       LYS  18   7.686  15.907  -5.645
  138    H    THR  19           HN       THR  19   7.401   7.550  -4.178
  139    HA   THR  19           HA       THR  19   4.706   7.612  -5.327
  140    HB   THR  19           HB       THR  19   5.371   6.331  -7.279
  141    HG1  THR  19          1HG       THR  19   7.841   6.336  -7.563
  142   HG21  THR  19          1HG2      THR  19   6.043   8.126  -8.494
  143   HG22  THR  19          2HG2      THR  19   7.385   8.491  -7.410
  144   HG23  THR  19          3HG2      THR  19   5.745   8.978  -6.981
  145    H    ASN  20           HN       ASN  20   5.969   6.545  -2.851
  146    HA   ASN  20           HA       ASN  20   5.196   3.725  -3.210
  147    HB2  ASN  20          2HB       ASN  20   7.388   4.857  -1.462
  148    HB3  ASN  20          3HB       ASN  20   6.810   3.197  -1.360
  149   HD21  ASN  20          1HD2      ASN  20   9.398   4.565  -2.204
  150   HD22  ASN  20          2HD2      ASN  20   9.792   3.800  -3.702
  151    H    THR  21           HN       THR  21   3.633   6.098  -2.391
  152    HA   THR  21           HA       THR  21   2.975   5.352   0.379
  153    HB   THR  21           HB       THR  21   2.216   7.875  -1.106
  154    HG1  THR  21          1HG       THR  21   4.537   7.378  -0.323
  155   HG21  THR  21          1HG2      THR  21   1.596   8.680   1.162
  156   HG22  THR  21          2HG2      THR  21   1.875   7.051   1.779
  157   HG23  THR  21          3HG2      THR  21   0.594   7.342   0.602
  158    H    CYS  22           HN       CYS  22   1.367   3.928   0.474
  159    HA   CYS  22           HA       CYS  22  -0.364   3.068  -1.393
  160    HB2  CYS  22          2HB       CYS  22  -0.175   2.255   0.989
  161    HB3  CYS  22          3HB       CYS  22  -1.246   3.574   1.452
  162    H    ARG  23           HN       ARG  23  -2.305   3.637  -2.295
  163    HA   ARG  23           HA       ARG  23  -3.004   6.455  -2.107
  164    HB2  ARG  23          2HB       ARG  23  -3.929   6.253  -4.189
  165    HB3  ARG  23          3HB       ARG  23  -2.792   4.913  -4.260
  166    HG2  ARG  23          2HG       ARG  23  -4.530   3.335  -3.768
  167    HG3  ARG  23          3HG       ARG  23  -5.687   4.637  -3.487
  168    HD2  ARG  23          2HD       ARG  23  -4.671   5.141  -6.023
  169    HD3  ARG  23          3HD       ARG  23  -4.866   3.390  -5.968
  170    HE   ARG  23           HE       ARG  23  -7.211   4.359  -4.975
  171   HH11  ARG  23          1HH1      ARG  23  -5.401   4.850  -7.908
  172   HH12  ARG  23          2HH1      ARG  23  -6.804   5.163  -8.875
  173   HH21  ARG  23          1HH2      ARG  23  -9.066   4.770  -6.238
  174   HH22  ARG  23          2HH2      ARG  23  -8.888   5.118  -7.924
  175    H    GLY  24           HN       GLY  24  -3.948   3.589  -0.659
  176    HA2  GLY  24          1HA       GLY  24  -6.683   4.588  -0.182
  177    HA3  GLY  24          2HA       GLY  24  -6.194   2.906  -0.043
  178    H    CYS  25           HN       CYS  25  -3.657   4.258   1.276
  179    HA   CYS  25           HA       CYS  25  -4.878   4.511   3.947
  180    HB2  CYS  25          2HB       CYS  25  -2.289   3.165   3.155
  181    HB3  CYS  25          3HB       CYS  25  -2.724   3.533   4.822
  182    H    ASN  26           HN       ASN  26  -2.438   5.618   1.700
  183    HA   ASN  26           HA       ASN  26  -1.431   7.670   1.535
  184    HB2  ASN  26          2HB       ASN  26  -3.562   8.227   3.203
  185    HB3  ASN  26          3HB       ASN  26  -2.172   8.748   4.150
  186   HD21  ASN  26          1HD2      ASN  26  -3.786   9.098   1.048
  187   HD22  ASN  26          2HD2      ASN  26  -3.191  10.684   0.709
  188    H    HIS  27           HN       HIS  27  -0.518   5.237   3.116
  189    HA   HIS  27           HA       HIS  27   1.587   6.567   4.691
  190    HB2  HIS  27          2HB       HIS  27   0.466   3.771   4.971
  191    HB3  HIS  27          3HB       HIS  27   1.812   4.415   5.907
  192    HD1  HIS  27          1HD       HIS  27   0.812   7.073   6.836
  193    HD2  HIS  27          2HD       HIS  27  -1.625   3.712   6.677
  194    HE1  HIS  27          1HE       HIS  27  -1.059   7.522   8.454
  195    H    LEU  28           HN       LEU  28   3.689   5.392   4.726
  196    HA   LEU  28           HA       LEU  28   4.547   4.886   2.045
  197    HB2  LEU  28          2HB       LEU  28   5.959   4.720   4.698
  198    HB3  LEU  28          3HB       LEU  28   6.753   4.417   3.155
  199    HG   LEU  28           HG       LEU  28   5.620   7.015   4.171
  200   HD11  LEU  28          1HD1      LEU  28   7.937   6.186   4.838
  201   HD12  LEU  28          2HD1      LEU  28   7.826   7.797   4.131
  202   HD13  LEU  28          3HD1      LEU  28   8.384   6.441   3.151
  203   HD21  LEU  28          1HD2      LEU  28   6.427   7.931   1.974
  204   HD22  LEU  28          2HD2      LEU  28   4.974   6.934   1.887
  205   HD23  LEU  28          3HD2      LEU  28   6.534   6.265   1.402
  206    H    VAL  29           HN       VAL  29   5.451   2.976   1.206
  207    HA   VAL  29           HA       VAL  29   5.259   0.517   2.722
  208    HB   VAL  29           HB       VAL  29   3.933   0.019   0.220
  209   HG11  VAL  29          1HG1      VAL  29   3.984  -1.052   2.709
  210   HG12  VAL  29          2HG1      VAL  29   2.425  -0.226   2.731
  211   HG13  VAL  29          3HG1      VAL  29   2.769  -1.430   1.488
  212   HG21  VAL  29          1HG2      VAL  29   1.824   1.205   0.688
  213   HG22  VAL  29          2HG2      VAL  29   2.618   2.066   2.006
  214   HG23  VAL  29          3HG2      VAL  29   3.153   2.312   0.344
  215    H    CYS  30           HN       CYS  30   7.049  -0.567   2.270
  216    HA   CYS  30           HA       CYS  30   8.925   0.054   0.368
  217    HB2  CYS  30          2HB       CYS  30   9.830  -2.222   0.708
  218    HB3  CYS  30          3HB       CYS  30   9.407  -1.442   2.227
  219    H    ARG  31           HN       ARG  31   9.670  -1.733  -1.328
  220    HA   ARG  31           HA       ARG  31   7.544  -1.800  -3.301
  221    HB2  ARG  31          2HB       ARG  31  10.350  -2.821  -3.684
  222    HB3  ARG  31          3HB       ARG  31   9.225  -2.239  -4.904
  223    HG2  ARG  31          2HG       ARG  31   9.500  -0.052  -3.290
  224    HG3  ARG  31          3HG       ARG  31  11.111  -0.770  -3.234
  225    HD2  ARG  31          2HD       ARG  31  10.736  -0.946  -5.842
  226    HD3  ARG  31          3HD       ARG  31   9.613   0.377  -5.534
  227    HE   ARG  31           HE       ARG  31  11.415   1.748  -5.321
  228   HH11  ARG  31          1HH1      ARG  31  12.435  -1.512  -4.649
  229   HH12  ARG  31          2HH1      ARG  31  14.103  -1.087  -4.448
  230   HH21  ARG  31          1HH2      ARG  31  13.608   2.319  -5.061
  231   HH22  ARG  31          2HH2      ARG  31  14.769   1.093  -4.683
  232    H    ASP  32           HN       ASP  32   7.763  -3.643  -0.870
  233    HA   ASP  32           HA       ASP  32   7.380  -6.151  -2.365
  234    HB2  ASP  32          2HB       ASP  32   9.511  -6.154  -1.062
  235    HB3  ASP  32          3HB       ASP  32   8.565  -5.936   0.409
  236    H    CYS  33           HN       CYS  33   6.040  -3.832  -0.379
  237    HA   CYS  33           HA       CYS  33   4.060  -5.696   0.738
  238    HB2  CYS  33          2HB       CYS  33   4.899  -2.911   1.531
  239    HB3  CYS  33          3HB       CYS  33   3.413  -3.641   2.129
  240    H    ARG  34           HN       ARG  34   4.386  -4.188  -2.008
  241    HA   ARG  34           HA       ARG  34   1.699  -3.003  -2.084
  242    HB2  ARG  34          2HB       ARG  34   3.460  -2.789  -4.452
  243    HB3  ARG  34          3HB       ARG  34   2.414  -1.585  -3.712
  244    HG2  ARG  34          2HG       ARG  34   4.030  -1.045  -2.077
  245    HG3  ARG  34          3HG       ARG  34   5.009  -2.457  -2.477
  246    HD2  ARG  34          2HD       ARG  34   4.447  -0.246  -4.440
  247    HD3  ARG  34          3HD       ARG  34   5.834  -0.227  -3.351
  248    HE   ARG  34           HE       ARG  34   5.974  -2.649  -4.609
  249   HH11  ARG  34          1HH1      ARG  34   5.850   0.674  -5.643
  250   HH12  ARG  34          2HH1      ARG  34   6.773   0.396  -7.083
  251   HH21  ARG  34          1HH2      ARG  34   7.190  -3.026  -6.502
  252   HH22  ARG  34          2HH2      ARG  34   7.533  -1.708  -7.571
  253    H    ILE  35           HN       ILE  35   0.151  -3.714  -3.513
  254    HA   ILE  35           HA       ILE  35   0.748  -6.258  -4.874
  255    HB   ILE  35           HB       ILE  35  -1.742  -5.291  -3.505
  256   HG12  ILE  35          2HG1      ILE  35  -1.619  -7.552  -2.482
  257   HG13  ILE  35          3HG1      ILE  35  -0.151  -7.864  -3.401
  258   HG21  ILE  35          1HG2      ILE  35  -2.789  -7.414  -4.497
  259   HG22  ILE  35          2HG2      ILE  35  -2.675  -5.987  -5.524
  260   HG23  ILE  35          3HG2      ILE  35  -1.518  -7.304  -5.713
  261   HD11  ILE  35          1HD1      ILE  35  -0.034  -7.077  -0.918
  262   HD12  ILE  35          2HD1      ILE  35   1.115  -6.463  -2.107
  263   HD13  ILE  35          3HD1      ILE  35  -0.268  -5.479  -1.626
  264    H    GLN  36           HN       GLN  36   1.063  -5.842  -6.969
  265    HA   GLN  36           HA       GLN  36   0.237  -3.679  -8.442
  266    HB2  GLN  36          2HB       GLN  36   0.955  -6.487  -9.161
  267    HB3  GLN  36          3HB       GLN  36   0.296  -5.439 -10.410
  268    HG2  GLN  36          2HG       GLN  36   2.800  -5.024  -8.802
  269    HG3  GLN  36          3HG       GLN  36   2.667  -5.335 -10.532
  270   HE21  GLN  36          1HE2      GLN  36   2.382  -2.986  -8.009
  271   HE22  GLN  36          2HE2      GLN  36   2.233  -1.599  -9.029
