*HEADER    METAL BINDING PROTEIN                   08-NOV-19   6L99              
*TITLE     ZINC FINGER OF RING FINGER PROTEIN 144A                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE RNF144A;                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: RING FINGER PROTEIN 144A,UBCM4-INTERACTING PROTEIN 4,       
*COMPND   5 UBIQUITIN-CONJUGATING ENZYME 7-INTERACTING PROTEIN 4;                
*COMPND   6 EC: 2.3.2.31;                                                        
*COMPND   7 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    RING FINGER PROTEIN 144A, ZINC FINGER, METAL BINDING PROTEIN          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.MIYAMOTO                                                            
*REVDAT   1   11-NOV-20 6L99    0                                                
# Restraints file 1: RNF144.upl
 21 THR  HA     22 THR  HN      2.85         
 64 LEU  HA     65 GLN  HN      3.15           
  6 VAL  HA     15 TYR  HN      5.25           
 29 ILE  HA     30 PHE  HN      3.10           
 45 GLU  HA     45 GLU  HG3     4.11            
 35 LEU  HA     38 TYR  HB3     3.20         
 40 GLU  HA     73 VAL  QG1     4.67           
 39 VAL  HA     49 THR  QG2     5.33           
 21 THR  HA     21 THR  QG2     3.13           
 36 LYS  HA     36 LYS  QD      4.55           
 40 GLU  HA     40 GLU  QG      3.12             
 61 GLN  HA     62 GLY  HN      3.34           
 51 ILE  HA     52 SER  HN      2.76           
 50 ALA  HA     51 ILE  HN      3.11           
 27 GLN  HA     28 CYSS HN      3.56           
 63 HIS  HA     64 LEU  HN      3.00            
 52 SER  HA     64 LEU  HN      4.33    
 32 THR  HA     35 LEU  HN      4.32        
 31 CYSS HA     32 THR  HN      3.11           
 20 MET  HA     32 THR  HN      3.42        
  8 CYSS HA     10 LEU  HN      4.55        
 34 CYSS HA     38 TYR  HN      4.42            
 55 ASP  HA     57 ALA  HN      4.43        
 16 PRO  HA     17 VAL  HN      2.53         
 58 CYSS HA     61 GLN  HN      4.56          
 18 GLU  HA     20 MET  HN      4.77        
 17 VAL  HA     20 MET  HN      4.87            
 66 GLU  HA     69 ILE  HN      4.53     
 67 ASN  HA     70 GLU  HN      4.13         
 36 LYS  HA     39 VAL  HN      4.67         
 55 ASP  HA     56 ALA  HN      2.74         
  6 VAL  HA      7 SER  HN      2.25           
 32 THR  HA     36 LYS  HN      4.25            
 60 LYS  HA     60 LYS  QD      4.67            
 15 TYR  HA     16 PRO  QG      4.83       
 66 GLU  HA     69 ILE  HB      3.23       
 36 LYS  HA     39 VAL  QG2     4.56          
 37 GLN  HA     37 GLN  HG3     4.42       
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           HN       ALA   1 -28.081 -15.734   5.563
    2    HA   ALA   1           HA       ALA   1 -26.267 -16.709   6.695
    3    HB1  ALA   1          1HB       ALA   1 -28.145 -18.412   5.534
    4    HB2  ALA   1          2HB       ALA   1 -26.583 -19.183   5.251
    5    HB3  ALA   1          3HB       ALA   1 -27.076 -18.768   6.892
    6    H    LEU   2           HN       LEU   2 -24.174 -16.303   6.432
    7    HA   LEU   2           HA       LEU   2 -22.055 -16.307   5.607
    8    HB2  LEU   2          2HB       LEU   2 -23.097 -18.849   5.107
    9    HB3  LEU   2          3HB       LEU   2 -22.323 -18.363   3.601
   10    HG   LEU   2           HG       LEU   2 -20.808 -19.666   4.987
   11   HD11  LEU   2          1HD1      LEU   2 -19.650 -18.174   3.631
   12   HD12  LEU   2          2HD1      LEU   2 -18.992 -17.863   5.236
   13   HD13  LEU   2          3HD1      LEU   2 -20.190 -16.767   4.548
   14   HD21  LEU   2          1HD2      LEU   2 -21.910 -18.865   7.150
   15   HD22  LEU   2          2HD2      LEU   2 -20.856 -17.458   7.021
   16   HD23  LEU   2          3HD2      LEU   2 -20.158 -19.073   7.156
   17    H    ASP   3           HN       ASP   3 -21.191 -14.893   4.241
   18    HA   ASP   3           HA       ASP   3 -21.759 -14.883   1.443
   19    HB2  ASP   3          2HB       ASP   3 -22.724 -12.615   1.330
   20    HB3  ASP   3          3HB       ASP   3 -23.775 -13.731   2.199
   21    HA   PRO   4           HA       PRO   4 -17.731 -13.117   1.469
   22    HB2  PRO   4          2HB       PRO   4 -17.678 -12.096  -1.046
   23    HB3  PRO   4          3HB       PRO   4 -17.567 -13.828  -0.710
   24    HG2  PRO   4          2HG       PRO   4 -19.941 -12.210  -1.555
   25    HG3  PRO   4          3HG       PRO   4 -19.415 -13.806  -2.121
   26    HD2  PRO   4          2HD       PRO   4 -21.404 -13.486  -0.312
   27    HD3  PRO   4          3HD       PRO   4 -20.319 -14.891  -0.299
   28    H    LEU   5           HN       LEU   5 -18.223 -11.476   3.060
   29    HA   LEU   5           HA       LEU   5 -19.466  -9.057   2.658
   30    HB2  LEU   5          2HB       LEU   5 -17.794 -10.210   4.610
   31    HB3  LEU   5          3HB       LEU   5 -17.104  -8.635   4.224
   32    HG   LEU   5           HG       LEU   5 -19.364  -7.640   4.694
   33   HD11  LEU   5          1HD1      LEU   5 -19.893 -10.419   5.732
   34   HD12  LEU   5          2HD1      LEU   5 -20.746  -9.591   4.430
   35   HD13  LEU   5          3HD1      LEU   5 -20.885  -9.005   6.087
   36   HD21  LEU   5          1HD2      LEU   5 -17.580  -7.484   6.314
   37   HD22  LEU   5          2HD2      LEU   5 -17.943  -9.100   6.918
   38   HD23  LEU   5          3HD2      LEU   5 -19.105  -7.792   7.144
   39    H    VAL   6           HN       VAL   6 -15.924  -9.480   2.529
   40    HA   VAL   6           HA       VAL   6 -14.305  -8.411   1.338
   41    HB   VAL   6           HB       VAL   6 -16.401  -8.941  -0.509
   42   HG11  VAL   6          1HG1      VAL   6 -16.664  -6.479  -0.596
   43   HG12  VAL   6          2HG1      VAL   6 -14.978  -6.348  -1.098
   44   HG13  VAL   6          3HG1      VAL   6 -16.144  -7.177  -2.130
   45   HG21  VAL   6          1HG2      VAL   6 -13.827  -9.561  -0.295
   46   HG22  VAL   6          2HG2      VAL   6 -14.680  -9.624  -1.838
   47   HG23  VAL   6          3HG2      VAL   6 -13.675  -8.230  -1.442
   48    H    SER   7           HN       SER   7 -13.551  -6.292   0.586
   49    HA   SER   7           HA       SER   7 -15.140  -3.963   0.813
   50    HB2  SER   7          2HB       SER   7 -13.963  -4.996   3.274
   51    HB3  SER   7          3HB       SER   7 -13.439  -3.350   2.919
   52    HG   SER   7           HG       SER   7 -15.735  -4.111   3.950
   53    H    CYS   8           HN       CYS   8 -11.858  -4.335   2.068
   54    HA   CYS   8           HA       CYS   8 -10.655  -2.285   0.769
   55    HB2  CYS   8          2HB       CYS   8  -9.622  -3.877   2.455
   56    HB3  CYS   8          3HB       CYS   8  -9.296  -4.960   1.106
   57    H    LYS   9           HN       LYS   9  -9.221  -2.177  -1.093
   58    HA   LYS   9           HA       LYS   9 -10.110  -3.933  -3.287
   59    HB2  LYS   9          2HB       LYS   9  -9.152  -1.109  -3.685
   60    HB3  LYS   9          3HB       LYS   9 -10.076  -2.118  -4.791
   61    HG2  LYS   9          2HG       LYS   9 -11.532  -1.758  -2.347
   62    HG3  LYS   9          3HG       LYS   9 -11.044  -0.193  -3.002
   63    HD2  LYS   9          2HD       LYS   9 -12.473  -2.354  -4.550
   64    HD3  LYS   9          3HD       LYS   9 -13.247  -0.936  -3.839
   65    HE2  LYS   9          2HE       LYS   9 -12.421   0.473  -5.415
   66    HE3  LYS   9          3HE       LYS   9 -10.927  -0.444  -5.608
   67    HZ1  LYS   9          1HZ       LYS   9 -12.578  -0.456  -7.525
   68    HZ2  LYS   9          2HZ       LYS   9 -13.513  -1.497  -6.574
   69    HZ3  LYS   9          3HZ       LYS   9 -11.950  -1.949  -7.037
   70    H    LEU  10           HN       LEU  10  -7.441  -2.291  -1.743
   71    HA   LEU  10           HA       LEU  10  -5.451  -2.782  -3.662
   72    HB2  LEU  10          2HB       LEU  10  -5.445  -2.258  -0.722
   73    HB3  LEU  10          3HB       LEU  10  -3.949  -2.730  -1.524
   74    HG   LEU  10           HG       LEU  10  -5.570  -0.231  -1.909
   75   HD11  LEU  10          1HD1      LEU  10  -2.740  -0.853  -1.108
   76   HD12  LEU  10          2HD1      LEU  10  -3.984  -0.023  -0.174
   77   HD13  LEU  10          3HD1      LEU  10  -3.271   0.762  -1.582
   78   HD21  LEU  10          1HD2      LEU  10  -3.549   0.101  -3.643
   79   HD22  LEU  10          2HD2      LEU  10  -5.142  -0.494  -4.112
   80   HD23  LEU  10          3HD2      LEU  10  -3.821  -1.631  -3.833
   81    H    CYS  11           HN       CYS  11  -6.971  -4.840  -1.333
   82    HA   CYS  11           HA       CYS  11  -5.259  -7.055  -2.226
   83    HB2  CYS  11          2HB       CYS  11  -5.077  -7.949  -0.017
   84    HB3  CYS  11          3HB       CYS  11  -4.607  -6.255   0.073
   85    H    LEU  12           HN       LEU  12  -8.257  -5.810  -2.167
   86    HA   LEU  12           HA       LEU  12 -10.402  -6.640  -2.147
   87    HB2  LEU  12          2HB       LEU  12  -9.026  -8.817  -3.712
   88    HB3  LEU  12          3HB       LEU  12 -10.731  -8.379  -3.797
   89    HG   LEU  12           HG       LEU  12  -9.024  -6.122  -4.408
   90   HD11  LEU  12          1HD1      LEU  12  -7.394  -7.452  -5.343
   91   HD12  LEU  12          2HD1      LEU  12  -8.467  -7.191  -6.717
   92   HD13  LEU  12          3HD1      LEU  12  -8.538  -8.707  -5.819
   93   HD21  LEU  12          1HD2      LEU  12 -11.054  -7.597  -6.079
   94   HD22  LEU  12          2HD2      LEU  12 -10.484  -5.944  -6.310
   95   HD23  LEU  12          3HD2      LEU  12 -11.448  -6.354  -4.890
   96    H    GLY  13           HN       GLY  13  -8.706  -7.561   0.099
   97    HA2  GLY  13          1HA       GLY  13  -9.296 -10.304   0.615
   98    HA3  GLY  13          2HA       GLY  13  -8.720  -9.128   1.788
   99    H    GLU  14           HN       GLU  14 -10.175 -10.175   3.288
  100    HA   GLU  14           HA       GLU  14 -12.907  -9.120   3.037
  101    HB2  GLU  14          2HB       GLU  14 -12.107 -11.888   3.165
  102    HB3  GLU  14          3HB       GLU  14 -13.084 -11.474   4.568
  103    HG2  GLU  14          2HG       GLU  14 -14.938 -11.513   3.365
  104    HG3  GLU  14          3HG       GLU  14 -14.264 -10.381   2.194
  105    H    TYR  15           HN       TYR  15 -13.277  -7.745   4.633
  106    HA   TYR  15           HA       TYR  15 -12.700  -8.427   7.364
  107    HB2  TYR  15          2HB       TYR  15 -11.461  -5.841   6.541
  108    HB3  TYR  15          3HB       TYR  15 -11.045  -6.910   7.876
  109    HD1  TYR  15          1HD       TYR  15 -10.609  -6.267   4.288
  110    HD2  TYR  15          2HD       TYR  15  -9.518  -8.757   7.562
  111    HE1  TYR  15          1HE       TYR  15  -8.762  -7.198   2.957
  112    HE2  TYR  15          2HE       TYR  15  -7.668  -9.693   6.240
  113    HH   TYR  15           HH       TYR  15  -6.237  -8.660   4.085
  114    HA   PRO  16           HA       PRO  16 -16.202  -5.872   8.058
  115    HB2  PRO  16          2HB       PRO  16 -15.756  -5.068  10.613
  116    HB3  PRO  16          3HB       PRO  16 -16.239  -6.717  10.195
  117    HG2  PRO  16          2HG       PRO  16 -13.514  -5.638  10.808
  118    HG3  PRO  16          3HG       PRO  16 -14.265  -7.151  11.348
  119    HD2  PRO  16          2HD       PRO  16 -12.482  -7.054   9.312
  120    HD3  PRO  16          3HD       PRO  16 -13.811  -8.230   9.362
  121    H    VAL  17           HN       VAL  17 -16.495  -3.638   9.577
  122    HA   VAL  17           HA       VAL  17 -15.080  -1.652   7.985
  123    HB   VAL  17           HB       VAL  17 -17.670  -1.805   9.153
  124   HG11  VAL  17          1HG1      VAL  17 -16.698  -0.695  11.109
  125   HG12  VAL  17          2HG1      VAL  17 -16.096   0.599  10.073
  126   HG13  VAL  17          3HG1      VAL  17 -17.833   0.356  10.263
  127   HG21  VAL  17          1HG2      VAL  17 -16.840  -0.960   6.880
  128   HG22  VAL  17          2HG2      VAL  17 -18.173  -0.092   7.641
  129   HG23  VAL  17          3HG2      VAL  17 -16.540   0.570   7.706
  130    H    GLU  18           HN       GLU  18 -15.018  -2.989  11.147
  131    HA   GLU  18           HA       GLU  18 -13.718  -0.721  12.377
  132    HB2  GLU  18          2HB       GLU  18 -14.436  -3.489  13.295
  133    HB3  GLU  18          3HB       GLU  18 -13.365  -2.476  14.252
  134    HG2  GLU  18          2HG       GLU  18 -15.631  -0.928  13.546
  135    HG3  GLU  18          3HG       GLU  18 -16.195  -2.479  14.165
  136    H    GLN  19           HN       GLN  19 -12.772  -3.340  10.455
  137    HA   GLN  19           HA       GLN  19 -10.025  -3.311  11.474
  138    HB2  GLN  19          2HB       GLN  19 -11.536  -5.173   9.659
  139    HB3  GLN  19          3HB       GLN  19  -9.780  -5.209   9.744
  140    HG2  GLN  19          2HG       GLN  19 -11.636  -6.487  11.429
  141    HG3  GLN  19          3HG       GLN  19  -9.876  -6.484  11.542
  142   HE21  GLN  19          1HE2      GLN  19 -12.786  -4.764  12.517
  143   HE22  GLN  19          2HE2      GLN  19 -12.121  -4.080  13.956
  144    H    MET  20           HN       MET  20 -11.536  -1.288   9.674
  145    HA   MET  20           HA       MET  20  -9.345  -1.017   7.736
  146    HB2  MET  20          2HB       MET  20 -11.887   0.019   6.750
  147    HB3  MET  20          3HB       MET  20 -10.697  -0.994   5.943
  148    HG2  MET  20          2HG       MET  20 -11.709  -2.844   7.521
  149    HG3  MET  20          3HG       MET  20 -13.099  -1.760   7.507
  150    HE1  MET  20          1HE       MET  20 -10.936  -2.642   3.789
  151    HE2  MET  20          2HE       MET  20 -10.352  -3.008   5.412
  152    HE3  MET  20          3HE       MET  20 -11.140  -4.263   4.455
  153    H    THR  21           HN       THR  21  -9.526   1.279   6.682
  154    HA   THR  21           HA       THR  21 -10.387   3.269   8.651
  155    HB   THR  21           HB       THR  21  -7.583   2.998   7.575
  156    HG1  THR  21          1HG       THR  21  -8.201   3.589  10.238
  157   HG21  THR  21          1HG2      THR  21  -7.079   5.181   8.484
  158   HG22  THR  21          2HG2      THR  21  -8.745   5.375   9.030
  159   HG23  THR  21          3HG2      THR  21  -8.382   5.331   7.305
  160    H    THR  22           HN       THR  22 -11.054   5.188   7.789
  161    HA   THR  22           HA       THR  22 -11.617   5.230   4.979
  162    HB   THR  22           HB       THR  22 -12.260   6.999   7.292
  163    HG1  THR  22          1HG       THR  22 -13.813   5.520   6.823
  164   HG21  THR  22          1HG2      THR  22 -11.494   8.621   5.674
  165   HG22  THR  22          2HG2      THR  22 -13.257   8.661   5.736
  166   HG23  THR  22          3HG2      THR  22 -12.439   7.850   4.402
  167    H    ILE  23           HN       ILE  23 -11.020   6.946   3.518
  168    HA   ILE  23           HA       ILE  23  -8.237   7.511   3.577
  169    HB   ILE  23           HB       ILE  23 -10.455   8.436   1.764
  170   HG12  ILE  23          2HG1      ILE  23  -9.756   6.090   1.565
  171   HG13  ILE  23          3HG1      ILE  23  -9.311   7.005   0.129
  172   HG21  ILE  23          1HG2      ILE  23  -8.025   8.967   0.504
  173   HG22  ILE  23          2HG2      ILE  23  -9.191  10.142   1.111
  174   HG23  ILE  23          3HG2      ILE  23  -7.854   9.617   2.135
  175   HD11  ILE  23          1HD1      ILE  23  -7.024   7.262   1.292
  176   HD12  ILE  23          2HD1      ILE  23  -7.565   5.908   2.284
  177   HD13  ILE  23          3HD1      ILE  23  -7.438   5.725   0.535
  178    H    ALA  24           HN       ALA  24 -10.372  10.117   2.700
  179    HA   ALA  24           HA       ALA  24 -10.572  11.699   4.877
  180    HB1  ALA  24          1HB       ALA  24  -8.431  11.880   5.580
  181    HB2  ALA  24          2HB       ALA  24  -7.762  11.565   3.978
  182    HB3  ALA  24          3HB       ALA  24  -8.387  13.167   4.374
  183    H    GLN  25           HN       GLN  25 -11.659  11.298   2.257
  184    HA   GLN  25           HA       GLN  25 -12.411  13.889   1.587
  185    HB2  GLN  25          2HB       GLN  25  -9.874  13.108   0.458
  186    HB3  GLN  25          3HB       GLN  25 -11.050  13.385  -0.819
  187    HG2  GLN  25          2HG       GLN  25 -10.229  15.318   1.335
  188    HG3  GLN  25          3HG       GLN  25  -9.850  15.414  -0.384
  189   HE21  GLN  25          1HE2      GLN  25 -12.078  16.173   2.062
  190   HE22  GLN  25          2HE2      GLN  25 -13.299  16.877   1.063
  191    H    CYS  26           HN       CYS  26 -11.697  10.705   0.202
  192    HA   CYS  26           HA       CYS  26 -14.129  10.847  -1.415
  193    HB2  CYS  26          2HB       CYS  26 -13.304   8.777  -2.463
  194    HB3  CYS  26          3HB       CYS  26 -12.101  10.061  -2.531
  195    H    GLN  27           HN       GLN  27 -12.972   9.539   1.523
  196    HA   GLN  27           HA       GLN  27 -13.931   8.248   3.131
  197    HB2  GLN  27          2HB       GLN  27 -16.409   8.798   1.495
  198    HB3  GLN  27          3HB       GLN  27 -16.424   7.989   3.056
  199    HG2  GLN  27          2HG       GLN  27 -16.813  10.611   2.758
  200    HG3  GLN  27          3HG       GLN  27 -16.098   9.897   4.202
  201   HE21  GLN  27          1HE2      GLN  27 -13.790   9.909   4.393
  202   HE22  GLN  27          2HE2      GLN  27 -12.863  11.138   3.608
  203    H    CYS  28           HN       CYS  28 -12.508   6.719   1.656
  204    HA   CYS  28           HA       CYS  28 -14.173   4.543   0.602
  205    HB2  CYS  28          2HB       CYS  28 -11.281   5.290   0.209
  206    HB3  CYS  28          3HB       CYS  28 -11.895   3.703  -0.246
  207    H    ILE  29           HN       ILE  29 -12.838   2.331   0.890
  208    HA   ILE  29           HA       ILE  29 -12.157   2.106   3.748
  209    HB   ILE  29           HB       ILE  29 -14.463   1.150   2.873
  210   HG12  ILE  29          2HG1      ILE  29 -14.217  -0.699   4.602
  211   HG13  ILE  29          3HG1      ILE  29 -12.533  -0.209   4.756
  212   HG21  ILE  29          1HG2      ILE  29 -13.260  -0.179   1.096
  213   HG22  ILE  29          2HG2      ILE  29 -12.663  -1.212   2.394
  214   HG23  ILE  29          3HG2      ILE  29 -14.397  -1.084   2.096
  215   HD11  ILE  29          1HD1      ILE  29 -14.513   0.729   6.300
  216   HD12  ILE  29          2HD1      ILE  29 -13.045   1.637   5.931
  217   HD13  ILE  29          3HD1      ILE  29 -14.524   1.941   5.019
  218    H    PHE  30           HN       PHE  30 -10.241   1.219   4.135
  219    HA   PHE  30           HA       PHE  30  -9.165  -0.837   2.401
  220    HB2  PHE  30          2HB       PHE  30  -7.699   1.781   2.801
  221    HB3  PHE  30          3HB       PHE  30  -7.038   0.352   2.014
  222    HD1  PHE  30          1HD       PHE  30  -8.349  -0.533  -0.040
  223    HD2  PHE  30          2HD       PHE  30  -8.756   3.399   1.540
  224    HE1  PHE  30          1HE       PHE  30  -9.249   0.236  -2.196
  225    HE2  PHE  30          2HE       PHE  30  -9.658   4.173  -0.613
  226    HZ   PHE  30           HZ       PHE  30  -9.907   2.592  -2.485
  227    H    CYS  31           HN       CYS  31  -8.188  -2.323   3.605
  228    HA   CYS  31           HA       CYS  31  -8.011  -2.184   6.379
  229    HB2  CYS  31          2HB       CYS  31  -6.897  -4.278   6.294
  230    HB3  CYS  31          3HB       CYS  31  -7.992  -4.262   4.916
  231    H    THR  32           HN       THR  32  -6.570  -1.369   7.760
  232    HA   THR  32           HA       THR  32  -4.749   0.521   7.314
  233    HB   THR  32           HB       THR  32  -4.050  -1.684   9.246
  234    HG1  THR  32          1HG       THR  32  -6.141   0.221   9.336
  235   HG21  THR  32          1HG2      THR  32  -3.717   1.318   9.348
  236   HG22  THR  32          2HG2      THR  32  -2.439   0.143   9.035
  237   HG23  THR  32          3HG2      THR  32  -3.233   0.186  10.610
  238    H    LEU  33           HN       LEU  33  -3.933  -2.945   7.242
  239    HA   LEU  33           HA       LEU  33  -1.286  -2.951   6.757
  240    HB2  LEU  33          2HB       LEU  33  -3.336  -4.551   5.232
  241    HB3  LEU  33          3HB       LEU  33  -1.615  -4.922   5.315
  242    HG   LEU  33           HG       LEU  33  -2.370  -4.821   7.966
  243   HD11  LEU  33          1HD1      LEU  33  -4.526  -6.250   6.418
  244   HD12  LEU  33          2HD1      LEU  33  -4.733  -4.723   7.275
  245   HD13  LEU  33          3HD1      LEU  33  -4.348  -6.192   8.172
  246   HD21  LEU  33          1HD2      LEU  33  -2.239  -7.227   6.150
  247   HD22  LEU  33          2HD2      LEU  33  -2.063  -7.234   7.906
  248   HD23  LEU  33          3HD2      LEU  33  -0.856  -6.430   6.900
  249    H    CYS  34           HN       CYS  34  -3.551  -2.967   4.001
  250    HA   CYS  34           HA       CYS  34  -1.625  -2.167   2.116
  251    HB2  CYS  34          2HB       CYS  34  -4.609  -1.736   1.906
  252    HB3  CYS  34          3HB       CYS  34  -3.458  -1.892   0.582
  253    H    LEU  35           HN       LEU  35  -4.375  -0.257   3.353
  254    HA   LEU  35           HA       LEU  35  -3.739   2.185   2.308
  255    HB2  LEU  35          2HB       LEU  35  -5.768   1.624   3.633
  256    HB3  LEU  35          3HB       LEU  35  -4.793   1.737   5.097
  257    HG   LEU  35           HG       LEU  35  -4.483   4.091   4.788
  258   HD11  LEU  35          1HD1      LEU  35  -5.642   3.563   2.085
  259   HD12  LEU  35          2HD1      LEU  35  -4.191   4.463   2.527
  260   HD13  LEU  35          3HD1      LEU  35  -5.785   5.159   2.820
  261   HD21  LEU  35          1HD2      LEU  35  -6.553   4.726   5.445
  262   HD22  LEU  35          2HD2      LEU  35  -6.817   2.982   5.486
  263   HD23  LEU  35          3HD2      LEU  35  -7.351   3.923   4.093
  264    H    LYS  36           HN       LYS  36  -2.028   0.453   4.721
  265    HA   LYS  36           HA       LYS  36  -0.587   2.809   5.655
  266    HB2  LYS  36          2HB       LYS  36  -1.182   1.206   7.352
  267    HB3  LYS  36          3HB       LYS  36  -0.447  -0.106   6.440
  268    HG2  LYS  36          2HG       LYS  36   1.392   2.080   7.048
  269    HG3  LYS  36          3HG       LYS  36   0.741   1.269   8.474
  270    HD2  LYS  36          2HD       LYS  36   1.488  -0.656   6.466
  271    HD3  LYS  36          3HD       LYS  36   2.844   0.411   6.836
  272    HE2  LYS  36          2HE       LYS  36   2.677  -0.107   9.179
  273    HE3  LYS  36          3HE       LYS  36   1.201  -1.034   8.911
  274    HZ1  LYS  36          1HZ       LYS  36   3.842  -1.936   8.816
  275    HZ2  LYS  36          2HZ       LYS  36   3.218  -2.052   7.249
  276    HZ3  LYS  36          3HZ       LYS  36   2.428  -2.820   8.531
  277    H    GLN  37           HN       GLN  37   0.539  -0.425   4.671
  278    HA   GLN  37           HA       GLN  37   3.116   0.131   4.055
  279    HB2  GLN  37          2HB       GLN  37   1.223  -1.909   3.320
  280    HB3  GLN  37          3HB       GLN  37   2.268  -1.544   1.954
  281    HG2  GLN  37          2HG       GLN  37   4.031  -2.529   2.893
  282    HG3  GLN  37          3HG       GLN  37   3.711  -1.810   4.470