  272    H    GLU  37           HN       GLU  37  -1.699  -2.920  -8.952
  273    HA   GLU  37           HA       GLU  37  -3.992  -4.745  -8.933
  274    HB2  GLU  37          2HB       GLU  37  -3.855  -1.728  -8.830
  275    HB3  GLU  37          3HB       GLU  37  -5.348  -2.654  -8.857
  276    HG2  GLU  37          2HG       GLU  37  -3.258  -3.029  -6.737
  277    HG3  GLU  37          3HG       GLU  37  -4.549  -1.837  -6.602
  278    H    SER  38           HN       SER  38  -5.752  -4.192 -10.546
  279    HA   SER  38           HA       SER  38  -4.529  -4.061 -13.191
  280    HB2  SER  38          2HB       SER  38  -7.302  -4.856 -12.281
  281    HB3  SER  38          3HB       SER  38  -6.797  -4.813 -13.969
  282    HG   SER  38           HG       SER  38  -4.992  -6.184 -12.562
  283    H    ASN  39           HN       ASN  39  -5.420  -1.790 -11.180
  284    HA   ASN  39           HA       ASN  39  -7.045  -0.225 -13.047
  285    HB2  ASN  39          2HB       ASN  39  -7.153  -0.487 -10.296
  286    HB3  ASN  39          3HB       ASN  39  -6.351   1.065 -10.519
  287   HD21  ASN  39          1HD2      ASN  39  -7.995   2.353  -9.868
  288   HD22  ASN  39          2HD2      ASN  39  -9.501   2.490 -10.705
  289    H    GLY  40           HN       GLY  40  -3.880  -0.804 -12.587
  290    HA2  GLY  40          1HA       GLY  40  -2.190   0.346 -13.794
  291    HA3  GLY  40          2HA       GLY  40  -3.148   1.816 -13.681
  292    H    THR  41           HN       THR  41  -3.500   0.930 -10.708
  293    HA   THR  41           HA       THR  41  -0.980   2.159  -9.805
  294    HB   THR  41           HB       THR  41  -3.187   3.388  -9.394
  295    HG1  THR  41          1HG       THR  41  -1.758   4.251  -8.085
  296   HG21  THR  41          1HG2      THR  41  -4.752   2.580  -7.961
  297   HG22  THR  41          2HG2      THR  41  -3.563   1.735  -6.970
  298   HG23  THR  41          3HG2      THR  41  -4.105   1.028  -8.493
  299    H    TRP  42           HN       TRP  42  -1.492   1.614  -7.034
  300    HA   TRP  42           HA       TRP  42  -1.594  -1.276  -6.787
  301    HB2  TRP  42          2HB       TRP  42   0.608  -1.393  -5.651
  302    HB3  TRP  42          3HB       TRP  42   0.743  -0.938  -7.346
  303    HD1  TRP  42          1HD       TRP  42   1.958   1.291  -7.882
  304    HE1  TRP  42          1HE       TRP  42   3.023   3.153  -6.461
  305    HE3  TRP  42          3HE       TRP  42   0.253  -0.128  -3.276
  306    HZ2  TRP  42          2HZ       TRP  42   3.127   3.919  -3.746
  307    HZ3  TRP  42          3HZ       TRP  42   0.882   1.223  -1.318
  308    HH2  TRP  42          2HH       TRP  42   2.289   3.205  -1.550
  309    H    ARG  43           HN       ARG  43  -1.774  -2.000  -4.600
  310    HA   ARG  43           HA       ARG  43  -2.194   0.089  -2.589
  311    HB2  ARG  43          2HB       ARG  43  -4.196  -2.005  -3.423
  312    HB3  ARG  43          3HB       ARG  43  -4.271  -1.204  -1.858
  313    HG2  ARG  43          2HG       ARG  43  -4.014   0.834  -3.772
  314    HG3  ARG  43          3HG       ARG  43  -5.209  -0.299  -4.401
  315    HD2  ARG  43          2HD       ARG  43  -5.365   0.553  -1.547
  316    HD3  ARG  43          3HD       ARG  43  -5.923   1.654  -2.805
  317    HE   ARG  43           HE       ARG  43  -7.178  -0.655  -3.423
  318   HH11  ARG  43          1HH1      ARG  43  -6.905   1.195  -0.487
  319   HH12  ARG  43          2HH1      ARG  43  -8.455   0.711   0.117
  320   HH21  ARG  43          1HH2      ARG  43  -9.221  -1.300  -2.639
  321   HH22  ARG  43          2HH2      ARG  43  -9.770  -0.710  -1.107
  322    H    CYS  44           HN       CYS  44  -1.396  -0.425  -0.644
  323    HA   CYS  44           HA       CYS  44   0.360  -2.404  -0.131
  324    HB2  CYS  44          2HB       CYS  44   0.122  -1.966   2.176
  325    HB3  CYS  44          3HB       CYS  44  -0.339  -0.464   1.381
  326    H    LYS  45           HN       LYS  45   0.244  -4.364   1.201
  327    HA   LYS  45           HA       LYS  45  -1.555  -6.243   0.151
  328    HB2  LYS  45          2HB       LYS  45  -0.287  -6.791   2.784
  329    HB3  LYS  45          3HB       LYS  45  -0.394  -7.810   1.355
  330    HG2  LYS  45          2HG       LYS  45   1.234  -5.998   0.356
  331    HG3  LYS  45          3HG       LYS  45   1.604  -5.727   2.060
  332    HD2  LYS  45          2HD       LYS  45   3.152  -7.343   1.507
  333    HD3  LYS  45          3HD       LYS  45   1.826  -8.329   2.127
  334    HE2  LYS  45          2HE       LYS  45   1.046  -8.704  -0.167
  335    HE3  LYS  45          3HE       LYS  45   2.383  -7.731  -0.778
  336    HZ1  LYS  45          1HZ       LYS  45   2.359 -10.468  -0.038
  337    HZ2  LYS  45          2HZ       LYS  45   3.521  -9.633   0.862
  338    HZ3  LYS  45          3HZ       LYS  45   3.569  -9.586  -0.827
  339    H    VAL  46           HN       VAL  46  -1.842  -4.055   2.784
  340    HA   VAL  46           HA       VAL  46  -3.893  -5.509   4.182
  341    HB   VAL  46           HB       VAL  46  -3.549  -2.569   4.546
  342   HG11  VAL  46          1HG1      VAL  46  -3.788  -4.814   6.542
  343   HG12  VAL  46          2HG1      VAL  46  -3.971  -3.086   6.846
  344   HG13  VAL  46          3HG1      VAL  46  -5.161  -3.940   5.865
  345   HG21  VAL  46          1HG2      VAL  46  -1.414  -4.570   4.838
  346   HG22  VAL  46          2HG2      VAL  46  -1.312  -2.821   4.642
  347   HG23  VAL  46          3HG2      VAL  46  -1.651  -3.512   6.229
  348    H    CYS  47           HN       CYS  47  -3.756  -3.264   1.561
  349    HA   CYS  47           HA       CYS  47  -6.631  -2.730   1.723
  350    HB2  CYS  47          2HB       CYS  47  -4.392  -1.515   0.113
  351    HB3  CYS  47          3HB       CYS  47  -6.082  -1.201  -0.267
  352    H    ALA  48           HN       ALA  48  -4.238  -3.786  -0.701
  353    HA   ALA  48           HA       ALA  48  -6.128  -4.610  -2.620
  354    HB1  ALA  48          1HB       ALA  48  -3.991  -6.144  -3.221
  355    HB2  ALA  48          2HB       ALA  48  -4.135  -4.441  -3.657
  356    HB3  ALA  48          3HB       ALA  48  -3.227  -4.910  -2.221
  357    H    LYS  49           HN       LYS  49  -5.214  -5.993   0.339
  358    HA   LYS  49           HA       LYS  49  -5.177  -8.652   0.182
  359    HB2  LYS  49          2HB       LYS  49  -5.436  -7.224   2.270
  360    HB3  LYS  49          3HB       LYS  49  -7.172  -7.300   1.997
  361    HG2  LYS  49          2HG       LYS  49  -6.960  -9.043   3.427
  362    HG3  LYS  49          3HG       LYS  49  -6.666  -9.900   1.913
  363    HD2  LYS  49          2HD       LYS  49  -4.203  -9.444   2.290
  364    HD3  LYS  49          3HD       LYS  49  -4.644  -8.924   3.919
  365    HE2  LYS  49          2HE       LYS  49  -5.935 -11.330   3.694
  366    HE3  LYS  49          3HE       LYS  49  -4.451 -11.613   2.785
  367    HZ1  LYS  49          1HZ       LYS  49  -4.260 -10.326   5.413
  368    HZ2  LYS  49          2HZ       LYS  49  -3.159 -11.344   4.630
  369    HZ3  LYS  49          3HZ       LYS  49  -4.543 -11.994   5.354
  370    H    GLU  50           HN       GLU  50  -8.325  -6.974   0.337
  371    HA   GLU  50           HA       GLU  50  -9.392  -8.747  -1.699
  372    HB2  GLU  50          2HB       GLU  50 -10.437  -8.699   1.132
  373    HB3  GLU  50          3HB       GLU  50 -11.359  -9.327  -0.226
  374    HG2  GLU  50          2HG       GLU  50  -9.645 -11.004  -0.633
  375    HG3  GLU  50          3HG       GLU  50  -8.689 -10.362   0.701
  376    H    ILE  51           HN       ILE  51 -11.881  -8.206  -1.917
  377    HA   ILE  51           HA       ILE  51 -12.014  -5.450  -2.608
  378    HB   ILE  51           HB       ILE  51 -13.213  -7.182  -3.879
  379   HG12  ILE  51          2HG1      ILE  51 -15.583  -5.754  -3.155
  380   HG13  ILE  51          3HG1      ILE  51 -14.212  -4.655  -3.038
  381   HG21  ILE  51          1HG2      ILE  51 -13.915  -8.270  -1.551
  382   HG22  ILE  51          2HG2      ILE  51 -15.377  -7.336  -1.864
  383   HG23  ILE  51          3HG2      ILE  51 -14.830  -8.535  -3.035
  384   HD11  ILE  51          1HD1      ILE  51 -14.589  -6.356  -5.463
  385   HD12  ILE  51          2HD1      ILE  51 -15.479  -4.846  -5.267
  386   HD13  ILE  51          3HD1      ILE  51 -13.715  -4.834  -5.288
  387    H    GLU  52           HN       GLU  52 -12.463  -3.799  -1.322
  388    HA   GLU  52           HA       GLU  52 -14.383  -4.163   0.861
  389    HB2  GLU  52          2HB       GLU  52 -11.896  -4.301   1.595
  390    HB3  GLU  52          3HB       GLU  52 -11.885  -2.564   1.323
  391    HG2  GLU  52          2HG       GLU  52 -13.709  -4.041   3.207
  392    HG3  GLU  52          3HG       GLU  52 -12.286  -3.105   3.661
  393    H    LEU  53           HN       LEU  53 -15.941  -2.952  -0.143
  394    HA   LEU  53           HA       LEU  53 -17.093  -1.058  -0.665
  395    HB2  LEU  53          2HB       LEU  53 -15.358  -0.253   1.278
  396    HB3  LEU  53          3HB       LEU  53 -14.943   0.836  -0.045
  397    HG   LEU  53           HG       LEU  53 -17.810   0.547   0.709
  398   HD11  LEU  53          1HD1      LEU  53 -16.825   0.815   2.870
  399   HD12  LEU  53          2HD1      LEU  53 -17.497   2.369   2.380
  400   HD13  LEU  53          3HD1      LEU  53 -15.758   2.091   2.283
  401   HD21  LEU  53          1HD2      LEU  53 -18.038   2.612  -0.263
  402   HD22  LEU  53          2HD2      LEU  53 -16.705   1.949  -1.209
  403   HD23  LEU  53          3HD2      LEU  53 -16.378   3.089   0.097
  Start of MODEL   19
    1    H1   SER   1           HN       SER   1   9.297  11.390  12.833