  283   HE21  GLN  37          1HE2      GLN  37   4.084  -3.658   5.629
  284   HE22  GLN  37          2HE2      GLN  37   3.048  -5.039   5.570
  285    H    TYR  38           HN       TYR  38   0.330   1.217   2.339
  286    HA   TYR  38           HA       TYR  38   1.726   1.888  -0.086
  287    HB2  TYR  38          2HB       TYR  38  -0.422   1.710  -0.739
  288    HB3  TYR  38          3HB       TYR  38  -1.031   1.971   0.892
  289    HD1  TYR  38          1HD       TYR  38  -2.648   3.620   0.818
  290    HD2  TYR  38          2HD       TYR  38   0.927   4.153  -1.425
  291    HE1  TYR  38          1HE       TYR  38  -3.391   5.876   0.182
  292    HE2  TYR  38          2HE       TYR  38   0.194   6.412  -2.066
  293    HH   TYR  38           HH       TYR  38  -2.064   7.618  -2.295
  294    H    VAL  39           HN       VAL  39   0.170   3.829   2.472
  295    HA   VAL  39           HA       VAL  39   1.419   6.251   1.576
  296    HB   VAL  39           HB       VAL  39   0.410   7.291   3.545
  297   HG11  VAL  39          1HG1      VAL  39  -0.899   6.340   1.385
  298   HG12  VAL  39          2HG1      VAL  39  -1.813   5.564   2.680
  299   HG13  VAL  39          3HG1      VAL  39  -1.655   7.320   2.641
  300   HG21  VAL  39          1HG2      VAL  39   0.662   5.680   5.245
  301   HG22  VAL  39          2HG2      VAL  39  -1.078   5.815   4.986
  302   HG23  VAL  39          3HG2      VAL  39  -0.190   4.447   4.316
  303    H    GLU  40           HN       GLU  40   1.759   4.218   4.485
  304    HA   GLU  40           HA       GLU  40   3.602   5.444   5.964
  305    HB2  GLU  40          2HB       GLU  40   2.746   2.859   5.797
  306    HB3  GLU  40          3HB       GLU  40   4.441   2.684   5.364
  307    HG2  GLU  40          2HG       GLU  40   4.229   4.393   7.640
  308    HG3  GLU  40          3HG       GLU  40   3.313   2.917   7.930
  309    H    LEU  41           HN       LEU  41   4.233   3.995   2.828
  310    HA   LEU  41           HA       LEU  41   7.070   4.366   2.941
  311    HB2  LEU  41          2HB       LEU  41   5.183   3.130   1.201
  312    HB3  LEU  41          3HB       LEU  41   6.187   4.226   0.253
  313    HG   LEU  41           HG       LEU  41   8.157   3.040   0.783
  314   HD11  LEU  41          1HD1      LEU  41   6.503   1.790   2.946
  315   HD12  LEU  41          2HD1      LEU  41   8.051   2.626   3.070
  316   HD13  LEU  41          3HD1      LEU  41   7.974   1.016   2.355
  317   HD21  LEU  41          1HD2      LEU  41   7.725   0.853  -0.073
  318   HD22  LEU  41          2HD2      LEU  41   6.611   1.971  -0.862
  319   HD23  LEU  41          3HD2      LEU  41   6.038   0.925   0.438
  320    H    LEU  42           HN       LEU  42   4.398   6.060   1.324
  321    HA   LEU  42           HA       LEU  42   6.092   8.085   0.226
  322    HB2  LEU  42          2HB       LEU  42   3.103   7.930   0.565
  323    HB3  LEU  42          3HB       LEU  42   3.935   9.230  -0.286
  324    HG   LEU  42           HG       LEU  42   4.305   6.391  -1.157
  325   HD11  LEU  42          1HD1      LEU  42   1.959   8.173  -1.760
  326   HD12  LEU  42          2HD1      LEU  42   1.942   6.538  -1.100
  327   HD13  LEU  42          3HD1      LEU  42   2.427   6.808  -2.774
  328   HD21  LEU  42          1HD2      LEU  42   4.175   8.893  -2.809
  329   HD22  LEU  42          2HD2      LEU  42   4.907   7.341  -3.213
  330   HD23  LEU  42          3HD2      LEU  42   5.657   8.384  -2.003
  331    H    ILE  43           HN       ILE  43   3.554   8.208   2.732
  332    HA   ILE  43           HA       ILE  43   3.742  10.725   3.648
  333    HB   ILE  43           HB       ILE  43   2.969   8.224   4.819
  334   HG12  ILE  43          2HG1      ILE  43   1.473   9.796   6.139
  335   HG13  ILE  43          3HG1      ILE  43   2.284  11.123   5.314
  336   HG21  ILE  43          1HG2      ILE  43   3.326   8.865   7.206
  337   HG22  ILE  43          2HG2      ILE  43   4.799   8.425   6.343
  338   HG23  ILE  43          3HG2      ILE  43   4.429  10.122   6.646
  339   HD11  ILE  43          1HD1      ILE  43   0.031   9.831   4.455
  340   HD12  ILE  43          2HD1      ILE  43   1.092  10.830   3.461
  341   HD13  ILE  43          3HD1      ILE  43   1.303   9.079   3.493
  342    H    LYS  44           HN       LYS  44   6.035   8.136   4.405
  343    HA   LYS  44           HA       LYS  44   7.623   9.561   6.226
  344    HB2  LYS  44          2HB       LYS  44   7.749   7.048   4.810
  345    HB3  LYS  44          3HB       LYS  44   9.331   7.816   4.836
  346    HG2  LYS  44          2HG       LYS  44   8.960   6.276   6.725
  347    HG3  LYS  44          3HG       LYS  44   9.296   7.932   7.235
  348    HD2  LYS  44          2HD       LYS  44   7.496   7.594   8.559
  349    HD3  LYS  44          3HD       LYS  44   6.607   8.018   7.094
  350    HE2  LYS  44          2HE       LYS  44   5.608   6.037   7.186
  351    HE3  LYS  44          3HE       LYS  44   7.172   5.275   6.899
  352    HZ1  LYS  44          1HZ       LYS  44   7.053   5.981   9.594
  353    HZ2  LYS  44          2HZ       LYS  44   7.068   4.427   8.926
  354    HZ3  LYS  44          3HZ       LYS  44   5.596   5.207   9.221
  355    H    GLU  45           HN       GLU  45   7.763   9.302   2.706
  356    HA   GLU  45           HA       GLU  45  10.182  10.779   2.430
  357    HB2  GLU  45          2HB       GLU  45   8.408   9.361   0.724
  358    HB3  GLU  45          3HB       GLU  45   8.577  10.987   0.077
  359    HG2  GLU  45          2HG       GLU  45  10.687   8.911   0.509
  360    HG3  GLU  45          3HG       GLU  45  10.253   9.760  -0.972
  361    H    GLY  46           HN       GLY  46   7.097  11.761   0.986
  362    HA2  GLY  46          1HA       GLY  46   5.896  13.751   1.452
  363    HA3  GLY  46          2HA       GLY  46   7.298  14.364   2.317
  364    H    LEU  47           HN       LEU  47   8.766  13.213  -0.240
  365    HA   LEU  47           HA       LEU  47   9.407  15.601  -1.431
  366    HB2  LEU  47          2HB       LEU  47  10.520  14.393  -3.028
  367    HB3  LEU  47          3HB       LEU  47  10.359  13.198  -1.741
  368    HG   LEU  47           HG       LEU  47   8.445  13.341  -4.058
  369   HD11  LEU  47          1HD1      LEU  47  10.549  11.273  -4.035
  370   HD12  LEU  47          2HD1      LEU  47  11.058  12.905  -4.470
  371   HD13  LEU  47          3HD1      LEU  47   9.783  12.104  -5.389
  372   HD21  LEU  47          1HD2      LEU  47   8.327  11.978  -1.683
  373   HD22  LEU  47          2HD2      LEU  47   9.034  10.787  -2.776
  374   HD23  LEU  47          3HD2      LEU  47   7.484  11.532  -3.166
  375    H    GLU  48           HN       GLU  48   6.846  13.339  -2.391
  376    HA   GLU  48           HA       GLU  48   5.153  15.391  -3.339
  377    HB2  GLU  48          2HB       GLU  48   5.247  15.115  -5.689
  378    HB3  GLU  48          3HB       GLU  48   6.912  15.314  -5.160
  379    HG2  GLU  48          2HG       GLU  48   7.462  13.411  -6.132
  380    HG3  GLU  48          3HG       GLU  48   6.304  12.544  -5.125
  381    H    THR  49           HN       THR  49   3.994  13.688  -5.460
  382    HA   THR  49           HA       THR  49   2.674  11.817  -5.740
  383    HB   THR  49           HB       THR  49   3.154  10.964  -2.900
  384    HG1  THR  49          1HG       THR  49   4.920  10.820  -5.104
  385   HG21  THR  49          1HG2      THR  49   2.162   9.065  -3.539
  386   HG22  THR  49          2HG2      THR  49   3.165   8.947  -4.986
  387   HG23  THR  49          3HG2      THR  49   1.689   9.911  -5.011
  388    H    ALA  50           HN       ALA  50   2.521  13.511  -2.641
  389    HA   ALA  50           HA       ALA  50   0.787  14.464  -1.514
  390    HB1  ALA  50          1HB       ALA  50  -1.143  15.192  -2.723
  391    HB2  ALA  50          2HB       ALA  50   0.264  15.392  -3.768
  392    HB3  ALA  50          3HB       ALA  50  -0.834  14.035  -4.017
  393    H    ILE  51           HN       ILE  51   0.984  11.351  -2.276
  394    HA   ILE  51           HA       ILE  51  -0.149   9.428  -1.767
  395    HB   ILE  51           HB       ILE  51  -0.840  11.127   0.632
  396   HG12  ILE  51          2HG1      ILE  51   1.048   9.921   1.680
  397   HG13  ILE  51          3HG1      ILE  51   1.362   9.106   0.151
  398   HG21  ILE  51          1HG2      ILE  51  -2.310   9.111   0.268
  399   HG22  ILE  51          2HG2      ILE  51  -0.866   8.123   0.481
  400   HG23  ILE  51          3HG2      ILE  51  -1.432   9.152   1.797
  401   HD11  ILE  51          1HD1      ILE  51   2.648  11.307   0.939
  402   HD12  ILE  51          2HD1      ILE  51   2.359  10.909  -0.756
  403   HD13  ILE  51          3HD1      ILE  51   1.302  12.052   0.075
  404    H    SER  52           HN       SER  52  -1.679   9.458  -3.455
  405    HA   SER  52           HA       SER  52  -4.323  10.553  -2.817
  406    HB2  SER  52          2HB       SER  52  -4.089   9.306  -5.433
  407    HB3  SER  52          3HB       SER  52  -4.543  10.958  -5.016
  408    HG   SER  52           HG       SER  52  -2.677  11.273  -6.023
  409    H    CYS  53           HN       CYS  53  -6.212   9.280  -3.004
  410    HA   CYS  53           HA       CYS  53  -6.402   6.962  -1.706
  411    HB2  CYS  53          2HB       CYS  53  -8.356   8.147  -2.585
  412    HB3  CYS  53          3HB       CYS  53  -7.957   7.621  -4.217
  413    HA   PRO  54           HA       PRO  54  -4.117   3.896  -3.914
  414    HB2  PRO  54          2HB       PRO  54  -5.109   1.711  -2.645
  415    HB3  PRO  54          3HB       PRO  54  -3.942   2.808  -1.898
  416    HG2  PRO  54          2HG       PRO  54  -6.913   2.687  -1.556
  417    HG3  PRO  54          3HG       PRO  54  -5.654   2.909  -0.327
  418    HD2  PRO  54          2HD       PRO  54  -7.102   4.971  -1.319
  419    HD3  PRO  54          3HD       PRO  54  -5.414   5.153  -0.798
  420    H    ASP  55           HN       ASP  55  -7.311   4.564  -4.331
  421    HA   ASP  55           HA       ASP  55  -7.772   2.264  -6.106
  422    HB2  ASP  55          2HB       ASP  55  -9.526   2.467  -4.485
  423    HB3  ASP  55          3HB       ASP  55  -9.699   4.190  -4.805
  424    H    ALA  56           HN       ALA  56  -6.328   3.290  -7.674
  425    HA   ALA  56           HA       ALA  56  -6.492   5.732  -8.838
  426    HB1  ALA  56          1HB       ALA  56  -6.111   4.261 -11.058
  427    HB2  ALA  56          2HB       ALA  56  -4.855   4.559  -9.855
  428    HB3  ALA  56          3HB       ALA  56  -5.767   3.050  -9.823
  429    H    ALA  57           HN       ALA  57  -8.888   3.254  -8.941
  430    HA   ALA  57           HA       ALA  57 -10.359   4.629 -11.073
  431    HB1  ALA  57          1HB       ALA  57  -9.953   1.961 -10.638
  432    HB2  ALA  57          2HB       ALA  57 -11.566   2.209  -9.966
  433    HB3  ALA  57          3HB       ALA  57 -11.230   2.649 -11.641
  434    H    CYS  58           HN       CYS  58 -10.099   5.786  -8.426
  435    HA   CYS  58           HA       CYS  58 -12.653   5.399  -7.120
  436    HB2  CYS  58          2HB       CYS  58 -10.505   5.850  -5.881
  437    HB3  CYS  58          3HB       CYS  58 -10.554   7.489  -6.522
  438    HA   PRO  59           HA       PRO  59 -14.774   8.486  -9.465
  439    HB2  PRO  59          2HB       PRO  59 -16.917   8.771  -7.821
  440    HB3  PRO  59          3HB       PRO  59 -16.699   7.374  -8.881
  441    HG2  PRO  59          2HG       PRO  59 -16.122   7.641  -5.956