    2    HA   SER   1           HA       SER   1   7.759  10.044  10.836
    3    HB2  SER   1          2HB       SER   1   7.216  12.757  11.058
    4    HB3  SER   1          3HB       SER   1   8.389  12.676   9.743
    5    HG   SER   1           HG       SER   1   6.503  12.328   8.742
    6    H    ASP   2           HN       ASP   2   9.410   8.754  10.275
    7    HA   ASP   2           HA       ASP   2  11.911  10.046   9.398
    8    HB2  ASP   2          2HB       ASP   2  11.433   7.718  11.133
    9    HB3  ASP   2          3HB       ASP   2  12.639   7.454   9.877
   10    H    ARG   3           HN       ARG   3   9.207   8.342   8.434
   11    HA   ARG   3           HA       ARG   3   8.606   7.688   6.310
   12    HB2  ARG   3          2HB       ARG   3  11.477   7.617   5.444
   13    HB3  ARG   3          3HB       ARG   3  10.038   7.916   4.479
   14    HG2  ARG   3          2HG       ARG   3  10.285   9.936   6.494
   15    HG3  ARG   3          3HG       ARG   3  11.792   9.800   5.584
   16    HD2  ARG   3          2HD       ARG   3  10.851  10.529   3.656
   17    HD3  ARG   3          3HD       ARG   3   9.298   9.768   4.002
   18    HE   ARG   3           HE       ARG   3   9.881  12.019   5.691
   19   HH11  ARG   3          1HH1      ARG   3   8.556  10.998   2.637
   20   HH12  ARG   3          2HH1      ARG   3   7.556  12.401   2.455
   21   HH21  ARG   3          1HH2      ARG   3   8.568  13.870   5.461
   22   HH22  ARG   3          2HH2      ARG   3   7.565  14.035   4.061
   23    H    THR   4           HN       THR   4   8.358   5.811   7.914
   24    HA   THR   4           HA       THR   4  10.014   3.543   7.017
   25    HB   THR   4           HB       THR   4   8.529   2.975   9.430
   26    HG1  THR   4          1HG       THR   4   9.821   4.443  10.750
   27   HG21  THR   4          1HG2      THR   4  10.942   2.595  10.237
   28   HG22  THR   4          2HG2      THR   4  11.409   2.963   8.578
   29   HG23  THR   4          3HG2      THR   4  10.349   1.595   8.912
   30    H    CYS   5           HN       CYS   5   9.022   1.688   6.333
   31    HA   CYS   5           HA       CYS   5   6.647   1.728   5.023
   32    HB2  CYS   5          2HB       CYS   5   8.409  -0.123   5.075
   33    HB3  CYS   5          3HB       CYS   5   7.563  -0.743   6.490
   34    H    ALA   6           HN       ALA   6   4.521   0.981   5.441
   35    HA   ALA   6           HA       ALA   6   3.705   1.371   8.232
   36    HB1  ALA   6          1HB       ALA   6   2.440   1.889   5.611
   37    HB2  ALA   6          2HB       ALA   6   1.373   1.383   6.921
   38    HB3  ALA   6          3HB       ALA   6   2.378   2.819   7.109
   39    H    ARG   7           HN       ARG   7   4.564  -1.138   6.419
   40    HA   ARG   7           HA       ARG   7   2.525  -2.912   7.593
   41    HB2  ARG   7          2HB       ARG   7   4.045  -3.580   5.085
   42    HB3  ARG   7          3HB       ARG   7   2.570  -4.313   5.700
   43    HG2  ARG   7          2HG       ARG   7   2.879  -1.586   4.470
   44    HG3  ARG   7          3HG       ARG   7   2.007  -2.973   3.814
   45    HD2  ARG   7          2HD       ARG   7   1.240  -1.084   5.972
   46    HD3  ARG   7          3HD       ARG   7   0.258  -1.803   4.696
   47    HE   ARG   7           HE       ARG   7   0.782  -3.931   6.216
   48   HH11  ARG   7          1HH1      ARG   7  -0.275  -0.724   7.059
   49   HH12  ARG   7          2HH1      ARG   7  -1.151  -1.239   8.462
   50   HH21  ARG   7          1HH2      ARG   7  -0.367  -4.623   8.060
   51   HH22  ARG   7          2HH2      ARG   7  -1.202  -3.458   9.031
   52    H    CYS   8           HN       CYS   8   5.903  -2.481   6.695
   53    HA   CYS   8           HA       CYS   8   6.602  -4.730   8.469
   54    HB2  CYS   8          2HB       CYS   8   8.633  -5.024   7.165
   55    HB3  CYS   8          3HB       CYS   8   7.232  -5.086   6.101
   56    H    GLN   9           HN       GLN   9   6.716  -1.390   8.062
   57    HA   GLN   9           HA       GLN   9   7.733   0.307   9.184
   58    HB2  GLN   9          2HB       GLN   9   7.782  -1.956  11.117
   59    HB3  GLN   9          3HB       GLN   9   8.760  -0.543  11.495
   60    HG2  GLN   9          2HG       GLN   9   6.537  -0.463  12.525
   61    HG3  GLN   9          3HG       GLN   9   6.820   0.878  11.417
   62   HE21  GLN   9          1HE2      GLN   9   5.916  -2.472  10.750
   63   HE22  GLN   9          2HE2      GLN   9   4.423  -2.100   9.966
   64    H    GLU  10           HN       GLU  10   9.273  -0.342   7.213
   65    HA   GLU  10           HA       GLU  10  11.980  -0.644   8.341
   66    HB2  GLU  10          2HB       GLU  10  10.750  -1.705   5.836
   67    HB3  GLU  10          3HB       GLU  10  12.459  -1.292   5.821
   68    HG2  GLU  10          2HG       GLU  10  12.890  -2.831   7.628
   69    HG3  GLU  10          3HG       GLU  10  11.170  -3.186   7.772
   70    H    SER  11           HN       SER  11  13.665   0.599   7.369
   71    HA   SER  11           HA       SER  11  13.011   3.281   6.924
   72    HB2  SER  11          2HB       SER  11  15.216   2.586   7.729
   73    HB3  SER  11          3HB       SER  11  15.546   1.799   6.186
   74    HG   SER  11           HG       SER  11  16.373   3.687   5.724
   75    H    LEU  12           HN       LEU  12  12.690   4.501   5.133
   76    HA   LEU  12           HA       LEU  12  12.387   3.049   2.601
   77    HB2  LEU  12          2HB       LEU  12  11.182   5.563   3.699
   78    HB3  LEU  12          3HB       LEU  12  11.153   5.226   1.970
   79    HG   LEU  12           HG       LEU  12   9.098   4.625   3.435
   80   HD11  LEU  12          1HD1      LEU  12  10.276   3.458   1.094
   81   HD12  LEU  12          2HD1      LEU  12   8.576   3.733   1.474
   82   HD13  LEU  12          3HD1      LEU  12   9.365   2.242   1.989
   83   HD21  LEU  12          1HD2      LEU  12   9.123   2.516   4.506
   84   HD22  LEU  12          2HD2      LEU  12  10.541   3.384   5.095
   85   HD23  LEU  12          3HD2      LEU  12  10.720   2.129   3.868
   86    H    GLY  13           HN       GLY  13  14.944   4.099   3.738
   87    HA2  GLY  13          1HA       GLY  13  15.915   6.395   2.637
   88    HA3  GLY  13          2HA       GLY  13  16.873   4.930   2.788
   89    H    ARG  14           HN       ARG  14  17.291   3.689   0.994
   90    HA   ARG  14           HA       ARG  14  17.029   5.016  -1.535
   91    HB2  ARG  14          2HB       ARG  14  17.982   2.187  -1.171
   92    HB3  ARG  14          3HB       ARG  14  18.457   3.357  -2.395
   93    HG2  ARG  14          2HG       ARG  14  19.179   4.563  -0.016
   94    HG3  ARG  14          3HG       ARG  14  19.572   2.860   0.228
   95    HD2  ARG  14          2HD       ARG  14  20.347   4.066  -2.363
   96    HD3  ARG  14          3HD       ARG  14  21.245   4.587  -0.938
   97    HE   ARG  14           HE       ARG  14  21.288   1.903  -0.716
   98   HH11  ARG  14          1HH1      ARG  14  22.055   4.071  -3.329
   99   HH12  ARG  14          2HH1      ARG  14  23.250   3.025  -4.020
  100   HH21  ARG  14          1HH2      ARG  14  22.860   0.517  -1.616
  101   HH22  ARG  14          2HH2      ARG  14  23.707   1.003  -3.046
  102    H    LEU  15           HN       LEU  15  14.500   4.639  -0.707
  103    HA   LEU  15           HA       LEU  15  13.525   2.496  -2.477
  104    HB2  LEU  15          2HB       LEU  15  12.841   3.121   0.315
  105    HB3  LEU  15          3HB       LEU  15  11.465   2.825  -0.746
  106    HG   LEU  15           HG       LEU  15  13.695   0.937  -0.025
  107   HD11  LEU  15          1HD1      LEU  15  11.607   1.281   1.423
  108   HD12  LEU  15          2HD1      LEU  15  12.040  -0.368   0.971
  109   HD13  LEU  15          3HD1      LEU  15  10.738   0.466   0.122
  110   HD21  LEU  15          1HD2      LEU  15  13.522   0.371  -2.232
  111   HD22  LEU  15          2HD2      LEU  15  11.856   0.935  -2.364
  112   HD23  LEU  15          3HD2      LEU  15  12.208  -0.600  -1.569
  113    H    SER  16           HN       SER  16  13.213   5.758  -1.310
  114    HA   SER  16           HA       SER  16  12.319   7.586  -2.381
  115    HB2  SER  16          2HB       SER  16  12.569   6.040  -4.490
  116    HB3  SER  16          3HB       SER  16  10.821   5.869  -4.329
  117    HG   SER  16           HG       SER  16  10.677   7.736  -5.257
  118    HA   PRO  17           HA       PRO  17   8.566   6.538   0.089
  119    HB2  PRO  17          2HB       PRO  17   8.775   8.699   1.720
  120    HB3  PRO  17          3HB       PRO  17   9.630   7.181   2.021
  121    HG2  PRO  17          2HG       PRO  17  10.641   9.710   0.779
  122    HG3  PRO  17          3HG       PRO  17  11.427   8.656   1.968
  123    HD2  PRO  17          2HD       PRO  17  12.035   8.585  -0.670
  124    HD3  PRO  17          3HD       PRO  17  12.106   7.144   0.366
  125    H    LYS  18           HN       LYS  18   9.476   8.856  -2.122
  126    HA   LYS  18           HA       LYS  18   7.232  10.640  -1.811
  127    HB2  LYS  18          2HB       LYS  18   9.102  10.384  -4.170
  128    HB3  LYS  18          3HB       LYS  18   8.070  11.753  -3.781
  129    HG2  LYS  18          2HG       LYS  18   9.488  11.704  -1.542
  130    HG3  LYS  18          3HG       LYS  18  10.665  10.935  -2.610
  131    HD2  LYS  18          2HD       LYS  18  10.238  12.887  -4.200
  132    HD3  LYS  18          3HD       LYS  18   9.434  13.669  -2.838
  133    HE2  LYS  18          2HE       LYS  18  11.411  14.359  -2.103
  134    HE3  LYS  18          3HE       LYS  18  11.894  12.679  -1.879
  135    HZ1  LYS  18          1HZ       LYS  18  12.062  13.594  -4.605
  136    HZ2  LYS  18          2HZ       LYS  18  13.190  12.738  -3.680