  442    HG3  PRO  59          3HG       PRO  59 -16.888   6.299  -6.827
  443    HD2  PRO  59          2HD       PRO  59 -14.289   6.247  -6.066
  444    HD3  PRO  59          3HD       PRO  59 -14.868   5.444  -7.539
  445    H    LYS  60           HN       LYS  60 -13.552   8.901  -6.292
  446    HA   LYS  60           HA       LYS  60 -13.955  11.814  -6.499
  447    HB2  LYS  60          2HB       LYS  60 -13.829  10.104  -4.009
  448    HB3  LYS  60          3HB       LYS  60 -13.843  11.862  -4.007
  449    HG2  LYS  60          2HG       LYS  60 -16.033  10.940  -5.574
  450    HG3  LYS  60          3HG       LYS  60 -16.038  10.089  -4.027
  451    HD2  LYS  60          2HD       LYS  60 -17.314  12.045  -3.687
  452    HD3  LYS  60          3HD       LYS  60 -15.746  12.363  -2.939
  453    HE2  LYS  60          2HE       LYS  60 -15.998  13.130  -5.775
  454    HE3  LYS  60          3HE       LYS  60 -16.983  14.055  -4.643
  455    HZ1  LYS  60          1HZ       LYS  60 -15.162  15.242  -4.263
  456    HZ2  LYS  60          2HZ       LYS  60 -14.166  14.150  -5.086
  457    HZ3  LYS  60          3HZ       LYS  60 -14.528  13.900  -3.452
  458    H    GLN  61           HN       GLN  61 -11.752   9.216  -6.170
  459    HA   GLN  61           HA       GLN  61  -9.506   9.120  -5.637
  460    HB2  GLN  61          2HB       GLN  61  -9.706  11.391  -7.618
  461    HB3  GLN  61          3HB       GLN  61  -8.189  10.628  -7.159
  462    HG2  GLN  61          2HG       GLN  61  -9.424   8.437  -7.873
  463    HG3  GLN  61          3HG       GLN  61 -10.439   9.553  -8.784
  464   HE21  GLN  61          1HE2      GLN  61  -8.603  11.439  -9.548
  465   HE22  GLN  61          2HE2      GLN  61  -7.458  10.729 -10.630
  466    H    GLY  62           HN       GLY  62 -10.434  10.144  -3.447
  467    HA2  GLY  62          1HA       GLY  62  -9.588  12.812  -2.867
  468    HA3  GLY  62          2HA       GLY  62 -10.107  11.607  -1.697
  469    H    HIS  63           HN       HIS  63  -7.819  13.551  -1.755
  470    HA   HIS  63           HA       HIS  63  -5.507  11.777  -1.770
  471    HB2  HIS  63          2HB       HIS  63  -5.933  14.712  -1.781
  472    HB3  HIS  63          3HB       HIS  63  -4.485  14.134  -0.964
  473    HD1  HIS  63          1HD       HIS  63  -5.592  15.199  -4.171
  474    HD2  HIS  63          2HD       HIS  63  -2.981  12.267  -2.811
  475    HE1  HIS  63          1HE       HIS  63  -4.132  14.633  -6.139
  476    H    LEU  64           HN       LEU  64  -3.924  12.085   0.099
  477    HA   LEU  64           HA       LEU  64  -5.413  12.128   2.642
  478    HB2  LEU  64          2HB       LEU  64  -3.246  10.295   1.675
  479    HB3  LEU  64          3HB       LEU  64  -3.546  10.525   3.397
  480    HG   LEU  64           HG       LEU  64  -5.827   9.737   1.651
  481   HD11  LEU  64          1HD1      LEU  64  -4.944   7.323   2.461
  482   HD12  LEU  64          2HD1      LEU  64  -3.411   8.127   2.127
  483   HD13  LEU  64          3HD1      LEU  64  -4.634   8.000   0.862
  484   HD21  LEU  64          1HD2      LEU  64  -5.927   8.266   3.926
  485   HD22  LEU  64          2HD2      LEU  64  -6.672   9.853   3.730
  486   HD23  LEU  64          3HD2      LEU  64  -5.087   9.709   4.493
  487    H    GLN  65           HN       GLN  65  -4.086  12.654   4.549
  488    HA   GLN  65           HA       GLN  65  -2.387  14.920   3.973
  489    HB2  GLN  65          2HB       GLN  65  -2.567  14.114   6.773
  490    HB3  GLN  65          3HB       GLN  65  -2.972  15.649   6.016
  491    HG2  GLN  65          2HG       GLN  65  -5.008  14.983   6.824
  492    HG3  GLN  65          3HG       GLN  65  -5.071  14.372   5.172
  493   HE21  GLN  65          1HE2      GLN  65  -3.052  12.282   6.004
  494   HE22  GLN  65          2HE2      GLN  65  -3.997  11.076   6.801
  495    H    GLU  66           HN       GLU  66  -0.332  15.197   5.239
  496    HA   GLU  66           HA       GLU  66   1.294  12.805   4.884
  497    HB2  GLU  66          2HB       GLU  66   1.743  15.682   4.784
  498    HB3  GLU  66          3HB       GLU  66   2.975  14.848   5.720
  499    HG2  GLU  66          2HG       GLU  66   2.649  13.293   3.440
  500    HG3  GLU  66          3HG       GLU  66   2.589  14.960   2.867
  501    H    ASN  67           HN       ASN  67   0.088  14.885   7.407
  502    HA   ASN  67           HA       ASN  67   1.764  13.612   9.424
  503    HB2  ASN  67          2HB       ASN  67   1.625  15.699  10.248
  504    HB3  ASN  67          3HB       ASN  67   0.250  16.096   9.221
  505   HD21  ASN  67          1HD2      ASN  67  -1.655  16.348  10.154
  506   HD22  ASN  67          2HD2      ASN  67  -2.059  15.872  11.765
  507    H    GLU  68           HN       GLU  68  -1.728  14.294   9.119
  508    HA   GLU  68           HA       GLU  68  -2.759  12.735  11.062
  509    HB2  GLU  68          2HB       GLU  68  -3.708  13.743   8.530
  510    HB3  GLU  68          3HB       GLU  68  -4.407  12.164   8.857
  511    HG2  GLU  68          2HG       GLU  68  -4.418  14.185  11.032
  512    HG3  GLU  68          3HG       GLU  68  -5.545  14.384   9.691
  513    H    ILE  69           HN       ILE  69  -1.555  11.594   7.947
  514    HA   ILE  69           HA       ILE  69  -2.332   8.876   8.354
  515    HB   ILE  69           HB       ILE  69  -0.465  10.209   6.409
  516   HG12  ILE  69          2HG1      ILE  69  -3.263   9.318   6.447
  517   HG13  ILE  69          3HG1      ILE  69  -2.482  10.537   5.445
  518   HG21  ILE  69          1HG2      ILE  69  -0.213   8.032   5.293
  519   HG22  ILE  69          2HG2      ILE  69   0.504   8.045   6.904
  520   HG23  ILE  69          3HG2      ILE  69  -1.053   7.261   6.638
  521   HD11  ILE  69          1HD1      ILE  69  -1.666   8.832   3.949
  522   HD12  ILE  69          2HD1      ILE  69  -2.327   7.568   4.987
  523   HD13  ILE  69          3HD1      ILE  69  -3.411   8.676   4.145
  524    H    GLU  70           HN       GLU  70   0.929  10.322   8.164
  525    HA   GLU  70           HA       GLU  70   2.366   8.175   9.118
  526    HB2  GLU  70          2HB       GLU  70   4.155   9.591   9.230
  527    HB3  GLU  70          3HB       GLU  70   3.073  10.593   8.275
  528    HG2  GLU  70          2HG       GLU  70   2.430  11.847  10.225
  529    HG3  GLU  70          3HG       GLU  70   3.378  10.782  11.262
  530    H    CYS  71           HN       CYS  71   0.162  10.142  10.815
  531    HA   CYS  71           HA       CYS  71   1.267   9.773  13.435
  532    HB2  CYS  71          2HB       CYS  71  -0.085  11.572  13.620
  533    HB3  CYS  71          3HB       CYS  71  -1.081  11.080  12.256
  534    HG   CYS  71           HG       CYS  71  -2.455  11.376  14.830
  535    H    MET  72           HN       MET  72  -1.044   8.093  11.413
  536    HA   MET  72           HA       MET  72  -1.913   6.347  13.549
  537    HB2  MET  72          2HB       MET  72  -3.546   5.635  12.125
  538    HB3  MET  72          3HB       MET  72  -3.180   7.171  11.352
  539    HG2  MET  72          2HG       MET  72  -1.436   5.671  10.042
  540    HG3  MET  72          3HG       MET  72  -2.591   4.408  10.464
  541    HE1  MET  72          1HE       MET  72  -1.777   5.533   7.382
  542    HE2  MET  72          2HE       MET  72  -2.653   4.068   7.822
  543    HE3  MET  72          3HE       MET  72  -3.368   5.217   6.690
  544    H    VAL  73           HN       VAL  73   0.894   6.542  11.991
  545    HA   VAL  73           HA       VAL  73   1.371   3.656  12.207
  546    HB   VAL  73           HB       VAL  73   2.928   3.902  10.185
  547   HG11  VAL  73          1HG1      VAL  73   0.004   4.135   9.534
  548   HG12  VAL  73          2HG1      VAL  73   1.242   3.191   8.704
  549   HG13  VAL  73          3HG1      VAL  73   0.689   2.707  10.307
  550   HG21  VAL  73          1HG2      VAL  73   3.114   6.001   9.426
  551   HG22  VAL  73          2HG2      VAL  73   1.555   5.714   8.656
  552   HG23  VAL  73          3HG2      VAL  73   1.629   6.519  10.224
  553    H    ALA  74           HN       ALA  74   3.086   6.694  11.444
  554    HA   ALA  74           HA       ALA  74   5.296   5.815  13.157
  555    HB1  ALA  74          1HB       ALA  74   5.601   8.330  11.675
  556    HB2  ALA  74          2HB       ALA  74   6.692   6.950  11.813
  557    HB3  ALA  74          3HB       ALA  74   5.349   6.902  10.670
  558    H    ALA  75           HN       ALA  75   3.148   6.468  14.649
  559    HA   ALA  75           HA       ALA  75   2.569   9.000  15.410
  560    HB1  ALA  75          1HB       ALA  75   2.427   8.073  17.784
  561    HB2  ALA  75          2HB       ALA  75   1.461   7.275  16.542
  562    HB3  ALA  75          3HB       ALA  75   2.970   6.546  17.089
  Start of MODEL    2
    1    H1   ALA   1           HN       ALA   1 -23.501  -7.488   0.157
    2    HA   ALA   1           HA       ALA   1 -25.650  -8.280  -1.645
    3    HB1  ALA   1          1HB       ALA   1 -22.916  -9.351  -2.010
    4    HB2  ALA   1          2HB       ALA   1 -24.057  -8.715  -3.197
    5    HB3  ALA   1          3HB       ALA   1 -23.124  -7.609  -2.190
    6    H    LEU   2           HN       LEU   2 -23.065  -9.958   0.161
    7    HA   LEU   2           HA       LEU   2 -24.951 -12.125   0.728
    8    HB2  LEU   2          2HB       LEU   2 -22.252 -12.412  -0.563
    9    HB3  LEU   2          3HB       LEU   2 -23.048 -13.746   0.269
   10    HG   LEU   2           HG       LEU   2 -24.912 -12.716  -1.582
   11   HD11  LEU   2          1HD1      LEU   2 -23.067 -11.628  -2.739
   12   HD12  LEU   2          2HD1      LEU   2 -23.708 -12.966  -3.693
   13   HD13  LEU   2          3HD1      LEU   2 -22.194 -13.160  -2.810
   14   HD21  LEU   2          1HD2      LEU   2 -23.207 -15.203  -1.690
   15   HD22  LEU   2          2HD2      LEU   2 -24.716 -14.935  -2.562
   16   HD23  LEU   2          3HD2      LEU   2 -24.722 -15.031  -0.801
   17    H    ASP   3           HN       ASP   3 -21.509 -11.316   1.225
   18    HA   ASP   3           HA       ASP   3 -21.777 -12.125   4.026
   19    HB2  ASP   3          2HB       ASP   3 -19.703 -12.351   2.082
   20    HB3  ASP   3          3HB       ASP   3 -19.106 -11.353   3.405
   21    HA   PRO   4           HA       PRO   4 -21.824  -7.990   5.517
   22    HB2  PRO   4          2HB       PRO   4 -20.746  -8.377   7.978
   23    HB3  PRO   4          3HB       PRO   4 -22.386  -8.884   7.557
   24    HG2  PRO   4          2HG       PRO   4 -19.876 -10.510   7.684
   25    HG3  PRO   4          3HG       PRO   4 -21.503 -10.917   8.260
   26    HD2  PRO   4          2HD       PRO   4 -20.510 -11.851   5.921
   27    HD3  PRO   4          3HD       PRO   4 -22.236 -11.510   6.158
   28    H    LEU   5           HN       LEU   5 -18.799  -9.787   6.048
   29    HA   LEU   5           HA       LEU   5 -17.146  -7.556   6.462
   30    HB2  LEU   5          2HB       LEU   5 -16.159 -10.050   5.140
   31    HB3  LEU   5          3HB       LEU   5 -15.343  -9.013   6.308
   32    HG   LEU   5           HG       LEU   5 -17.488  -9.997   7.733
   33   HD11  LEU   5          1HD1      LEU   5 -17.417 -11.622   5.550
   34   HD12  LEU   5          2HD1      LEU   5 -18.035 -12.083   7.136
   35   HD13  LEU   5          3HD1      LEU   5 -16.380 -12.492   6.681
   36   HD21  LEU   5          1HD2      LEU   5 -15.857 -11.124   9.013
   37   HD22  LEU   5          2HD2      LEU   5 -15.051  -9.704   8.348
   38   HD23  LEU   5          3HD2      LEU   5 -14.776 -11.292   7.630
   39    H    VAL   6           HN       VAL   6 -15.090  -8.280   4.467
   40    HA   VAL   6           HA       VAL   6 -14.358  -7.616   2.416
   41    HB   VAL   6           HB       VAL   6 -17.274  -7.882   1.674
   42   HG11  VAL   6          1HG1      VAL   6 -15.063  -6.769   0.214
   43   HG12  VAL   6          2HG1      VAL   6 -15.661  -8.223  -0.588
   44   HG13  VAL   6          3HG1      VAL   6 -16.761  -6.887  -0.245
   45   HG21  VAL   6          1HG2      VAL   6 -16.632 -10.018   0.733
   46   HG22  VAL   6          2HG2      VAL   6 -14.951  -9.746   1.189
   47   HG23  VAL   6          3HG2      VAL   6 -16.178  -9.958   2.437
   48    H    SER   7           HN       SER   7 -13.727  -5.657   1.771
   49    HA   SER   7           HA       SER   7 -15.481  -3.470   1.343
   50    HB2  SER   7          2HB       SER   7 -14.441  -3.808   4.029
   51    HB3  SER   7          3HB       SER   7 -13.895  -2.286   3.324
   52    HG   SER   7           HG       SER   7 -16.592  -3.171   3.407
   53    H    CYS   8           HN       CYS   8 -12.178  -4.478   2.106
   54    HA   CYS   8           HA       CYS   8 -10.909  -2.304   0.791
   55    HB2  CYS   8          2HB       CYS   8  -9.895  -3.844   2.548
   56    HB3  CYS   8          3HB       CYS   8  -9.703  -5.029   1.261
   57    H    LYS   9           HN       LYS   9  -9.598  -2.445  -1.154
   58    HA   LYS   9           HA       LYS   9 -10.433  -4.498  -3.069
   59    HB2  LYS   9          2HB       LYS   9 -10.570  -2.570  -4.791
   60    HB3  LYS   9          3HB       LYS   9 -11.933  -2.837  -3.711
   61    HG2  LYS   9          2HG       LYS   9 -10.447  -1.071  -2.274
   62    HG3  LYS   9          3HG       LYS   9 -10.118  -0.552  -3.929
   63    HD2  LYS   9          2HD       LYS   9 -12.938  -1.136  -3.207
   64    HD3  LYS   9          3HD       LYS   9 -12.214   0.334  -2.548
   65    HE2  LYS   9          2HE       LYS   9 -12.380   1.370  -4.510
   66    HE3  LYS   9          3HE       LYS   9 -11.571   0.042  -5.341
   67    HZ1  LYS   9          1HZ       LYS   9 -14.145   0.749  -5.698
   68    HZ2  LYS   9          2HZ       LYS   9 -14.296  -0.525  -4.595
   69    HZ3  LYS   9          3HZ       LYS   9 -13.504  -0.772  -6.069
   70    H    LEU  10           HN       LEU  10  -7.957  -3.457  -1.511
   71    HA   LEU  10           HA       LEU  10  -6.151  -3.078  -3.791
   72    HB2  LEU  10          2HB       LEU  10  -5.716  -2.697  -0.834
   73    HB3  LEU  10          3HB       LEU  10  -4.479  -2.461  -2.068
   74    HG   LEU  10           HG       LEU  10  -7.039  -0.873  -1.925
   75   HD11  LEU  10          1HD1      LEU  10  -4.319   0.084  -1.087
   76   HD12  LEU  10          2HD1      LEU  10  -5.461  -0.622   0.055
   77   HD13  LEU  10          3HD1      LEU  10  -5.888   0.847  -0.823
   78   HD21  LEU  10          1HD2      LEU  10  -6.160   0.462  -3.605
   79   HD22  LEU  10          2HD2      LEU  10  -5.684  -1.160  -4.110
   80   HD23  LEU  10          3HD2      LEU  10  -4.511  -0.098  -3.329
   81    H    CYS  11           HN       CYS  11  -6.957  -5.270  -1.210
   82    HA   CYS  11           HA       CYS  11  -4.888  -7.123  -2.196
   83    HB2  CYS  11          2HB       CYS  11  -4.709  -8.041   0.070
   84    HB3  CYS  11          3HB       CYS  11  -4.326  -6.322   0.055
   85    H    LEU  12           HN       LEU  12  -8.073  -6.540  -2.216
   86    HA   LEU  12           HA       LEU  12  -9.978  -7.777  -2.426
   87    HB2  LEU  12          2HB       LEU  12  -7.869  -9.562  -3.592
   88    HB3  LEU  12          3HB       LEU  12  -9.567 -10.036  -3.574
   89    HG   LEU  12           HG       LEU  12  -8.560  -7.513  -4.878
   90   HD11  LEU  12          1HD1      LEU  12  -9.417  -9.699  -6.611
   91   HD12  LEU  12          2HD1      LEU  12  -7.932 -10.035  -5.722
   92   HD13  LEU  12          3HD1      LEU  12  -8.038  -8.609  -6.753
   93   HD21  LEU  12          1HD2      LEU  12 -11.178  -8.814  -4.520
   94   HD22  LEU  12          2HD2      LEU  12 -10.840  -8.203  -6.139
   95   HD23  LEU  12          3HD2      LEU  12 -10.774  -7.114  -4.753
   96    H    GLY  13           HN       GLY  13  -9.780  -7.795   0.056
   97    HA2  GLY  13          1HA       GLY  13  -9.905 -10.616   0.917
   98    HA3  GLY  13          2HA       GLY  13  -9.072  -9.411   1.890
   99    H    GLU  14           HN       GLU  14 -10.687 -10.355   3.471
  100    HA   GLU  14           HA       GLU  14 -13.349  -9.163   3.180
  101    HB2  GLU  14          2HB       GLU  14 -12.279 -11.258   5.074
  102    HB3  GLU  14          3HB       GLU  14 -13.898 -10.582   5.186
  103    HG2  GLU  14          2HG       GLU  14 -14.418 -11.424   2.962
  104    HG3  GLU  14          3HG       GLU  14 -12.789 -12.084   2.826
  105    H    TYR  15           HN       TYR  15 -11.554  -9.838   6.150
  106    HA   TYR  15           HA       TYR  15 -11.080  -8.560   7.970
  107    HB2  TYR  15          2HB       TYR  15 -10.999  -6.155   6.164
  108    HB3  TYR  15          3HB       TYR  15 -10.048  -6.474   7.609
  109    HD1  TYR  15          1HD       TYR  15  -8.300  -8.322   7.507
  110    HD2  TYR  15          2HD       TYR  15 -10.185  -6.731   4.040
  111    HE1  TYR  15          1HE       TYR  15  -6.477  -9.212   6.115
  112    HE2  TYR  15          2HE       TYR  15  -8.368  -7.617   2.639
  113    HH   TYR  15           HH       TYR  15  -5.618  -8.291   3.401
  114    HA   PRO  16           HA       PRO  16 -14.895  -6.899   9.384
  115    HB2  PRO  16          2HB       PRO  16 -14.036  -5.551  11.578
  116    HB3  PRO  16          3HB       PRO  16 -14.128  -7.315  11.510
  117    HG2  PRO  16          2HG       PRO  16 -11.756  -5.525  11.143
  118    HG3  PRO  16          3HG       PRO  16 -11.881  -7.046  12.047
  119    HD2  PRO  16          2HD       PRO  16 -10.801  -6.909   9.567
  120    HD3  PRO  16          3HD       PRO  16 -11.683  -8.336  10.147
  121    H    VAL  17           HN       VAL  17 -15.377  -4.551  10.679
  122    HA   VAL  17           HA       VAL  17 -14.879  -2.580   8.563
  123    HB   VAL  17           HB       VAL  17 -17.116  -3.082  10.418
  124   HG11  VAL  17          1HG1      VAL  17 -16.366  -0.951  11.297
  125   HG12  VAL  17          2HG1      VAL  17 -16.317  -0.271   9.669
  126   HG13  VAL  17          3HG1      VAL  17 -17.860  -0.736  10.386
  127   HG21  VAL  17          1HG2      VAL  17 -17.488  -3.534   8.135
  128   HG22  VAL  17          2HG2      VAL  17 -18.340  -2.025   8.460
  129   HG23  VAL  17          3HG2      VAL  17 -16.783  -1.997   7.634
  130    H    GLU  18           HN       GLU  18 -13.905  -3.383  11.689
  131    HA   GLU  18           HA       GLU  18 -13.269  -0.633  12.438
  132    HB2  GLU  18          2HB       GLU  18 -13.682  -3.133  13.863
  133    HB3  GLU  18          3HB       GLU  18 -12.208  -2.326  14.377
  134    HG2  GLU  18          2HG       GLU  18 -13.422  -0.341  14.948
  135    HG3  GLU  18          3HG       GLU  18 -14.907  -1.002  14.268
  136    H    GLN  19           HN       GLN  19 -11.880  -3.115  10.713
  137    HA   GLN  19           HA       GLN  19  -9.140  -2.445  11.493
  138    HB2  GLN  19          2HB       GLN  19 -10.388  -4.687   9.950
  139    HB3  GLN  19          3HB       GLN  19  -8.684  -4.319   9.717
  140    HG2  GLN  19          2HG       GLN  19  -8.258  -4.666  12.077
  141    HG3  GLN  19          3HG       GLN  19  -9.972  -4.963  12.359
  142   HE21  GLN  19          1HE2      GLN  19  -9.686  -7.025  13.128
  143   HE22  GLN  19          2HE2      GLN  19  -9.193  -8.343  12.127
  144    H    MET  20           HN       MET  20 -11.321  -1.099   9.570
  145    HA   MET  20           HA       MET  20  -9.425  -0.550   7.385
  146    HB2  MET  20          2HB       MET  20 -12.150   0.389   6.960
  147    HB3  MET  20          3HB       MET  20 -11.130  -0.601   5.926
  148    HG2  MET  20          2HG       MET  20 -11.729  -2.445   7.727
  149    HG3  MET  20          3HG       MET  20 -13.135  -1.407   7.952
  150    HE1  MET  20          1HE       MET  20 -11.533  -2.536   4.042
  151    HE2  MET  20          2HE       MET  20 -10.827  -2.995   5.592
  152    HE3  MET  20          3HE       MET  20 -11.860  -4.131   4.722
  153    H    THR  21           HN       THR  21  -9.653   1.697   6.450
  154    HA   THR  21           HA       THR  21 -10.344   3.710   8.464
  155    HB   THR  21           HB       THR  21  -7.652   3.496   7.111
  156    HG1  THR  21          1HG       THR  21  -7.727   3.964   9.797
  157   HG21  THR  21          1HG2      THR  21  -7.179   5.621   8.429
  158   HG22  THR  21          2HG2      THR  21  -8.928   5.785   8.592
  159   HG23  THR  21          3HG2      THR  21  -8.186   5.795   6.992
  160    H    THR  22           HN       THR  22 -10.850   5.748   7.633
  161    HA   THR  22           HA       THR  22 -11.684   5.723   4.854
  162    HB   THR  22           HB       THR  22 -12.025   8.034   6.755
  163    HG1  THR  22          1HG       THR  22 -12.827   6.123   7.763
  164   HG21  THR  22          1HG2      THR  22 -13.553   8.823   5.276
  165   HG22  THR  22          2HG2      THR  22 -14.109   7.212   4.826
  166   HG23  THR  22          3HG2      THR  22 -12.619   7.855   4.136
  167    H    ILE  23           HN       ILE  23 -11.047   7.210   3.285
  168    HA   ILE  23           HA       ILE  23  -8.328   7.975   3.331
  169    HB   ILE  23           HB       ILE  23 -10.600   8.528   1.458
  170   HG12  ILE  23          2HG1      ILE  23  -9.580   6.369   1.237
  171   HG13  ILE  23          3HG1      ILE  23  -9.029   7.351  -0.117
  172   HG21  ILE  23          1HG2      ILE  23  -8.691   9.574   0.007
  173   HG22  ILE  23          2HG2      ILE  23  -9.569  10.561   1.175
  174   HG23  ILE  23          3HG2      ILE  23  -7.973   9.931   1.578
  175   HD11  ILE  23          1HD1      ILE  23  -6.989   7.844   1.387
  176   HD12  ILE  23          2HD1      ILE  23  -7.515   6.415   2.276
  177   HD13  ILE  23          3HD1      ILE  23  -7.104   6.288   0.566
  178    H    ALA  24           HN       ALA  24 -11.234   9.582   4.298
  179    HA   ALA  24           HA       ALA  24 -11.482  11.501   5.535
  180    HB1  ALA  24          1HB       ALA  24  -9.709  12.329   6.623
  181    HB2  ALA  24          2HB       ALA  24  -8.820  11.005   5.873
  182    HB3  ALA  24          3HB       ALA  24  -8.804  12.606   5.135
  183    H    GLN  25           HN       GLN  25 -11.063  11.155   2.399
  184    HA   GLN  25           HA       GLN  25 -11.725  13.947   1.842
  185    HB2  GLN  25          2HB       GLN  25  -9.321  12.537   0.920
  186    HB3  GLN  25          3HB       GLN  25 -10.237  13.302  -0.371
  187    HG2  GLN  25          2HG       GLN  25  -8.534  14.800   0.437
  188    HG3  GLN  25          3HG       GLN  25 -10.131  15.435   0.831
  189   HE21  GLN  25          1HE2      GLN  25  -7.741  13.238   2.276
  190   HE22  GLN  25          2HE2      GLN  25  -7.826  13.916   3.862
  191    H    CYS  26           HN       CYS  26 -11.158  10.889   0.086
  192    HA   CYS  26           HA       CYS  26 -13.452  11.382  -1.602
  193    HB2  CYS  26          2HB       CYS  26 -12.811   9.246  -2.680
  194    HB3  CYS  26          3HB       CYS  26 -11.474  10.389  -2.600
  195    H    GLN  27           HN       GLN  27 -12.755   9.680   1.300
  196    HA   GLN  27           HA       GLN  27 -14.146   8.610   2.765
  197    HB2  GLN  27          2HB       GLN  27 -16.385   8.827   0.766