  137    HZ3  LYS  18          3HZ       LYS  18  13.093  14.421  -3.548
  138    H    THR  19           HN       THR  19   8.012   7.793  -3.668
  139    HA   THR  19           HA       THR  19   5.342   7.927  -4.913
  140    HB   THR  19           HB       THR  19   6.109   7.109  -6.913
  141    HG1  THR  19          1HG       THR  19   8.133   5.905  -7.037
  142   HG21  THR  19          1HG2      THR  19   7.173   9.219  -6.774
  143   HG22  THR  19          2HG2      THR  19   8.393   8.109  -7.398
  144   HG23  THR  19          3HG2      THR  19   8.429   8.599  -5.705
  145    H    ASN  20           HN       ASN  20   6.675   6.595  -2.415
  146    HA   ASN  20           HA       ASN  20   5.734   3.858  -2.951
  147    HB2  ASN  20          2HB       ASN  20   7.804   4.974  -1.089
  148    HB3  ASN  20          3HB       ASN  20   7.019   3.445  -0.704
  149   HD21  ASN  20          1HD2      ASN  20   9.771   3.803  -1.237
  150   HD22  ASN  20          2HD2      ASN  20  10.153   2.907  -2.664
  151    H    THR  21           HN       THR  21   4.204   6.356  -2.165
  152    HA   THR  21           HA       THR  21   3.131   5.519   0.431
  153    HB   THR  21           HB       THR  21   2.457   8.007  -1.149
  154    HG1  THR  21          1HG       THR  21   4.377   8.619  -0.500
  155   HG21  THR  21          1HG2      THR  21   2.141   7.728   1.804
  156   HG22  THR  21          2HG2      THR  21   0.933   6.996   0.748
  157   HG23  THR  21          3HG2      THR  21   1.242   8.731   0.665
  158    H    CYS  22           HN       CYS  22   1.495   4.136   0.399
  159    HA   CYS  22           HA       CYS  22   0.033   3.297  -1.768
  160    HB2  CYS  22          2HB       CYS  22   0.069   2.207   0.476
  161    HB3  CYS  22          3HB       CYS  22  -1.008   3.467   1.068
  162    H    ARG  23           HN       ARG  23  -1.650   4.027  -2.923
  163    HA   ARG  23           HA       ARG  23  -2.607   6.710  -2.402
  164    HB2  ARG  23          2HB       ARG  23  -3.854   5.201  -4.595
  165    HB3  ARG  23          3HB       ARG  23  -3.108   6.794  -4.602
  166    HG2  ARG  23          2HG       ARG  23  -0.906   5.319  -4.348
  167    HG3  ARG  23          3HG       ARG  23  -1.933   4.143  -5.172
  168    HD2  ARG  23          2HD       ARG  23  -0.867   5.266  -6.915
  169    HD3  ARG  23          3HD       ARG  23  -2.445   6.045  -6.816
  170    HE   ARG  23           HE       ARG  23  -0.452   7.374  -5.250
  171   HH11  ARG  23          1HH1      ARG  23  -1.773   7.028  -8.452
  172   HH12  ARG  23          2HH1      ARG  23  -1.255   8.596  -8.976
  173   HH21  ARG  23          1HH2      ARG  23   0.234   9.441  -5.927
  174   HH22  ARG  23          2HH2      ARG  23  -0.113   9.968  -7.539
  175    H    GLY  24           HN       GLY  24  -3.402   3.979  -0.997
  176    HA2  GLY  24          1HA       GLY  24  -6.317   4.399  -1.161
  177    HA3  GLY  24          2HA       GLY  24  -5.545   2.902  -0.659
  178    H    CYS  25           HN       CYS  25  -3.679   3.872   1.153
  179    HA   CYS  25           HA       CYS  25  -5.449   4.868   3.284
  180    HB2  CYS  25          2HB       CYS  25  -3.677   3.841   4.810
  181    HB3  CYS  25          3HB       CYS  25  -4.684   2.719   3.900
  182    H    ASN  26           HN       ASN  26  -2.620   5.523   1.454
  183    HA   ASN  26           HA       ASN  26  -1.444   7.495   1.305
  184    HB2  ASN  26          2HB       ASN  26  -3.583   8.338   2.749
  185    HB3  ASN  26          3HB       ASN  26  -2.289   8.582   3.919
  186   HD21  ASN  26          1HD2      ASN  26  -3.613   9.538   0.864
  187   HD22  ASN  26          2HD2      ASN  26  -2.641  10.950   0.651
  188    H    HIS  27           HN       HIS  27  -1.040   5.010   3.181
  189    HA   HIS  27           HA       HIS  27   1.050   6.081   4.918
  190    HB2  HIS  27          2HB       HIS  27  -0.073   3.283   4.666
  191    HB3  HIS  27          3HB       HIS  27   1.147   3.781   5.834
  192    HD1  HIS  27          1HD       HIS  27  -0.283   6.518   6.575
  193    HD2  HIS  27          2HD       HIS  27  -2.048   2.757   6.524
  194    HE1  HIS  27          1HE       HIS  27  -2.259   6.682   8.121
  195    H    LEU  28           HN       LEU  28   3.182   5.122   4.942
  196    HA   LEU  28           HA       LEU  28   4.232   4.806   2.295
  197    HB2  LEU  28          2HB       LEU  28   5.467   4.722   5.034
  198    HB3  LEU  28          3HB       LEU  28   6.400   4.432   3.566
  199    HG   LEU  28           HG       LEU  28   5.022   6.984   4.388
  200   HD11  LEU  28          1HD1      LEU  28   7.357   6.196   5.265
  201   HD12  LEU  28          2HD1      LEU  28   7.111   7.861   4.743
  202   HD13  LEU  28          3HD1      LEU  28   7.901   6.708   3.668
  203   HD21  LEU  28          1HD2      LEU  28   5.843   6.004   1.746
  204   HD22  LEU  28          2HD2      LEU  28   6.456   7.604   2.167
  205   HD23  LEU  28          3HD2      LEU  28   4.720   7.291   2.184
  206    H    VAL  29           HN       VAL  29   4.991   2.998   1.301
  207    HA   VAL  29           HA       VAL  29   5.120   0.482   2.762
  208    HB   VAL  29           HB       VAL  29   3.795  -0.155   0.344
  209   HG11  VAL  29          1HG1      VAL  29   2.390  -0.185   2.970
  210   HG12  VAL  29          2HG1      VAL  29   2.458  -1.420   1.712
  211   HG13  VAL  29          3HG1      VAL  29   3.844  -1.162   2.771
  212   HG21  VAL  29          1HG2      VAL  29   2.332   1.951   1.933
  213   HG22  VAL  29          2HG2      VAL  29   2.977   2.153   0.305
  214   HG23  VAL  29          3HG2      VAL  29   1.667   1.010   0.598
  215    H    CYS  30           HN       CYS  30   7.102  -0.201   2.294
  216    HA   CYS  30           HA       CYS  30   8.734   0.579   0.229
  217    HB2  CYS  30          2HB       CYS  30  10.104  -1.354   0.713
  218    HB3  CYS  30          3HB       CYS  30   9.452  -0.726   2.224
  219    H    ARG  31           HN       ARG  31   9.678  -1.211  -1.377
  220    HA   ARG  31           HA       ARG  31   7.516  -1.729  -3.227
  221    HB2  ARG  31          2HB       ARG  31   9.221  -2.209  -4.839
  222    HB3  ARG  31          3HB       ARG  31   9.727  -0.789  -3.934
  223    HG2  ARG  31          2HG       ARG  31  11.447  -1.887  -2.899
  224    HG3  ARG  31          3HG       ARG  31  10.664  -3.463  -3.031
  225    HD2  ARG  31          2HD       ARG  31  11.054  -3.372  -5.491
  226    HD3  ARG  31          3HD       ARG  31  11.978  -1.891  -5.241
  227    HE   ARG  31           HE       ARG  31  12.855  -4.567  -4.758
  228   HH11  ARG  31          1HH1      ARG  31  13.219  -1.255  -3.750
  229   HH12  ARG  31          2HH1      ARG  31  14.825  -1.479  -3.142
  230   HH21  ARG  31          1HH2      ARG  31  14.971  -4.876  -3.961
  231   HH22  ARG  31          2HH2      ARG  31  15.821  -3.540  -3.263
  232    H    ASP  32           HN       ASP  32   7.901  -3.300  -0.677
  233    HA   ASP  32           HA       ASP  32   7.849  -5.968  -1.924
  234    HB2  ASP  32          2HB       ASP  32   9.934  -5.666  -0.635
  235    HB3  ASP  32          3HB       ASP  32   8.982  -5.296   0.800
  236    H    CYS  33           HN       CYS  33   6.204  -3.642  -0.192
  237    HA   CYS  33           HA       CYS  33   4.355  -5.638   0.943
  238    HB2  CYS  33          2HB       CYS  33   4.978  -2.818   1.832
  239    HB3  CYS  33          3HB       CYS  33   3.608  -3.742   2.443
  240    H    ARG  34           HN       ARG  34   4.559  -4.296  -1.793
  241    HA   ARG  34           HA       ARG  34   1.874  -3.090  -1.851
  242    HB2  ARG  34          2HB       ARG  34   3.385  -2.789  -4.305
  243    HB3  ARG  34          3HB       ARG  34   2.648  -1.559  -3.287
  244    HG2  ARG  34          2HG       ARG  34   4.592  -1.467  -1.886
  245    HG3  ARG  34          3HG       ARG  34   5.318  -2.832  -2.737
  246    HD2  ARG  34          2HD       ARG  34   4.536  -0.379  -4.251
  247    HD3  ARG  34          3HD       ARG  34   6.032  -0.392  -3.320
  248    HE   ARG  34           HE       ARG  34   6.000  -2.690  -4.891
  249   HH11  ARG  34          1HH1      ARG  34   6.111   0.765  -5.310
  250   HH12  ARG  34          2HH1      ARG  34   6.993   0.686  -6.799
  251   HH21  ARG  34          1HH2      ARG  34   7.162  -2.806  -6.851
  252   HH22  ARG  34          2HH2      ARG  34   7.590  -1.344  -7.675
  253    H    ILE  35           HN       ILE  35   0.373  -3.765  -3.393
  254    HA   ILE  35           HA       ILE  35   1.026  -6.293  -4.762
  255    HB   ILE  35           HB       ILE  35  -1.511  -5.522  -3.332
  256   HG12  ILE  35          2HG1      ILE  35  -1.127  -7.590  -2.097
  257   HG13  ILE  35          3HG1      ILE  35   0.274  -7.955  -3.097
  258   HG21  ILE  35          1HG2      ILE  35  -2.464  -7.635  -4.196
  259   HG22  ILE  35          2HG2      ILE  35  -2.169  -6.441  -5.459
  260   HG23  ILE  35          3HG2      ILE  35  -1.064  -7.800  -5.254
  261   HD11  ILE  35          1HD1      ILE  35   0.307  -5.373  -1.670
  262   HD12  ILE  35          2HD1      ILE  35   0.452  -6.833  -0.691
  263   HD13  ILE  35          3HD1      ILE  35   1.609  -6.519  -1.983
  264    H    GLN  36           HN       GLN  36   0.969  -6.076  -6.890
  265    HA   GLN  36           HA       GLN  36   0.150  -3.872  -8.314
  266    HB2  GLN  36          2HB       GLN  36   0.765  -6.676  -8.962
  267    HB3  GLN  36          3HB       GLN  36  -0.257  -5.860 -10.137
  268    HG2  GLN  36          2HG       GLN  36   2.176  -4.447  -9.205
  269    HG3  GLN  36          3HG       GLN  36   2.380  -5.821 -10.291
  270   HE21  GLN  36          1HE2      GLN  36   0.937  -2.655  -9.922
  271   HE22  GLN  36          2HE2      GLN  36   0.750  -2.331 -11.609
  272    H    GLU  37           HN       GLU  37  -1.749  -3.009  -8.827
  273    HA   GLU  37           HA       GLU  37  -4.160  -4.674  -8.518
  274    HB2  GLU  37          2HB       GLU  37  -3.856  -1.679  -8.229
  275    HB3  GLU  37          3HB       GLU  37  -5.370  -2.560  -8.089
  276    HG2  GLU  37          2HG       GLU  37  -3.240  -3.549  -6.347
  277    HG3  GLU  37          3HG       GLU  37  -3.746  -1.894  -6.016
  278    H    SER  38           HN       SER  38  -5.105  -5.215 -10.358
  279    HA   SER  38           HA       SER  38  -4.408  -4.391 -12.886
  280    HB2  SER  38          2HB       SER  38  -7.144  -5.328 -11.984
  281    HB3  SER  38          3HB       SER  38  -6.553  -5.329 -13.646
  282    HG   SER  38           HG       SER  38  -4.767  -6.587 -12.139
  283    H    ASN  39           HN       ASN  39  -6.480  -2.811 -10.595
  284    HA   ASN  39           HA       ASN  39  -8.091  -1.199 -12.081
  285    HB2  ASN  39          2HB       ASN  39  -7.548  -1.294  -9.479
  286    HB3  ASN  39          3HB       ASN  39  -6.578   0.122  -9.875
  287   HD21  ASN  39          1HD2      ASN  39  -7.991   1.335  -8.533
  288   HD22  ASN  39          2HD2      ASN  39  -9.533   1.849  -9.118
  289    H    GLY  40           HN       GLY  40  -4.687  -0.529 -11.271
  290    HA2  GLY  40          1HA       GLY  40  -3.843   0.460 -13.662
  291    HA3  GLY  40          2HA       GLY  40  -4.627   1.839 -12.907
  292    H    THR  41           HN       THR  41  -3.866   1.095 -10.208
  293    HA   THR  41           HA       THR  41  -0.979   1.676 -10.362
  294    HB   THR  41           HB       THR  41  -2.402   3.574  -9.536
  295    HG1  THR  41          1HG       THR  41  -0.238   3.492  -8.904
  296   HG21  THR  41          1HG2      THR  41  -2.736   2.699  -6.853
  297   HG22  THR  41          2HG2      THR  41  -3.502   1.515  -7.911
  298   HG23  THR  41          3HG2      THR  41  -3.972   3.211  -8.000
  299    H    TRP  42           HN       TRP  42  -0.760   1.551  -7.449
  300    HA   TRP  42           HA       TRP  42  -1.155  -1.330  -6.997
  301    HB2  TRP  42          2HB       TRP  42   1.052  -1.461  -5.941
  302    HB3  TRP  42          3HB       TRP  42   1.190  -0.930  -7.615
  303    HD1  TRP  42          1HD       TRP  42   2.492   1.258  -8.031
  304    HE1  TRP  42          1HE       TRP  42   3.509   3.086  -6.531
  305    HE3  TRP  42          3HE       TRP  42   0.554  -0.212  -3.535
  306    HZ2  TRP  42          2HZ       TRP  42   3.491   3.809  -3.802
  307    HZ3  TRP  42          3HZ       TRP  42   1.102   1.102  -1.528
  308    HH2  TRP  42          2HH       TRP  42   2.541   3.069  -1.661
  309    H    ARG  43           HN       ARG  43  -1.347  -1.972  -4.796
  310    HA   ARG  43           HA       ARG  43  -1.676   0.167  -2.828
  311    HB2  ARG  43          2HB       ARG  43  -3.808  -1.779  -3.682
  312    HB3  ARG  43          3HB       ARG  43  -3.828  -1.035  -2.088
  313    HG2  ARG  43          2HG       ARG  43  -3.447   0.951  -4.137
  314    HG3  ARG  43          3HG       ARG  43  -4.893  -0.011  -4.447
  315    HD2  ARG  43          2HD       ARG  43  -4.560   0.796  -1.653
  316    HD3  ARG  43          3HD       ARG  43  -4.761   2.142  -2.773
  317    HE   ARG  43           HE       ARG  43  -6.771   0.336  -1.920
  318   HH11  ARG  43          1HH1      ARG  43  -5.680   2.132  -4.695
  319   HH12  ARG  43          2HH1      ARG  43  -7.254   2.238  -5.409
  320   HH21  ARG  43          1HH2      ARG  43  -8.850   0.469  -2.850
  321   HH22  ARG  43          2HH2      ARG  43  -9.057   1.293  -4.358
  322    H    CYS  44           HN       CYS  44  -1.168  -0.413  -0.765
  323    HA   CYS  44           HA       CYS  44   0.502  -2.573  -0.298
  324    HB2  CYS  44          2HB       CYS  44   0.400  -2.010   2.014
  325    HB3  CYS  44          3HB       CYS  44   0.231  -0.499   1.127
  326    H    LYS  45           HN       LYS  45   0.251  -4.568   0.718
  327    HA   LYS  45           HA       LYS  45  -1.726  -6.240  -0.007
  328    HB2  LYS  45          2HB       LYS  45  -1.200  -7.231   2.494
  329    HB3  LYS  45          3HB       LYS  45  -0.219  -7.522   1.063
  330    HG2  LYS  45          2HG       LYS  45   0.381  -5.050   2.549
  331    HG3  LYS  45          3HG       LYS  45   0.752  -6.564   3.375
  332    HD2  LYS  45          2HD       LYS  45   1.697  -5.794   0.614
  333    HD3  LYS  45          3HD       LYS  45   2.667  -5.726   2.087
  334    HE2  LYS  45          2HE       LYS  45   1.701  -8.094   0.549
  335    HE3  LYS  45          3HE       LYS  45   3.305  -7.757   1.200
  336    HZ1  LYS  45          1HZ       LYS  45   2.455  -8.160   3.421
  337    HZ2  LYS  45          2HZ       LYS  45   2.192  -9.508   2.436
  338    HZ3  LYS  45          3HZ       LYS  45   0.910  -8.469   2.805
  339    H    VAL  46           HN       VAL  46  -1.775  -4.187   2.877
  340    HA   VAL  46           HA       VAL  46  -4.156  -5.111   4.005
  341    HB   VAL  46           HB       VAL  46  -3.227  -2.243   4.088
  342   HG11  VAL  46          1HG1      VAL  46  -5.411  -3.558   5.239
  343   HG12  VAL  46          2HG1      VAL  46  -4.243  -3.344   6.544
  344   HG13  VAL  46          3HG1      VAL  46  -4.806  -1.948   5.624
  345   HG21  VAL  46          1HG2      VAL  46  -1.956  -4.660   5.117
  346   HG22  VAL  46          2HG2      VAL  46  -1.305  -3.032   4.919
  347   HG23  VAL  46          3HG2      VAL  46  -2.245  -3.438   6.355
  348    H    CYS  47           HN       CYS  47  -3.588  -2.644   1.538
  349    HA   CYS  47           HA       CYS  47  -6.363  -1.921   1.353
  350    HB2  CYS  47          2HB       CYS  47  -3.855  -1.169  -0.082
  351    HB3  CYS  47          3HB       CYS  47  -5.397  -0.840  -0.864
  352    H    ALA  48           HN       ALA  48  -4.089  -3.602  -0.817
  353    HA   ALA  48           HA       ALA  48  -5.876  -4.284  -2.825
  354    HB1  ALA  48          1HB       ALA  48  -3.914  -6.373  -2.265
  355    HB2  ALA  48          2HB       ALA  48  -4.138  -5.380  -3.706
  356    HB3  ALA  48          3HB       ALA  48  -3.223  -4.752  -2.335
  357    H    LYS  49           HN       LYS  49  -5.383  -5.730   0.317
  358    HA   LYS  49           HA       LYS  49  -6.886  -8.109  -0.246
  359    HB2  LYS  49          2HB       LYS  49  -5.708  -6.873   2.217
  360    HB3  LYS  49          3HB       LYS  49  -6.866  -8.187   2.371
  361    HG2  LYS  49          2HG       LYS  49  -4.528  -8.512   0.551
  362    HG3  LYS  49          3HG       LYS  49  -4.307  -8.674   2.295
  363    HD2  LYS  49          2HD       LYS  49  -4.764 -10.850   1.669
  364    HD3  LYS  49          3HD       LYS  49  -6.363 -10.265   2.133
  365    HE2  LYS  49          2HE       LYS  49  -7.135 -10.268  -0.007
  366    HE3  LYS  49          3HE       LYS  49  -5.555  -9.890  -0.692
  367    HZ1  LYS  49          1HZ       LYS  49  -4.882 -12.193  -0.186
  368    HZ2  LYS  49          2HZ       LYS  49  -6.159 -12.110  -1.291
  369    HZ3  LYS  49          3HZ       LYS  49  -6.462 -12.530   0.319
  370    H    GLU  50           HN       GLU  50  -7.546  -4.972   1.208
  371    HA   GLU  50           HA       GLU  50  -9.506  -3.884   1.619
  372    HB2  GLU  50          2HB       GLU  50 -10.081  -5.349  -0.581
  373    HB3  GLU  50          3HB       GLU  50 -11.244  -6.025   0.551
  374    HG2  GLU  50          2HG       GLU  50 -12.229  -3.885   0.927
  375    HG3  GLU  50          3HG       GLU  50 -10.960  -3.083   0.003
  376    H    ILE  51           HN       ILE  51 -10.935  -3.772   3.311
  377    HA   ILE  51           HA       ILE  51 -11.663  -6.213   4.728
  378    HB   ILE  51           HB       ILE  51 -10.842  -4.298   6.696
  379   HG12  ILE  51          2HG1      ILE  51  -8.570  -5.265   4.962
  380   HG13  ILE  51          3HG1      ILE  51  -9.272  -3.660   4.792
  381   HG21  ILE  51          1HG2      ILE  51  -9.350  -6.284   7.324
  382   HG22  ILE  51          2HG2      ILE  51 -11.096  -6.527   7.339
  383   HG23  ILE  51          3HG2      ILE  51 -10.134  -7.124   5.987
  384   HD11  ILE  51          1HD1      ILE  51  -7.557  -3.170   6.188
  385   HD12  ILE  51          2HD1      ILE  51  -8.778  -3.585   7.392
  386   HD13  ILE  51          3HD1      ILE  51  -7.557  -4.770   6.931
  387    H    GLU  52           HN       GLU  52 -12.604  -4.986   7.062
  388    HA   GLU  52           HA       GLU  52 -14.686  -3.176   6.029
  389    HB2  GLU  52          2HB       GLU  52 -14.932  -5.736   7.428
  390    HB3  GLU  52          3HB       GLU  52 -15.868  -4.445   8.169
  391    HG2  GLU  52          2HG       GLU  52 -17.231  -5.637   6.589
  392    HG3  GLU  52          3HG       GLU  52 -16.939  -4.000   6.006
  393    H    LEU  53           HN       LEU  53 -14.025  -4.390   9.292
  394    HA   LEU  53           HA       LEU  53 -14.055  -1.666  10.297
  395    HB2  LEU  53          2HB       LEU  53 -15.093  -3.903  11.305
  396    HB3  LEU  53          3HB       LEU  53 -13.513  -3.970  12.081
  397    HG   LEU  53           HG       LEU  53 -15.218  -2.960  13.525
  398   HD11  LEU  53          1HD1      LEU  53 -12.668  -1.943  12.918
  399   HD12  LEU  53          2HD1      LEU  53 -13.574  -1.775  14.421
  400   HD13  LEU  53          3HD1      LEU  53 -13.722  -0.550  13.162
  401   HD21  LEU  53          1HD2      LEU  53 -16.310  -0.932  13.004
  402   HD22  LEU  53          2HD2      LEU  53 -16.514  -1.971  11.594
  403   HD23  LEU  53          3HD2      LEU  53 -15.316  -0.676  11.570
  Start of MODEL   20
    1    H1   SER   1           HN       SER   1   7.198   9.721  11.849