  198    HB3  GLN  27          3HB       GLN  27 -16.493   8.700   2.516
  199    HG2  GLN  27          2HG       GLN  27 -15.250  11.067   1.157
  200    HG3  GLN  27          3HG       GLN  27 -16.980  10.962   1.484
  201   HE21  GLN  27          1HE2      GLN  27 -13.802  11.196   2.891
  202   HE22  GLN  27          2HE2      GLN  27 -14.317  11.684   4.465
  203    H    CYS  28           HN       CYS  28 -12.502   7.042   1.483
  204    HA   CYS  28           HA       CYS  28 -14.072   4.845   0.323
  205    HB2  CYS  28          2HB       CYS  28 -11.164   5.599   0.118
  206    HB3  CYS  28          3HB       CYS  28 -11.736   3.998  -0.339
  207    H    ILE  29           HN       ILE  29 -12.597   2.679   0.749
  208    HA   ILE  29           HA       ILE  29 -12.032   2.528   3.622
  209    HB   ILE  29           HB       ILE  29 -14.436   1.695   2.777
  210   HG12  ILE  29          2HG1      ILE  29 -14.342   0.053   4.729
  211   HG13  ILE  29          3HG1      ILE  29 -12.641   0.481   4.879
  212   HG21  ILE  29          1HG2      ILE  29 -14.495  -0.651   2.341
  213   HG22  ILE  29          2HG2      ILE  29 -13.358   0.078   1.207
  214   HG23  ILE  29          3HG2      ILE  29 -12.759  -0.801   2.614
  215   HD11  ILE  29          1HD1      ILE  29 -14.229   1.692   6.402
  216   HD12  ILE  29          2HD1      ILE  29 -13.161   2.713   5.438
  217   HD13  ILE  29          3HD1      ILE  29 -14.849   2.513   4.970
  218    H    PHE  30           HN       PHE  30 -10.213   1.455   4.034
  219    HA   PHE  30           HA       PHE  30  -9.360  -0.749   2.361
  220    HB2  PHE  30          2HB       PHE  30  -7.590   1.683   2.683
  221    HB3  PHE  30          3HB       PHE  30  -7.175   0.195   1.839
  222    HD1  PHE  30          1HD       PHE  30  -8.362  -0.392  -0.267
  223    HD2  PHE  30          2HD       PHE  30  -8.825   3.391   1.627
  224    HE1  PHE  30          1HE       PHE  30  -9.266   0.540  -2.358
  225    HE2  PHE  30          2HE       PHE  30  -9.731   4.329  -0.459
  226    HZ   PHE  30           HZ       PHE  30  -9.953   2.903  -2.455
  227    H    CYS  31           HN       CYS  31  -8.368  -2.262   3.543
  228    HA   CYS  31           HA       CYS  31  -8.218  -2.124   6.319
  229    HB2  CYS  31          2HB       CYS  31  -7.163  -4.248   6.250
  230    HB3  CYS  31          3HB       CYS  31  -8.241  -4.203   4.859
  231    H    THR  32           HN       THR  32  -6.758  -1.373   7.722
  232    HA   THR  32           HA       THR  32  -4.890   0.476   7.306
  233    HB   THR  32           HB       THR  32  -4.553  -1.815   9.252
  234    HG1  THR  32          1HG       THR  32  -6.159   0.427   9.175
  235   HG21  THR  32          1HG2      THR  32  -3.115  -0.321  10.517
  236   HG22  THR  32          2HG2      THR  32  -3.323   0.943   9.304
  237   HG23  THR  32          3HG2      THR  32  -2.466  -0.542   8.892
  238    H    LEU  33           HN       LEU  33  -4.144  -3.007   7.218
  239    HA   LEU  33           HA       LEU  33  -1.499  -3.063   6.732
  240    HB2  LEU  33          2HB       LEU  33  -3.758  -4.657   5.643
  241    HB3  LEU  33          3HB       LEU  33  -2.163  -4.893   4.932
  242    HG   LEU  33           HG       LEU  33  -2.834  -6.511   6.752
  243   HD11  LEU  33          1HD1      LEU  33  -0.539  -6.031   7.991
  244   HD12  LEU  33          2HD1      LEU  33  -0.323  -4.940   6.623
  245   HD13  LEU  33          3HD1      LEU  33  -0.604  -6.658   6.343
  246   HD21  LEU  33          1HD2      LEU  33  -3.861  -5.328   8.428
  247   HD22  LEU  33          2HD2      LEU  33  -2.751  -3.963   8.297
  248   HD23  LEU  33          3HD2      LEU  33  -2.224  -5.457   9.074
  249    H    CYS  34           HN       CYS  34  -3.763  -3.027   3.976
  250    HA   CYS  34           HA       CYS  34  -1.834  -2.278   2.082
  251    HB2  CYS  34          2HB       CYS  34  -4.805  -1.740   1.920
  252    HB3  CYS  34          3HB       CYS  34  -3.680  -1.898   0.575
  253    H    LEU  35           HN       LEU  35  -4.496  -0.261   3.345
  254    HA   LEU  35           HA       LEU  35  -3.750   2.158   2.311
  255    HB2  LEU  35          2HB       LEU  35  -5.796   1.597   3.684
  256    HB3  LEU  35          3HB       LEU  35  -4.794   1.830   5.115
  257    HG   LEU  35           HG       LEU  35  -4.436   4.171   4.472
  258   HD11  LEU  35          1HD1      LEU  35  -6.198   3.426   2.153
  259   HD12  LEU  35          2HD1      LEU  35  -4.579   4.123   2.114
  260   HD13  LEU  35          3HD1      LEU  35  -5.943   5.092   2.672
  261   HD21  LEU  35          1HD2      LEU  35  -6.874   2.979   5.342
  262   HD22  LEU  35          2HD2      LEU  35  -7.251   4.392   4.355
  263   HD23  LEU  35          3HD2      LEU  35  -6.198   4.554   5.761
  264    H    LYS  36           HN       LYS  36  -2.124   0.337   4.713
  265    HA   LYS  36           HA       LYS  36  -0.593   2.621   5.680
  266    HB2  LYS  36          2HB       LYS  36  -1.239   1.048   7.370
  267    HB3  LYS  36          3HB       LYS  36  -0.607  -0.302   6.436
  268    HG2  LYS  36          2HG       LYS  36   1.598   1.294   6.721
  269    HG3  LYS  36          3HG       LYS  36   0.755   1.525   8.255
  270    HD2  LYS  36          2HD       LYS  36   0.546  -1.080   8.198
  271    HD3  LYS  36          3HD       LYS  36   1.900  -0.969   7.072
  272    HE2  LYS  36          2HE       LYS  36   2.976   0.531   8.878
  273    HE3  LYS  36          3HE       LYS  36   1.768  -0.165   9.957
  274    HZ1  LYS  36          1HZ       LYS  36   3.801  -1.668   8.399
  275    HZ2  LYS  36          2HZ       LYS  36   2.603  -2.374   9.362
  276    HZ3  LYS  36          3HZ       LYS  36   3.804  -1.418  10.072
  277    H    GLN  37           HN       GLN  37   0.406  -0.644   4.662
  278    HA   GLN  37           HA       GLN  37   3.003  -0.204   4.069
  279    HB2  GLN  37          2HB       GLN  37   1.118  -2.192   3.448
  280    HB3  GLN  37          3HB       GLN  37   1.871  -1.760   1.919
  281    HG2  GLN  37          2HG       GLN  37   3.864  -2.633   2.494
  282    HG3  GLN  37          3HG       GLN  37   3.704  -2.167   4.186
  283   HE21  GLN  37          1HE2      GLN  37   1.404  -3.374   4.931
  284   HE22  GLN  37          2HE2      GLN  37   1.560  -5.091   4.817
  285    H    TYR  38           HN       TYR  38   0.285   1.044   2.341
  286    HA   TYR  38           HA       TYR  38   1.787   1.746  -0.022
  287    HB2  TYR  38          2HB       TYR  38  -0.316   1.630  -0.804
  288    HB3  TYR  38          3HB       TYR  38  -1.006   1.765   0.810
  289    HD1  TYR  38          1HD       TYR  38  -2.623   3.410   0.823
  290    HD2  TYR  38          2HD       TYR  38   0.997   4.117  -1.298
  291    HE1  TYR  38          1HE       TYR  38  -3.375   5.696   0.315
  292    HE2  TYR  38          2HE       TYR  38   0.255   6.405  -1.812
  293    HH   TYR  38           HH       TYR  38  -2.974   7.472  -1.198
  294    H    VAL  39           HN       VAL  39  -0.063   3.747   2.282
  295    HA   VAL  39           HA       VAL  39   1.196   6.161   1.579
  296    HB   VAL  39           HB       VAL  39   0.172   7.127   3.532
  297   HG11  VAL  39          1HG1      VAL  39  -1.285   6.556   1.631
  298   HG12  VAL  39          2HG1      VAL  39  -1.653   5.010   2.398
  299   HG13  VAL  39          3HG1      VAL  39  -2.144   6.519   3.169
  300   HG21  VAL  39          1HG2      VAL  39  -1.044   5.624   5.153
  301   HG22  VAL  39          2HG2      VAL  39  -0.155   4.276   4.444
  302   HG23  VAL  39          3HG2      VAL  39   0.716   5.582   5.246
  303    H    GLU  40           HN       GLU  40   1.724   4.012   4.371
  304    HA   GLU  40           HA       GLU  40   3.618   5.323   5.782
  305    HB2  GLU  40          2HB       GLU  40   2.690   2.773   5.792
  306    HB3  GLU  40          3HB       GLU  40   4.341   2.511   5.246
  307    HG2  GLU  40          2HG       GLU  40   4.428   4.309   7.430
  308    HG3  GLU  40          3HG       GLU  40   3.389   2.958   7.877
  309    H    LEU  41           HN       LEU  41   3.999   3.964   2.607
  310    HA   LEU  41           HA       LEU  41   6.881   4.231   2.614
  311    HB2  LEU  41          2HB       LEU  41   4.831   3.136   0.811
  312    HB3  LEU  41          3HB       LEU  41   6.234   3.844   0.014
  313    HG   LEU  41           HG       LEU  41   6.444   1.415   0.314
  314   HD11  LEU  41          1HD1      LEU  41   8.385   2.974   2.013
  315   HD12  LEU  41          2HD1      LEU  41   8.436   2.860   0.254
  316   HD13  LEU  41          3HD1      LEU  41   8.677   1.416   1.239
  317   HD21  LEU  41          1HD2      LEU  41   5.217   1.752   2.691
  318   HD22  LEU  41          2HD2      LEU  41   6.898   1.645   3.216
  319   HD23  LEU  41          3HD2      LEU  41   6.181   0.336   2.275
  320    H    LEU  42           HN       LEU  42   4.093   5.896   1.224
  321    HA   LEU  42           HA       LEU  42   5.791   7.878  -0.048
  322    HB2  LEU  42          2HB       LEU  42   2.838   7.380   0.035
  323    HB3  LEU  42          3HB       LEU  42   3.483   8.900  -0.582
  324    HG   LEU  42           HG       LEU  42   4.375   6.267  -1.711
  325   HD11  LEU  42          1HD1      LEU  42   2.179   5.942  -2.189
  326   HD12  LEU  42          2HD1      LEU  42   2.589   7.015  -3.528
  327   HD13  LEU  42          3HD1      LEU  42   1.787   7.659  -2.096
  328   HD21  LEU  42          1HD2      LEU  42   5.726   7.769  -2.703
  329   HD22  LEU  42          2HD2      LEU  42   4.651   9.125  -2.358
  330   HD23  LEU  42          3HD2      LEU  42   4.321   8.062  -3.727
  331    H    ILE  43           HN       ILE  43   3.036   8.051   2.216
  332    HA   ILE  43           HA       ILE  43   3.140  10.623   3.016
  333    HB   ILE  43           HB       ILE  43   1.970   8.333   4.039
  334   HG12  ILE  43          2HG1      ILE  43   1.145  10.276   5.770
  335   HG13  ILE  43          3HG1      ILE  43   1.819  11.244   4.464
  336   HG21  ILE  43          1HG2      ILE  43   3.848   8.002   5.556
  337   HG22  ILE  43          2HG2      ILE  43   3.631   9.631   6.193
  338   HG23  ILE  43          3HG2      ILE  43   2.383   8.412   6.449
  339   HD11  ILE  43          1HD1      ILE  43  -0.719  10.147   4.592
  340   HD12  ILE  43          2HD1      ILE  43   0.055  10.866   3.180
  341   HD13  ILE  43          3HD1      ILE  43   0.148   9.125   3.446
  342    H    LYS  44           HN       LYS  44   5.541   8.213   3.639
  343    HA   LYS  44           HA       LYS  44   6.850   9.630   5.766
  344    HB2  LYS  44          2HB       LYS  44   7.039   7.060   4.562
  345    HB3  LYS  44          3HB       LYS  44   8.626   7.811   4.461
  346    HG2  LYS  44          2HG       LYS  44   8.357   6.468   6.489
  347    HG3  LYS  44          3HG       LYS  44   8.648   8.171   6.852
  348    HD2  LYS  44          2HD       LYS  44   6.890   7.897   8.243
  349    HD3  LYS  44          3HD       LYS  44   5.951   8.152   6.770
  350    HE2  LYS  44          2HE       LYS  44   5.151   6.074   6.824
  351    HE3  LYS  44          3HE       LYS  44   6.760   5.389   7.051
  352    HZ1  LYS  44          1HZ       LYS  44   4.740   6.084   9.036
  353    HZ2  LYS  44          2HZ       LYS  44   6.354   6.341   9.468
  354    HZ3  LYS  44          3HZ       LYS  44   5.836   4.796   9.014
  355    H    GLU  45           HN       GLU  45   7.634   9.011   2.343
  356    HA   GLU  45           HA       GLU  45   9.895  10.742   2.340
  357    HB2  GLU  45          2HB       GLU  45   8.927   8.804   0.649
  358    HB3  GLU  45          3HB       GLU  45   8.606  10.277  -0.254
  359    HG2  GLU  45          2HG       GLU  45  10.694  10.014  -0.995
  360    HG3  GLU  45          3HG       GLU  45  11.151  10.718   0.554
  361    H    GLY  46           HN       GLY  46   6.621  11.059   0.960
  362    HA2  GLY  46          1HA       GLY  46   5.430  12.912   0.307
  363    HA3  GLY  46          2HA       GLY  46   6.182  13.687   1.694
  364    H    LEU  47           HN       LEU  47   7.355  12.568  -1.484
  365    HA   LEU  47           HA       LEU  47   8.967  14.966  -1.732
  366    HB2  LEU  47          2HB       LEU  47   9.692  13.896  -3.878
  367    HB3  LEU  47          3HB       LEU  47  10.032  12.970  -2.418
  368    HG   LEU  47           HG       LEU  47   7.528  12.334  -3.877
  369   HD11  LEU  47          1HD1      LEU  47   9.454  12.654  -5.561
  370   HD12  LEU  47          2HD1      LEU  47   8.523  11.158  -5.612
  371   HD13  LEU  47          3HD1      LEU  47  10.114  11.181  -4.851
  372   HD21  LEU  47          1HD2      LEU  47   9.298  11.148  -1.924
  373   HD22  LEU  47          2HD2      LEU  47   8.989  10.049  -3.268
  374   HD23  LEU  47          3HD2      LEU  47   7.641  10.721  -2.350
  375    H    GLU  48           HN       GLU  48   5.925  13.777  -2.822
  376    HA   GLU  48           HA       GLU  48   4.876  16.120  -3.702
  377    HB2  GLU  48          2HB       GLU  48   5.079  15.691  -6.278
  378    HB3  GLU  48          3HB       GLU  48   6.351  16.553  -5.422
  379    HG2  GLU  48          2HG       GLU  48   7.865  14.997  -5.891
  380    HG3  GLU  48          3HG       GLU  48   6.778  13.683  -5.441
  381    H    THR  49           HN       THR  49   5.121  12.696  -4.055
  382    HA   THR  49           HA       THR  49   3.008  11.923  -5.566
  383    HB   THR  49           HB       THR  49   3.565  10.733  -2.844
  384    HG1  THR  49          1HG       THR  49   5.042  10.749  -5.198
  385   HG21  THR  49          1HG2      THR  49   1.692  10.076  -4.827
  386   HG22  THR  49          2HG2      THR  49   2.152   9.110  -3.425
  387   HG23  THR  49          3HG2      THR  49   2.978   8.878  -4.965
  388    H    ALA  50           HN       ALA  50   2.868  13.618  -2.548
  389    HA   ALA  50           HA       ALA  50   1.151  14.450  -1.305
  390    HB1  ALA  50          1HB       ALA  50   0.534  15.710  -3.187
  391    HB2  ALA  50          2HB       ALA  50  -0.115  14.299  -4.023
  392    HB3  ALA  50          3HB       ALA  50  -0.963  14.963  -2.628
  393    H    ILE  51           HN       ILE  51   1.382  11.404  -1.955
  394    HA   ILE  51           HA       ILE  51   0.166   9.475  -1.613
  395    HB   ILE  51           HB       ILE  51  -0.513  11.119   0.826
  396   HG12  ILE  51          2HG1      ILE  51   1.347   9.949   1.865
  397   HG13  ILE  51          3HG1      ILE  51   1.599   8.993   0.408
  398   HG21  ILE  51          1HG2      ILE  51  -1.158   9.120   1.931
  399   HG22  ILE  51          2HG2      ILE  51  -2.040   9.168   0.406
  400   HG23  ILE  51          3HG2      ILE  51  -0.630   8.123   0.575
  401   HD11  ILE  51          1HD1      ILE  51   3.072  11.101   0.960
  402   HD12  ILE  51          2HD1      ILE  51   2.619  10.698  -0.697
  403   HD13  ILE  51          3HD1      ILE  51   1.734  11.947   0.181
  404    H    SER  52           HN       SER  52  -1.351   9.549  -3.300
  405    HA   SER  52           HA       SER  52  -3.982  10.675  -2.656
  406    HB2  SER  52          2HB       SER  52  -4.379  10.052  -5.159
  407    HB3  SER  52          3HB       SER  52  -3.382  11.453  -4.772
  408    HG   SER  52           HG       SER  52  -2.453   8.848  -5.414
  409    H    CYS  53           HN       CYS  53  -5.887   9.433  -2.943
  410    HA   CYS  53           HA       CYS  53  -6.132   7.074  -1.733
  411    HB2  CYS  53          2HB       CYS  53  -8.052   8.311  -2.615
  412    HB3  CYS  53          3HB       CYS  53  -7.621   7.837  -4.255
  413    HA   PRO  54           HA       PRO  54  -3.827   4.062  -3.993
  414    HB2  PRO  54          2HB       PRO  54  -4.871   1.845  -2.823
  415    HB3  PRO  54          3HB       PRO  54  -3.710   2.903  -2.012
  416    HG2  PRO  54          2HG       PRO  54  -6.690   2.802  -1.743
  417    HG3  PRO  54          3HG       PRO  54  -5.457   2.967  -0.480
  418    HD2  PRO  54          2HD       PRO  54  -6.861   5.078  -1.431
  419    HD3  PRO  54          3HD       PRO  54  -5.185   5.223  -0.866
  420    H    ASP  55           HN       ASP  55  -7.004   4.777  -4.458
  421    HA   ASP  55           HA       ASP  55  -7.452   2.541  -6.317
  422    HB2  ASP  55          2HB       ASP  55  -9.194   2.893  -4.590
  423    HB3  ASP  55          3HB       ASP  55  -9.458   4.520  -5.214
  424    H    ALA  56           HN       ALA  56  -6.223   3.316  -8.038
  425    HA   ALA  56           HA       ALA  56  -6.242   5.895  -9.080
  426    HB1  ALA  56          1HB       ALA  56  -4.757   5.008 -10.468
  427    HB2  ALA  56          2HB       ALA  56  -5.113   3.423  -9.777
  428    HB3  ALA  56          3HB       ALA  56  -5.991   3.982 -11.201
  429    H    ALA  57           HN       ALA  57  -8.747   3.633  -9.011
  430    HA   ALA  57           HA       ALA  57 -10.114   4.882 -11.295
  431    HB1  ALA  57          1HB       ALA  57  -9.860   2.380 -11.228
  432    HB2  ALA  57          2HB       ALA  57 -10.957   2.382  -9.847
  433    HB3  ALA  57          3HB       ALA  57 -11.512   2.969 -11.415
  434    H    CYS  58           HN       CYS  58  -9.778   5.803  -8.378
  435    HA   CYS  58           HA       CYS  58 -12.342   5.718  -7.176
  436    HB2  CYS  58          2HB       CYS  58 -10.128   6.232  -6.037
  437    HB3  CYS  58          3HB       CYS  58 -10.252   7.848  -6.727
  438    HA   PRO  59           HA       PRO  59 -14.459   8.683  -9.677
  439    HB2  PRO  59          2HB       PRO  59 -16.577   9.092  -8.027
  440    HB3  PRO  59          3HB       PRO  59 -16.388   7.631  -9.005
  441    HG2  PRO  59          2HG       PRO  59 -15.770   8.065  -6.107
  442    HG3  PRO  59          3HG       PRO  59 -16.562   6.683  -6.888
  443    HD2  PRO  59          2HD       PRO  59 -13.954   6.646  -6.157
  444    HD3  PRO  59          3HD       PRO  59 -14.563   5.763  -7.572
  445    H    LYS  60           HN       LYS  60 -13.200   9.271  -6.544
  446    HA   LYS  60           HA       LYS  60 -13.523  12.172  -6.952
  447    HB2  LYS  60          2HB       LYS  60 -13.175  11.069  -4.200
  448    HB3  LYS  60          3HB       LYS  60 -13.989  12.538  -4.723
  449    HG2  LYS  60          2HG       LYS  60 -15.566  10.652  -5.856
  450    HG3  LYS  60          3HG       LYS  60 -15.027   9.814  -4.399
  451    HD2  LYS  60          2HD       LYS  60 -15.638  12.285  -3.421
  452    HD3  LYS  60          3HD       LYS  60 -16.838  12.102  -4.703
  453    HE2  LYS  60          2HE       LYS  60 -17.489   9.926  -3.742
  454    HE3  LYS  60          3HE       LYS  60 -16.330  10.176  -2.437
  455    HZ1  LYS  60          1HZ       LYS  60 -18.645  10.771  -1.856
  456    HZ2  LYS  60          2HZ       LYS  60 -18.597  12.001  -3.016
  457    HZ3  LYS  60          3HZ       LYS  60 -17.560  12.058  -1.681
  458    H    GLN  61           HN       GLN  61 -11.426   9.534  -6.390
  459    HA   GLN  61           HA       GLN  61  -9.206   9.402  -5.750
  460    HB2  GLN  61          2HB       GLN  61  -7.838  10.942  -7.340
  461    HB3  GLN  61          3HB       GLN  61  -8.826   9.659  -8.023
  462    HG2  GLN  61          2HG       GLN  61 -10.516  11.189  -8.674
  463    HG3  GLN  61          3HG       GLN  61  -9.774  12.496  -7.755
  464   HE21  GLN  61          1HE2      GLN  61  -9.440  10.426 -10.561
  465   HE22  GLN  61          2HE2      GLN  61  -8.369  11.462 -11.435
  466    H    GLY  62           HN       GLY  62  -9.868  10.448  -3.614
  467    HA2  GLY  62          1HA       GLY  62  -9.027  13.197  -3.257
  468    HA3  GLY  62          2HA       GLY  62  -9.640  12.119  -2.010
  469    H    HIS  63           HN       HIS  63  -7.417  13.859  -1.720
  470    HA   HIS  63           HA       HIS  63  -5.080  12.109  -1.800
  471    HB2  HIS  63          2HB       HIS  63  -5.448  15.048  -1.248
  472    HB3  HIS  63          3HB       HIS  63  -3.924  14.227  -0.925
  473    HD1  HIS  63          1HD       HIS  63  -5.852  15.811  -3.594
  474    HD2  HIS  63          2HD       HIS  63  -2.692  13.128  -3.319
  475    HE1  HIS  63          1HE       HIS  63  -4.797  15.779  -5.876
  476    H    LEU  64           HN       LEU  64  -3.609  12.275   0.188
  477    HA   LEU  64           HA       LEU  64  -5.259  12.008   2.614
  478    HB2  LEU  64          2HB       LEU  64  -2.851  10.453   1.707
  479    HB3  LEU  64          3HB       LEU  64  -3.426  10.427   3.374
  480    HG   LEU  64           HG       LEU  64  -5.292   9.701   1.155
  481   HD11  LEU  64          1HD1      LEU  64  -2.932   8.168   2.064
  482   HD12  LEU  64          2HD1      LEU  64  -3.765   8.159   0.509
  483   HD13  LEU  64          3HD1      LEU  64  -4.444   7.280   1.878
  484   HD21  LEU  64          1HD2      LEU  64  -5.588   8.033   3.357
  485   HD22  LEU  64          2HD2      LEU  64  -6.596   9.417   2.935
  486   HD23  LEU  64          3HD2      LEU  64  -5.239   9.619   4.044
  487    H    GLN  65           HN       GLN  65  -4.181  12.499   4.644
  488    HA   GLN  65           HA       GLN  65  -2.509  14.851   4.383
  489    HB2  GLN  65          2HB       GLN  65  -3.018  13.928   7.102
  490    HB3  GLN  65          3HB       GLN  65  -3.384  15.477   6.354
  491    HG2  GLN  65          2HG       GLN  65  -5.477  14.705   6.881
  492    HG3  GLN  65          3HG       GLN  65  -5.312  14.172   5.208
  493   HE21  GLN  65          1HE2      GLN  65  -3.334  12.110   6.185
  494   HE22  GLN  65          2HE2      GLN  65  -4.322  10.837   6.805
  495    H    GLU  66           HN       GLU  66  -0.544  15.142   5.611
  496    HA   GLU  66           HA       GLU  66   1.079  12.724   5.588
  497    HB2  GLU  66          2HB       GLU  66   1.619  15.647   5.514
  498    HB3  GLU  66          3HB       GLU  66   2.853  14.618   6.226
  499    HG2  GLU  66          2HG       GLU  66   2.571  13.226   4.051
  500    HG3  GLU  66          3HG       GLU  66   1.856  14.709   3.419
  501    H    ASN  67           HN       ASN  67  -0.466  14.828   7.821
  502    HA   ASN  67           HA       ASN  67   1.176  13.953  10.063
  503    HB2  ASN  67          2HB       ASN  67  -1.107  15.451  10.912
  504    HB3  ASN  67          3HB       ASN  67   0.590  15.921  10.944
  505   HD21  ASN  67          1HD2      ASN  67  -2.247  17.017  10.047
  506   HD22  ASN  67          2HD2      ASN  67  -1.836  17.911   8.627
  507    H    GLU  68           HN       GLU  68  -2.270  13.906   9.150
  508    HA   GLU  68           HA       GLU  68  -3.204  12.337  11.242
  509    HB2  GLU  68          2HB       GLU  68  -4.181  13.228   8.671
  510    HB3  GLU  68          3HB       GLU  68  -4.706  11.583   8.998
  511    HG2  GLU  68          2HG       GLU  68  -5.006  13.551  11.184
  512    HG3  GLU  68          3HG       GLU  68  -6.072  13.721   9.791
  513    H    ILE  69           HN       ILE  69  -2.340  11.231   7.961
  514    HA   ILE  69           HA       ILE  69  -2.633   8.514   8.354
  515    HB   ILE  69           HB       ILE  69  -0.715  10.021   6.588