    2    HA   SER   1           HA       SER   1   7.393  11.426   9.542
    3    HB2  SER   1          2HB       SER   1   8.856  12.586  11.641
    4    HB3  SER   1          3HB       SER   1   7.195  12.952  11.174
    5    HG   SER   1           HG       SER   1   6.448  11.637  12.728
    6    H    ASP   2           HN       ASP   2   8.993   8.905   9.688
    7    HA   ASP   2           HA       ASP   2  11.626  10.121   9.177
    8    HB2  ASP   2          2HB       ASP   2  11.013   7.518  10.579
    9    HB3  ASP   2          3HB       ASP   2  12.609   7.919   9.952
   10    H    ARG   3           HN       ARG   3   9.038   8.415   7.954
   11    HA   ARG   3           HA       ARG   3   8.695   7.674   5.801
   12    HB2  ARG   3          2HB       ARG   3  11.650   7.511   5.310
   13    HB3  ARG   3          3HB       ARG   3  10.351   7.795   4.160
   14    HG2  ARG   3          2HG       ARG   3  10.345   9.908   6.063
   15    HG3  ARG   3          3HG       ARG   3  11.991   9.687   5.466
   16    HD2  ARG   3          2HD       ARG   3  11.402  10.165   3.284
   17    HD3  ARG   3          3HD       ARG   3   9.712   9.729   3.536
   18    HE   ARG   3           HE       ARG   3  10.562  12.042   5.024
   19   HH11  ARG   3          1HH1      ARG   3   9.280  10.876   2.004
   20   HH12  ARG   3          2HH1      ARG   3   8.557  12.392   1.576
   21   HH21  ARG   3          1HH2      ARG   3   9.615  14.043   4.471
   22   HH22  ARG   3          2HH2      ARG   3   8.749  14.192   2.980
   23    H    THR   4           HN       THR   4   8.266   5.896   7.534
   24    HA   THR   4           HA       THR   4   9.926   3.547   6.884
   25    HB   THR   4           HB       THR   4   8.255   3.114   9.193
   26    HG1  THR   4          1HG       THR   4   9.754   5.497   9.096
   27   HG21  THR   4          1HG2      THR   4  11.261   3.296   8.985
   28   HG22  THR   4          2HG2      THR   4  10.320   1.877   8.524
   29   HG23  THR   4          3HG2      THR   4  10.324   2.426  10.199
   30    H    CYS   5           HN       CYS   5   8.889   1.572   6.471
   31    HA   CYS   5           HA       CYS   5   6.518   1.714   4.984
   32    HB2  CYS   5          2HB       CYS   5   8.229  -0.047   4.693
   33    HB3  CYS   5          3HB       CYS   5   7.778  -0.726   6.253
   34    H    ALA   6           HN       ALA   6   4.412   1.113   5.411
   35    HA   ALA   6           HA       ALA   6   3.625   1.282   8.203
   36    HB1  ALA   6          1HB       ALA   6   1.328   0.948   6.669
   37    HB2  ALA   6          2HB       ALA   6   1.988   2.467   7.276
   38    HB3  ALA   6          3HB       ALA   6   2.412   1.907   5.660
   39    H    ARG   7           HN       ARG   7   4.843  -1.165   6.749
   40    HA   ARG   7           HA       ARG   7   2.927  -3.089   7.869
   41    HB2  ARG   7          2HB       ARG   7   4.460  -3.835   5.417
   42    HB3  ARG   7          3HB       ARG   7   2.924  -4.455   6.007
   43    HG2  ARG   7          2HG       ARG   7   3.306  -1.705   4.847
   44    HG3  ARG   7          3HG       ARG   7   2.747  -3.108   3.934
   45    HD2  ARG   7          2HD       ARG   7   1.229  -1.316   5.515
   46    HD3  ARG   7          3HD       ARG   7   0.671  -2.727   4.617
   47    HE   ARG   7           HE       ARG   7   1.167  -2.552   7.462
   48   HH11  ARG   7          1HH1      ARG   7   0.678  -4.625   4.709
   49   HH12  ARG   7          2HH1      ARG   7   0.180  -5.986   5.657
   50   HH21  ARG   7          1HH2      ARG   7   0.513  -4.337   8.722
   51   HH22  ARG   7          2HH2      ARG   7   0.085  -5.821   7.940
   52    H    CYS   8           HN       CYS   8   6.232  -2.586   6.670
   53    HA   CYS   8           HA       CYS   8   7.178  -4.694   8.478
   54    HB2  CYS   8          2HB       CYS   8   8.890  -3.273   6.455
   55    HB3  CYS   8          3HB       CYS   8   9.099  -4.880   7.143
   56    H    GLN   9           HN       GLN   9   7.068  -1.296   8.089
   57    HA   GLN   9           HA       GLN   9   7.782   0.418   9.408
   58    HB2  GLN   9          2HB       GLN   9   7.756  -1.865  11.148
   59    HB3  GLN   9          3HB       GLN   9   9.131  -0.845  11.548
   60    HG2  GLN   9          2HG       GLN   9   7.813   0.928  12.171
   61    HG3  GLN   9          3HG       GLN   9   6.452   0.402  11.181
   62   HE21  GLN   9          1HE2      GLN   9   5.711  -1.923  11.896
   63   HE22  GLN   9          2HE2      GLN   9   5.417  -2.078  13.591
   64    H    GLU  10           HN       GLU  10   9.503  -0.951   7.408
   65    HA   GLU  10           HA       GLU  10  12.184  -0.507   8.472
   66    HB2  GLU  10          2HB       GLU  10  11.072  -1.810   6.023
   67    HB3  GLU  10          3HB       GLU  10  12.727  -1.220   5.991
   68    HG2  GLU  10          2HG       GLU  10  13.326  -2.632   7.838
   69    HG3  GLU  10          3HG       GLU  10  11.651  -3.139   8.040
   70    H    SER  11           HN       SER  11  13.568   1.073   7.770
   71    HA   SER  11           HA       SER  11  12.540   3.534   7.009
   72    HB2  SER  11          2HB       SER  11  14.783   3.113   8.070
   73    HB3  SER  11          3HB       SER  11  15.371   2.604   6.487
   74    HG   SER  11           HG       SER  11  15.740   4.647   6.190
   75    H    LEU  12           HN       LEU  12  12.267   4.600   5.104
   76    HA   LEU  12           HA       LEU  12  12.326   2.958   2.690
   77    HB2  LEU  12          2HB       LEU  12  11.021   5.571   3.386
   78    HB3  LEU  12          3HB       LEU  12  11.091   4.972   1.730
   79    HG   LEU  12           HG       LEU  12   9.011   4.556   3.366
   80   HD11  LEU  12          1HD1      LEU  12   9.105   2.214   1.860
   81   HD12  LEU  12          2HD1      LEU  12  10.048   3.390   0.944
   82   HD13  LEU  12          3HD1      LEU  12   8.382   3.753   1.395
   83   HD21  LEU  12          1HD2      LEU  12  10.402   3.270   4.958
   84   HD22  LEU  12          2HD2      LEU  12  10.709   2.084   3.689
   85   HD23  LEU  12          3HD2      LEU  12   9.068   2.331   4.288
   86    H    GLY  13           HN       GLY  13  14.580   4.620   4.153
   87    HA2  GLY  13          1HA       GLY  13  15.614   6.674   2.795
   88    HA3  GLY  13          2HA       GLY  13  16.626   5.327   3.295
   89    H    ARG  14           HN       ARG  14  16.972   3.584   1.780
   90    HA   ARG  14           HA       ARG  14  17.365   4.576  -0.883
   91    HB2  ARG  14          2HB       ARG  14  18.109   2.141   0.639
   92    HB3  ARG  14          3HB       ARG  14  17.999   1.971  -1.108
   93    HG2  ARG  14          2HG       ARG  14  19.754   3.409  -1.496
   94    HG3  ARG  14          3HG       ARG  14  19.563   4.227   0.055
   95    HD2  ARG  14          2HD       ARG  14  20.772   2.668   1.181
   96    HD3  ARG  14          3HD       ARG  14  20.245   1.349   0.135
   97    HE   ARG  14           HE       ARG  14  22.099   1.691  -1.155
   98   HH11  ARG  14          1HH1      ARG  14  21.563   4.509   0.817
   99   HH12  ARG  14          2HH1      ARG  14  23.046   5.276   0.354
  100   HH21  ARG  14          1HH2      ARG  14  24.054   2.691  -1.773
  101   HH22  ARG  14          2HH2      ARG  14  24.462   4.241  -1.121
  102    H    LEU  15           HN       LEU  15  14.741   4.765  -0.594
  103    HA   LEU  15           HA       LEU  15  13.732   2.763  -2.453
  104    HB2  LEU  15          2HB       LEU  15  13.217   2.080  -0.058
  105    HB3  LEU  15          3HB       LEU  15  12.146   3.477  -0.003
  106    HG   LEU  15           HG       LEU  15  10.610   2.520  -1.444
  107   HD11  LEU  15          1HD1      LEU  15  11.113   0.559  -2.871
  108   HD12  LEU  15          2HD1      LEU  15  12.796   0.659  -2.355
  109   HD13  LEU  15          3HD1      LEU  15  12.075   1.983  -3.269
  110   HD21  LEU  15          1HD2      LEU  15  10.468   0.047  -0.732
  111   HD22  LEU  15          2HD2      LEU  15  10.355   1.291   0.514
  112   HD23  LEU  15          3HD2      LEU  15  11.868   0.414   0.276
  113    H    SER  16           HN       SER  16  14.352   5.779  -2.128
  114    HA   SER  16           HA       SER  16  13.353   7.812  -2.588
  115    HB2  SER  16          2HB       SER  16  12.526   6.006  -4.868
  116    HB3  SER  16          3HB       SER  16  12.328   7.759  -4.900
  117    HG   SER  16           HG       SER  16  14.328   7.848  -5.497
  118    HA   PRO  17           HA       PRO  17   9.187   6.747  -0.859
  119    HB2  PRO  17          2HB       PRO  17   9.312   8.559   1.160
  120    HB3  PRO  17          3HB       PRO  17   9.970   6.924   1.294
  121    HG2  PRO  17          2HG       PRO  17  11.388   9.495   0.706
  122    HG3  PRO  17          3HG       PRO  17  11.874   8.169   1.779
  123    HD2  PRO  17          2HD       PRO  17  12.898   8.480  -0.708
  124    HD3  PRO  17          3HD       PRO  17  12.671   6.886   0.039
  125    H    LYS  18           HN       LYS  18   9.034   7.957  -3.123
  126    HA   LYS  18           HA       LYS  18   7.731  10.541  -2.576
  127    HB2  LYS  18          2HB       LYS  18   8.652  10.386  -5.297
  128    HB3  LYS  18          3HB       LYS  18   9.012  11.595  -4.072
  129    HG2  LYS  18          2HG       LYS  18  10.452   8.968  -4.363
  130    HG3  LYS  18          3HG       LYS  18  11.024  10.513  -4.997
  131    HD2  LYS  18          2HD       LYS  18  10.347  10.843  -2.246
  132    HD3  LYS  18          3HD       LYS  18  11.394   9.431  -2.406
  133    HE2  LYS  18          2HE       LYS  18  13.171  10.660  -3.115
  134    HE3  LYS  18          3HE       LYS  18  12.160  11.859  -3.921
  135    HZ1  LYS  18          1HZ       LYS  18  11.505  12.483  -1.516
  136    HZ2  LYS  18          2HZ       LYS  18  12.983  13.024  -2.135
  137    HZ3  LYS  18          3HZ       LYS  18  12.939  11.696  -1.089
  138    H    THR  19           HN       THR  19   7.411   7.413  -3.684
  139    HA   THR  19           HA       THR  19   4.766   7.989  -4.744
  140    HB   THR  19           HB       THR  19   5.109   7.453  -6.887
  141    HG1  THR  19          1HG       THR  19   7.055   5.481  -6.498
  142   HG21  THR  19          1HG2      THR  19   8.025   7.531  -6.099
  143   HG22  THR  19          2HG2      THR  19   7.033   8.913  -6.567
  144   HG23  THR  19          3HG2      THR  19   7.406   7.657  -7.746
  145    H    ASN  20           HN       ASN  20   6.388   6.440  -2.563
  146    HA   ASN  20           HA       ASN  20   5.156   3.804  -2.942
  147    HB2  ASN  20          2HB       ASN  20   7.245   4.718  -0.951
  148    HB3  ASN  20          3HB       ASN  20   6.625   3.075  -1.092
  149   HD21  ASN  20          1HD2      ASN  20   9.325   4.347  -1.484
  150   HD22  ASN  20          2HD2      ASN  20   9.843   3.777  -3.031
  151    H    THR  21           HN       THR  21   3.656   6.214  -2.198
  152    HA   THR  21           HA       THR  21   2.819   5.518   0.536
  153    HB   THR  21           HB       THR  21   2.182   8.029  -1.025
  154    HG1  THR  21          1HG       THR  21   4.359   8.044  -0.495
  155   HG21  THR  21          1HG2      THR  21   1.996   8.104   1.882
  156   HG22  THR  21          2HG2      THR  21   0.872   6.957   1.154
  157   HG23  THR  21          3HG2      THR  21   0.846   8.650   0.662
  158    H    CYS  22           HN       CYS  22   1.363   3.893   0.276
  159    HA   CYS  22           HA       CYS  22  -0.369   3.299  -1.693
  160    HB2  CYS  22          2HB       CYS  22  -0.115   2.082   0.493
  161    HB3  CYS  22          3HB       CYS  22  -1.194   3.272   1.215
  162    H    ARG  23           HN       ARG  23  -2.072   4.174  -2.682
  163    HA   ARG  23           HA       ARG  23  -2.966   6.798  -1.897
  164    HB2  ARG  23          2HB       ARG  23  -4.474   5.419  -4.009
  165    HB3  ARG  23          3HB       ARG  23  -3.701   6.998  -4.022
  166    HG2  ARG  23          2HG       ARG  23  -1.500   5.610  -4.149
  167    HG3  ARG  23          3HG       ARG  23  -2.571   4.330  -4.720
  168    HD2  ARG  23          2HD       ARG  23  -2.061   5.292  -6.719
  169    HD3  ARG  23          3HD       ARG  23  -3.456   6.277  -6.282
  170    HE   ARG  23           HE       ARG  23  -2.055   8.064  -6.304
  171   HH11  ARG  23          1HH1      ARG  23  -0.195   5.238  -5.483
  172   HH12  ARG  23          2HH1      ARG  23   1.305   6.097  -5.368
  173   HH21  ARG  23          1HH2      ARG  23  -0.086   9.207  -6.155
  174   HH22  ARG  23          2HH2      ARG  23   1.365   8.355  -5.748
  175    H    GLY  24           HN       GLY  24  -3.767   3.771  -0.877
  176    HA2  GLY  24          1HA       GLY  24  -6.638   4.252  -0.640
  177    HA3  GLY  24          2HA       GLY  24  -5.787   2.783  -0.184
  178    H    CYS  25           HN       CYS  25  -3.858   3.714   1.514
  179    HA   CYS  25           HA       CYS  25  -5.486   4.720   3.747
  180    HB2  CYS  25          2HB       CYS  25  -3.503   3.763   5.112
  181    HB3  CYS  25          3HB       CYS  25  -4.650   2.637   4.393
  182    H    ASN  26           HN       ASN  26  -2.826   5.448   1.711
  183    HA   ASN  26           HA       ASN  26  -1.672   7.418   1.480
  184    HB2  ASN  26          2HB       ASN  26  -3.778   8.274   2.931
  185    HB3  ASN  26          3HB       ASN  26  -2.489   8.537   4.102
  186   HD21  ASN  26          1HD2      ASN  26  -3.397   9.178   0.749
  187   HD22  ASN  26          2HD2      ASN  26  -2.596  10.705   0.640
  188    H    HIS  27           HN       HIS  27  -0.964   4.980   3.145
  189    HA   HIS  27           HA       HIS  27   1.138   6.175   4.819
  190    HB2  HIS  27          2HB       HIS  27   0.014   3.365   4.829
  191    HB3  HIS  27          3HB       HIS  27   1.293   3.950   5.890
  192    HD1  HIS  27          1HD       HIS  27   0.111   6.605   6.809
  193    HD2  HIS  27          2HD       HIS  27  -2.081   3.087   6.530
  194    HE1  HIS  27          1HE       HIS  27  -1.836   6.900   8.373
  195    H    LEU  28           HN       LEU  28   3.253   5.109   4.810
  196    HA   LEU  28           HA       LEU  28   4.172   4.700   2.130
  197    HB2  LEU  28          2HB       LEU  28   5.439   4.795   4.828
  198    HB3  LEU  28          3HB       LEU  28   6.348   4.125   3.474
  199    HG   LEU  28           HG       LEU  28   5.229   6.923   3.642
  200   HD11  LEU  28          1HD1      LEU  28   8.094   6.633   3.359
  201   HD12  LEU  28          2HD1      LEU  28   7.498   5.876   4.836
  202   HD13  LEU  28          3HD1      LEU  28   7.162   7.579   4.520
  203   HD21  LEU  28          1HD2      LEU  28   7.059   6.892   1.622
  204   HD22  LEU  28          2HD2      LEU  28   5.311   6.787   1.407
  205   HD23  LEU  28          3HD2      LEU  28   6.287   5.318   1.434
  206    H    VAL  29           HN       VAL  29   5.140   2.846   1.257
  207    HA   VAL  29           HA       VAL  29   5.052   0.353   2.727
  208    HB   VAL  29           HB       VAL  29   3.732  -0.090   0.190
  209   HG11  VAL  29          1HG1      VAL  29   2.738  -1.723   1.362
  210   HG12  VAL  29          2HG1      VAL  29   3.908  -1.316   2.619
  211   HG13  VAL  29          3HG1      VAL  29   2.280  -0.638   2.674
  212   HG21  VAL  29          1HG2      VAL  29   2.892   2.217   0.698
  213   HG22  VAL  29          2HG2      VAL  29   1.639   0.982   0.590
  214   HG23  VAL  29          3HG2      VAL  29   2.171   1.561   2.169
  215    H    CYS  30           HN       CYS  30   6.909  -0.609   2.271
  216    HA   CYS  30           HA       CYS  30   8.735   0.119   0.356
  217    HB2  CYS  30          2HB       CYS  30   9.791  -2.075   0.704
  218    HB3  CYS  30          3HB       CYS  30   9.287  -1.354   2.229
  219    H    ARG  31           HN       ARG  31   9.570  -1.525  -1.386
  220    HA   ARG  31           HA       ARG  31   7.460  -1.720  -3.344
  221    HB2  ARG  31          2HB       ARG  31   9.187  -2.199  -4.927
  222    HB3  ARG  31          3HB       ARG  31   9.782  -0.925  -3.869
  223    HG2  ARG  31          2HG       ARG  31  11.220  -2.402  -2.730
  224    HG3  ARG  31          3HG       ARG  31  10.434  -3.821  -3.425
  225    HD2  ARG  31          2HD       ARG  31  11.901  -3.797  -5.090
  226    HD3  ARG  31          3HD       ARG  31  11.307  -2.209  -5.574
  227    HE   ARG  31           HE       ARG  31  13.125  -1.937  -3.438
  228   HH11  ARG  31          1HH1      ARG  31  13.022  -2.715  -6.829
  229   HH12  ARG  31          2HH1      ARG  31  14.628  -2.142  -7.142
  230   HH21  ARG  31          1HH2      ARG  31  15.239  -1.179  -3.837
  231   HH22  ARG  31          2HH2      ARG  31  15.888  -1.269  -5.440
  232    H    ASP  32           HN       ASP  32   7.852  -3.575  -0.882
  233    HA   ASP  32           HA       ASP  32   7.529  -6.095  -2.377
  234    HB2  ASP  32          2HB       ASP  32   9.564  -6.259  -1.119
  235    HB3  ASP  32          3HB       ASP  32   8.786  -5.626   0.330
  236    H    CYS  33           HN       CYS  33   6.069  -3.815  -0.395
  237    HA   CYS  33           HA       CYS  33   4.089  -5.740   0.613
  238    HB2  CYS  33          2HB       CYS  33   4.848  -2.956   1.480
  239    HB3  CYS  33          3HB       CYS  33   3.346  -3.711   2.004
  240    H    ARG  34           HN       ARG  34   4.459  -4.235  -2.108
  241    HA   ARG  34           HA       ARG  34   1.818  -2.978  -2.259
  242    HB2  ARG  34          2HB       ARG  34   3.621  -3.049  -4.620
  243    HB3  ARG  34          3HB       ARG  34   2.574  -1.760  -4.042
  244    HG2  ARG  34          2HG       ARG  34   4.145  -1.128  -2.367
  245    HG3  ARG  34          3HG       ARG  34   5.136  -2.554  -2.683
  246    HD2  ARG  34          2HD       ARG  34   4.585  -0.437  -4.751
  247    HD3  ARG  34          3HD       ARG  34   5.974  -0.385  -3.666
  248    HE   ARG  34           HE       ARG  34   5.987  -2.876  -4.889
  249   HH11  ARG  34          1HH1      ARG  34   6.271   0.469  -5.814
  250   HH12  ARG  34          2HH1      ARG  34   7.278   0.139  -7.185
  251   HH21  ARG  34          1HH2      ARG  34   7.314  -3.323  -6.690
  252   HH22  ARG  34          2HH2      ARG  34   7.871  -2.018  -7.682
  253    H    ILE  35           HN       ILE  35   0.172  -3.784  -3.459
  254    HA   ILE  35           HA       ILE  35   0.616  -6.419  -4.693
  255    HB   ILE  35           HB       ILE  35  -1.695  -5.231  -3.238
  256   HG12  ILE  35          2HG1      ILE  35  -1.827  -7.673  -2.491
  257   HG13  ILE  35          3HG1      ILE  35  -0.308  -7.907  -3.348
  258   HG21  ILE  35          1HG2      ILE  35  -1.893  -6.954  -5.650
  259   HG22  ILE  35          2HG2      ILE  35  -2.985  -7.276  -4.304
  260   HG23  ILE  35          3HG2      ILE  35  -2.976  -5.689  -5.071
  261   HD11  ILE  35          1HD1      ILE  35  -0.404  -5.675  -1.423
  262   HD12  ILE  35          2HD1      ILE  35  -0.445  -7.308  -0.758
  263   HD13  ILE  35          3HD1      ILE  35   0.895  -6.810  -1.790
  264    H    GLN  36           HN       GLN  36   1.093  -5.963  -6.788
  265    HA   GLN  36           HA       GLN  36   0.373  -3.971  -8.432
  266    HB2  GLN  36          2HB       GLN  36   1.058  -6.775  -8.813
  267    HB3  GLN  36          3HB       GLN  36   0.020  -6.164 -10.096
  268    HG2  GLN  36          2HG       GLN  36   2.748  -5.233  -9.287
  269    HG3  GLN  36          3HG       GLN  36   2.191  -5.803 -10.859
  270   HE21  GLN  36          1HE2      GLN  36  -0.237  -4.257 -10.831
  271   HE22  GLN  36          2HE2      GLN  36   0.216  -2.611 -11.097
  272    H    GLU  37           HN       GLU  37  -1.586  -3.010  -8.325
  273    HA   GLU  37           HA       GLU  37  -4.022  -4.563  -8.332
  274    HB2  GLU  37          2HB       GLU  37  -3.402  -1.624  -8.227
  275    HB3  GLU  37          3HB       GLU  37  -5.044  -2.191  -8.496
  276    HG2  GLU  37          2HG       GLU  37  -3.343  -2.932  -6.128
  277    HG3  GLU  37          3HG       GLU  37  -4.558  -1.656  -6.138
  278    H    SER  38           HN       SER  38  -5.763  -4.109  -9.897
  279    HA   SER  38           HA       SER  38  -4.668  -4.085 -12.603
  280    HB2  SER  38          2HB       SER  38  -6.944  -5.335 -11.290
  281    HB3  SER  38          3HB       SER  38  -7.412  -4.537 -12.791
  282    HG   SER  38           HG       SER  38  -5.664  -5.708 -13.796
  283    H    ASN  39           HN       ASN  39  -5.358  -1.713 -10.692
  284    HA   ASN  39           HA       ASN  39  -7.080  -0.217 -12.545
  285    HB2  ASN  39          2HB       ASN  39  -7.515  -0.404  -9.976
  286    HB3  ASN  39          3HB       ASN  39  -6.242   0.807  -9.851
  287   HD21  ASN  39          1HD2      ASN  39  -6.718   2.879 -10.232
  288   HD22  ASN  39          2HD2      ASN  39  -8.253   3.456 -10.775
  289    H    GLY  40           HN       GLY  40  -4.233  -0.813 -13.004
  290    HA2  GLY  40          1HA       GLY  40  -2.448   0.298 -13.935
  291    HA3  GLY  40          2HA       GLY  40  -3.426   1.758 -13.896
  292    H    THR  41           HN       THR  41  -3.125   0.234 -10.877
  293    HA   THR  41           HA       THR  41  -0.771   1.802 -10.129
  294    HB   THR  41           HB       THR  41  -2.890   3.148  -9.694
  295    HG1  THR  41          1HG       THR  41  -0.995   3.665  -8.594
  296   HG21  THR  41          1HG2      THR  41  -4.465   2.471  -8.209
  297   HG22  THR  41          2HG2      THR  41  -3.302   1.601  -7.207
  298   HG23  THR  41          3HG2      THR  41  -3.908   0.871  -8.693
  299    H    TRP  42           HN       TRP  42  -1.203   1.418  -7.312
  300    HA   TRP  42           HA       TRP  42  -1.299  -1.477  -6.966
  301    HB2  TRP  42          2HB       TRP  42   0.862  -1.532  -5.798
  302    HB3  TRP  42          3HB       TRP  42   1.053  -1.017  -7.472
  303    HD1  TRP  42          1HD       TRP  42   2.211   1.265  -7.884
  304    HE1  TRP  42          1HE       TRP  42   3.144   3.119  -6.362
  305    HE3  TRP  42          3HE       TRP  42   0.354  -0.353  -3.405
  306    HZ2  TRP  42          2HZ       TRP  42   3.099   3.804  -3.624
  307    HZ3  TRP  42          3HZ       TRP  42   0.846   0.957  -1.381
  308    HH2  TRP  42          2HH       TRP  42   2.191   2.993  -1.491
  309    H    ARG  43           HN       ARG  43  -1.530  -2.140  -4.764
  310    HA   ARG  43           HA       ARG  43  -2.077  -0.010  -2.829
  311    HB2  ARG  43          2HB       ARG  43  -4.002  -2.170  -3.675
  312    HB3  ARG  43          3HB       ARG  43  -4.151  -1.328  -2.140
  313    HG2  ARG  43          2HG       ARG  43  -3.873   0.440  -4.455
  314    HG3  ARG  43          3HG       ARG  43  -5.326  -0.561  -4.466
  315    HD2  ARG  43          2HD       ARG  43  -5.497   0.231  -1.966
  316    HD3  ARG  43          3HD       ARG  43  -4.487   1.556  -2.544
  317    HE   ARG  43           HE       ARG  43  -6.305   2.409  -3.633
  318   HH11  ARG  43          1HH1      ARG  43  -6.927  -0.923  -2.836
  319   HH12  ARG  43          2HH1      ARG  43  -8.582  -0.872  -3.345
  320   HH21  ARG  43          1HH2      ARG  43  -8.483   2.489  -4.306
  321   HH22  ARG  43          2HH2      ARG  43  -9.466   1.069  -4.182
  322    H    CYS  44           HN       CYS  44  -1.364  -0.462  -0.833
  323    HA   CYS  44           HA       CYS  44   0.410  -2.425  -0.229
  324    HB2  CYS  44          2HB       CYS  44   0.048  -1.954   2.099
  325    HB3  CYS  44          3HB       CYS  44  -0.157  -0.451   1.204
  326    H    LYS  45           HN       LYS  45   0.187  -4.257   1.347
  327    HA   LYS  45           HA       LYS  45  -1.697  -6.143   0.331
  328    HB2  LYS  45          2HB       LYS  45  -0.289  -6.773   2.852
  329    HB3  LYS  45          3HB       LYS  45  -0.436  -7.718   1.377
  330    HG2  LYS  45          2HG       LYS  45   1.182  -5.986   0.367
  331    HG3  LYS  45          3HG       LYS  45   1.529  -5.566   2.046
  332    HD2  LYS  45          2HD       LYS  45   3.128  -7.168   1.689
  333    HD3  LYS  45          3HD       LYS  45   1.808  -8.176   2.288
  334    HE2  LYS  45          2HE       LYS  45   1.146  -8.507  -0.132
  335    HE3  LYS  45          3HE       LYS  45   2.683  -7.758  -0.562
  336    HZ1  LYS  45          1HZ       LYS  45   3.791  -9.499   0.773
  337    HZ2  LYS  45          2HZ       LYS  45   2.948 -10.116  -0.556
  338    HZ3  LYS  45          3HZ       LYS  45   2.294 -10.254   0.998
  339    H    VAL  46           HN       VAL  46  -2.003  -3.719   2.577
  340    HA   VAL  46           HA       VAL  46  -3.887  -5.155   4.287
  341    HB   VAL  46           HB       VAL  46  -3.183  -2.234   4.491
  342   HG11  VAL  46          1HG1      VAL  46  -4.345  -4.281   6.359
  343   HG12  VAL  46          2HG1      VAL  46  -3.674  -2.752   6.932
  344   HG13  VAL  46          3HG1      VAL  46  -5.049  -2.755   5.827
  345   HG21  VAL  46          1HG2      VAL  46  -1.184  -3.881   4.487
  346   HG22  VAL  46          2HG2      VAL  46  -1.302  -2.681   5.774
  347   HG23  VAL  46          3HG2      VAL  46  -1.782  -4.351   6.079
  348    H    CYS  47           HN       CYS  47  -3.836  -3.039   1.580
  349    HA   CYS  47           HA       CYS  47  -6.669  -2.362   1.922
  350    HB2  CYS  47          2HB       CYS  47  -4.479  -1.244   0.185
  351    HB3  CYS  47          3HB       CYS  47  -6.174  -0.893  -0.138
  352    H    ALA  48           HN       ALA  48  -4.446  -3.606  -0.568
  353    HA   ALA  48           HA       ALA  48  -6.489  -4.379  -2.370
  354    HB1  ALA  48          1HB       ALA  48  -3.888  -5.807  -2.404
  355    HB2  ALA  48          2HB       ALA  48  -4.813  -5.102  -3.730
  356    HB3  ALA  48          3HB       ALA  48  -3.872  -4.062  -2.662
  357    H    LYS  49           HN       LYS  49  -4.911  -5.981   0.312
  358    HA   LYS  49           HA       LYS  49  -6.714  -8.278  -0.078
  359    HB2  LYS  49          2HB       LYS  49  -3.826  -8.237   0.091
  360    HB3  LYS  49          3HB       LYS  49  -4.512  -9.203   1.390
  361    HG2  LYS  49          2HG       LYS  49  -5.788  -9.784  -1.134
  362    HG3  LYS  49          3HG       LYS  49  -4.039 -10.006  -1.222
  363    HD2  LYS  49          2HD       LYS  49  -5.420 -11.092   1.164
  364    HD3  LYS  49          3HD       LYS  49  -5.698 -11.919  -0.370
  365    HE2  LYS  49          2HE       LYS  49  -3.839 -13.043   0.305
  366    HE3  LYS  49          3HE       LYS  49  -3.057 -11.699  -0.526
  367    HZ1  LYS  49          1HZ       LYS  49  -1.956 -11.563   1.419
  368    HZ2  LYS  49          2HZ       LYS  49  -3.184 -12.303   2.317
  369    HZ3  LYS  49          3HZ       LYS  49  -3.308 -10.668   1.900
  370    H    GLU  50           HN       GLU  50  -7.505  -9.276   1.814
  371    HA   GLU  50           HA       GLU  50  -7.129  -7.720   4.286
  372    HB2  GLU  50          2HB       GLU  50  -9.439  -7.729   2.833
  373    HB3  GLU  50          3HB       GLU  50  -9.735  -9.048   3.957
  374    HG2  GLU  50          2HG       GLU  50  -9.230  -7.529   5.829
  375    HG3  GLU  50          3HG       GLU  50  -9.030  -6.212   4.675
  376    H    ILE  51           HN       ILE  51  -5.836 -10.186   3.371
  377    HA   ILE  51           HA       ILE  51  -5.369 -12.320   4.053
  378    HB   ILE  51           HB       ILE  51  -6.183 -11.440   6.806
  379   HG12  ILE  51          2HG1      ILE  51  -4.959  -9.579   5.652
  380   HG13  ILE  51          3HG1      ILE  51  -4.125 -10.223   7.062
  381   HG21  ILE  51          1HG2      ILE  51  -4.502 -12.886   7.557
  382   HG22  ILE  51          2HG2      ILE  51  -5.276 -13.759   6.235
  383   HG23  ILE  51          3HG2      ILE  51  -3.730 -12.953   5.973
  384   HD11  ILE  51          1HD1      ILE  51  -3.496 -11.146   4.281
  385   HD12  ILE  51          2HD1      ILE  51  -2.727  -9.735   5.009
  386   HD13  ILE  51          3HD1      ILE  51  -2.532 -11.324   5.746
  387    H    GLU  52           HN       GLU  52  -7.267 -13.153   2.917
  388    HA   GLU  52           HA       GLU  52  -9.259 -14.276   2.758
  389    HB2  GLU  52          2HB       GLU  52  -7.941 -16.044   3.658
  390    HB3  GLU  52          3HB       GLU  52  -8.033 -15.378   5.282
  391    HG2  GLU  52          2HG       GLU  52 -10.070 -16.257   5.681
  392    HG3  GLU  52          3HG       GLU  52 -10.601 -16.070   4.011
  393    H    LEU  53           HN       LEU  53  -9.449 -14.475   6.234
  394    HA   LEU  53           HA       LEU  53 -12.102 -13.567   6.337
  395    HB2  LEU  53          2HB       LEU  53 -10.387 -14.809   8.065
  396    HB3  LEU  53          3HB       LEU  53 -10.553 -13.214   8.796
  397    HG   LEU  53           HG       LEU  53 -12.252 -14.255   9.871
  398   HD11  LEU  53          1HD1      LEU  53 -13.136 -12.503   8.154
  399   HD12  LEU  53          2HD1      LEU  53 -14.269 -13.508   9.058
  400   HD13  LEU  53          3HD1      LEU  53 -13.871 -13.912   7.388
  401   HD21  LEU  53          1HD2      LEU  53 -13.590 -15.949   8.073
  402   HD22  LEU  53          2HD2      LEU  53 -12.565 -16.408   9.435
  403   HD23  LEU  53          3HD2      LEU  53 -11.865 -16.223   7.826