  516   HG12  ILE  69          2HG1      ILE  69  -3.485   9.141   6.418
  517   HG13  ILE  69          3HG1      ILE  69  -2.614  10.301   5.420
  518   HG21  ILE  69          1HG2      ILE  69  -1.216   7.049   6.675
  519   HG22  ILE  69          2HG2      ILE  69  -0.329   7.891   5.407
  520   HG23  ILE  69          3HG2      ILE  69   0.295   7.873   7.056
  521   HD11  ILE  69          1HD1      ILE  69  -1.765   8.537   4.031
  522   HD12  ILE  69          2HD1      ILE  69  -2.481   7.315   5.084
  523   HD13  ILE  69          3HD1      ILE  69  -3.518   8.394   4.151
  524    H    GLU  70           HN       GLU  70   0.488  10.249   8.456
  525    HA   GLU  70           HA       GLU  70   2.036   8.190   9.446
  526    HB2  GLU  70          2HB       GLU  70   3.672   9.792   9.953
  527    HB3  GLU  70          3HB       GLU  70   2.751  10.518   8.643
  528    HG2  GLU  70          2HG       GLU  70   1.596  11.956  10.148
  529    HG3  GLU  70          3HG       GLU  70   2.261  11.115  11.547
  530    H    CYS  71           HN       CYS  71  -0.379  10.019  11.055
  531    HA   CYS  71           HA       CYS  71   0.546   9.655  13.724
  532    HB2  CYS  71          2HB       CYS  71  -1.552  11.040  12.464
  533    HB3  CYS  71          3HB       CYS  71  -2.325   9.901  13.558
  534    HG   CYS  71           HG       CYS  71  -0.161  10.993  15.497
  535    H    MET  72           HN       MET  72  -1.441   7.787  11.529
  536    HA   MET  72           HA       MET  72  -2.196   5.898  13.601
  537    HB2  MET  72          2HB       MET  72  -3.760   5.109  12.143
  538    HB3  MET  72          3HB       MET  72  -3.526   6.697  11.427
  539    HG2  MET  72          2HG       MET  72  -1.655   5.400  10.075
  540    HG3  MET  72          3HG       MET  72  -2.699   4.029  10.447
  541    HE1  MET  72          1HE       MET  72  -3.605   3.736   7.460
  542    HE2  MET  72          2HE       MET  72  -3.054   5.240   6.721
  543    HE3  MET  72          3HE       MET  72  -2.014   4.385   7.863
  544    H    VAL  73           HN       VAL  73   0.613   6.411  12.242
  545    HA   VAL  73           HA       VAL  73   1.324   3.569  12.228
  546    HB   VAL  73           HB       VAL  73   3.014   4.408  10.316
  547   HG11  VAL  73          1HG1      VAL  73   0.307   3.165  10.193
  548   HG12  VAL  73          2HG1      VAL  73   1.156   3.533   8.690
  549   HG13  VAL  73          3HG1      VAL  73   1.889   2.453   9.877
  550   HG21  VAL  73          1HG2      VAL  73   1.419   6.595  10.482
  551   HG22  VAL  73          2HG2      VAL  73   2.308   6.118   9.036
  552   HG23  VAL  73          3HG2      VAL  73   0.609   5.681   9.210
  553    H    ALA  74           HN       ALA  74   2.922   6.706  11.641
  554    HA   ALA  74           HA       ALA  74   5.176   5.908  13.266
  555    HB1  ALA  74          1HB       ALA  74   4.860   7.601  11.110
  556    HB2  ALA  74          2HB       ALA  74   5.132   8.699  12.465
  557    HB3  ALA  74          3HB       ALA  74   6.308   7.435  12.104
  558    H    ALA  75           HN       ALA  75   2.322   6.578  14.292
  559    HA   ALA  75           HA       ALA  75   2.114   8.812  15.791
  560    HB1  ALA  75          1HB       ALA  75   0.361   7.729  16.610
  561    HB2  ALA  75          2HB       ALA  75   0.947   6.253  15.842
  562    HB3  ALA  75          3HB       ALA  75   1.412   6.628  17.502
  Start of MODEL    3
    1    H1   ALA   1           HN       ALA   1 -20.845 -15.105  -9.820
    2    HA   ALA   1           HA       ALA   1 -19.696 -13.395  -8.753
    3    HB1  ALA   1          1HB       ALA   1 -22.584 -12.660  -8.948
    4    HB2  ALA   1          2HB       ALA   1 -21.437 -11.533  -8.223
    5    HB3  ALA   1          3HB       ALA   1 -21.210 -12.074  -9.886
    6    H    LEU   2           HN       LEU   2 -19.362 -15.057  -6.893
    7    HA   LEU   2           HA       LEU   2 -20.816 -14.732  -4.486
    8    HB2  LEU   2          2HB       LEU   2 -18.547 -16.237  -5.422
    9    HB3  LEU   2          3HB       LEU   2 -18.226 -15.568  -3.823
   10    HG   LEU   2           HG       LEU   2 -19.096 -17.821  -3.642
   11   HD11  LEU   2          1HD1      LEU   2 -21.109 -15.746  -2.787
   12   HD12  LEU   2          2HD1      LEU   2 -19.675 -16.242  -1.888
   13   HD13  LEU   2          3HD1      LEU   2 -20.989 -17.387  -2.153
   14   HD21  LEU   2          1HD2      LEU   2 -20.703 -17.076  -5.807
   15   HD22  LEU   2          2HD2      LEU   2 -21.812 -17.347  -4.462
   16   HD23  LEU   2          3HD2      LEU   2 -20.696 -18.621  -4.957
   17    H    ASP   3           HN       ASP   3 -20.874 -12.973  -3.270
   18    HA   ASP   3           HA       ASP   3 -18.396 -11.580  -2.634
   19    HB2  ASP   3          2HB       ASP   3 -19.089 -10.240  -4.464
   20    HB3  ASP   3          3HB       ASP   3 -20.774 -10.278  -3.951
   21    HA   PRO   4           HA       PRO   4 -21.199 -12.217   0.992
   22    HB2  PRO   4          2HB       PRO   4 -19.222 -13.045   2.658
   23    HB3  PRO   4          3HB       PRO   4 -20.087 -14.141   1.574
   24    HG2  PRO   4          2HG       PRO   4 -17.407 -12.854   1.224
   25    HG3  PRO   4          3HG       PRO   4 -17.901 -14.520   0.876
   26    HD2  PRO   4          2HD       PRO   4 -17.674 -12.636  -1.055
   27    HD3  PRO   4          3HD       PRO   4 -18.867 -13.947  -1.137
   28    H    LEU   5           HN       LEU   5 -17.955 -10.785   0.839
   29    HA   LEU   5           HA       LEU   5 -18.944  -8.498   2.366
   30    HB2  LEU   5          2HB       LEU   5 -16.704 -10.304   3.144
   31    HB3  LEU   5          3HB       LEU   5 -16.585  -8.586   3.514
   32    HG   LEU   5           HG       LEU   5 -19.035 -10.047   4.364
   33   HD11  LEU   5          1HD1      LEU   5 -18.009 -10.872   6.356
   34   HD12  LEU   5          2HD1      LEU   5 -16.458 -10.156   5.918
   35   HD13  LEU   5          3HD1      LEU   5 -17.105 -11.500   4.978
   36   HD21  LEU   5          1HD2      LEU   5 -17.390  -7.976   5.798
   37   HD22  LEU   5          2HD2      LEU   5 -19.067  -8.438   6.095
   38   HD23  LEU   5          3HD2      LEU   5 -18.639  -7.563   4.624
   39    H    VAL   6           HN       VAL   6 -15.560  -9.110   1.810
   40    HA   VAL   6           HA       VAL   6 -13.991  -8.002   0.587
   41    HB   VAL   6           HB       VAL   6 -15.992  -7.553  -1.594
   42   HG11  VAL   6          1HG1      VAL   6 -13.081  -8.317  -1.475
   43   HG12  VAL   6          2HG1      VAL   6 -14.026  -8.308  -2.965
   44   HG13  VAL   6          3HG1      VAL   6 -13.781  -6.810  -2.065
   45   HG21  VAL   6          1HG2      VAL   6 -14.929 -10.210  -0.667
   46   HG22  VAL   6          2HG2      VAL   6 -16.606  -9.738  -0.934
   47   HG23  VAL   6          3HG2      VAL   6 -15.518  -9.939  -2.307
   48    H    SER   7           HN       SER   7 -13.548  -6.107   1.568
   49    HA   SER   7           HA       SER   7 -15.226  -3.788   0.868
   50    HB2  SER   7          2HB       SER   7 -14.149  -4.707   3.421
   51    HB3  SER   7          3HB       SER   7 -13.740  -3.025   3.082
   52    HG   SER   7           HG       SER   7 -15.691  -2.815   3.942
   53    H    CYS   8           HN       CYS   8 -11.892  -4.703   1.726
   54    HA   CYS   8           HA       CYS   8 -10.740  -2.309   0.716
   55    HB2  CYS   8          2HB       CYS   8  -9.701  -3.831   2.434
   56    HB3  CYS   8          3HB       CYS   8  -9.357  -4.963   1.131
   57    H    LYS   9           HN       LYS   9  -9.360  -2.083  -1.128
   58    HA   LYS   9           HA       LYS   9  -9.914  -4.001  -3.293
   59    HB2  LYS   9          2HB       LYS   9  -9.574  -1.113  -3.951
   60    HB3  LYS   9          3HB       LYS   9 -10.497  -2.352  -4.790
   61    HG2  LYS   9          2HG       LYS   9 -11.876  -2.200  -2.474
   62    HG3  LYS   9          3HG       LYS   9 -11.295  -0.538  -2.621
   63    HD2  LYS   9          2HD       LYS   9 -12.138  -1.025  -5.156
   64    HD3  LYS   9          3HD       LYS   9 -13.276  -2.004  -4.228
   65    HE2  LYS   9          2HE       LYS   9 -13.967  -0.105  -2.947
   66    HE3  LYS   9          3HE       LYS   9 -12.689   0.893  -3.641
   67    HZ1  LYS   9          1HZ       LYS   9 -13.774   0.582  -5.828
   68    HZ2  LYS   9          2HZ       LYS   9 -14.738   1.416  -4.716
   69    HZ3  LYS   9          3HZ       LYS   9 -15.053  -0.211  -5.056
   70    H    LEU  10           HN       LEU  10  -7.623  -3.930  -1.595
   71    HA   LEU  10           HA       LEU  10  -5.563  -3.288  -3.593
   72    HB2  LEU  10          2HB       LEU  10  -5.505  -2.768  -0.631
   73    HB3  LEU  10          3HB       LEU  10  -4.050  -2.796  -1.626
   74    HG   LEU  10           HG       LEU  10  -6.307  -0.955  -2.319
   75   HD11  LEU  10          1HD1      LEU  10  -5.737   0.632  -0.777
   76   HD12  LEU  10          2HD1      LEU  10  -4.104   0.004  -0.567
   77   HD13  LEU  10          3HD1      LEU  10  -5.470  -0.830   0.172
   78   HD21  LEU  10          1HD2      LEU  10  -3.635   0.057  -2.599
   79   HD22  LEU  10          2HD2      LEU  10  -4.866  -0.209  -3.834
   80   HD23  LEU  10          3HD2      LEU  10  -3.774  -1.519  -3.380
   81    H    CYS  11           HN       CYS  11  -6.660  -5.334  -0.977
   82    HA   CYS  11           HA       CYS  11  -4.553  -7.279  -1.655
   83    HB2  CYS  11          2HB       CYS  11  -4.965  -8.242   0.607
   84    HB3  CYS  11          3HB       CYS  11  -4.365  -6.587   0.651
   85    H    LEU  12           HN       LEU  12  -7.911  -6.648  -1.627
   86    HA   LEU  12           HA       LEU  12  -9.716  -7.838  -2.328
   87    HB2  LEU  12          2HB       LEU  12  -7.969 -10.070  -3.255
   88    HB3  LEU  12          3HB       LEU  12  -9.432  -9.414  -3.987
   89    HG   LEU  12           HG       LEU  12  -6.824  -7.913  -3.945
   90   HD11  LEU  12          1HD1      LEU  12  -6.854 -10.236  -5.126
   91   HD12  LEU  12          2HD1      LEU  12  -6.175  -8.834  -5.950
   92   HD13  LEU  12          3HD1      LEU  12  -7.801  -9.387  -6.347
   93   HD21  LEU  12          1HD2      LEU  12  -8.062  -6.288  -4.806
   94   HD22  LEU  12          2HD2      LEU  12  -9.495  -7.315  -4.769
   95   HD23  LEU  12          3HD2      LEU  12  -8.437  -7.329  -6.179
   96    H    GLY  13           HN       GLY  13  -9.572  -8.053   0.219
   97    HA2  GLY  13          1HA       GLY  13  -9.783 -10.940   0.822
   98    HA3  GLY  13          2HA       GLY  13  -9.145  -9.774   1.972
   99    H    GLU  14           HN       GLU  14 -10.875 -10.857   3.294
  100    HA   GLU  14           HA       GLU  14 -13.418  -9.420   2.918
  101    HB2  GLU  14          2HB       GLU  14 -13.366 -12.062   4.312
  102    HB3  GLU  14          3HB       GLU  14 -14.682 -11.283   3.444
  103    HG2  GLU  14          2HG       GLU  14 -13.773 -11.867   1.346
  104    HG3  GLU  14          3HG       GLU  14 -12.237 -12.347   2.064
  105    H    TYR  15           HN       TYR  15 -13.458  -7.886   4.427
  106    HA   TYR  15           HA       TYR  15 -13.169  -8.656   7.216
  107    HB2  TYR  15          2HB       TYR  15 -11.726  -6.166   6.447
  108    HB3  TYR  15          3HB       TYR  15 -11.410  -7.285   7.768
  109    HD1  TYR  15          1HD       TYR  15 -10.303  -9.492   7.249
  110    HD2  TYR  15          2HD       TYR  15 -10.567  -6.343   4.399
  111    HE1  TYR  15          1HE       TYR  15  -8.498 -10.531   5.942
  112    HE2  TYR  15          2HE       TYR  15  -8.764  -7.375   3.083
  113    HH   TYR  15           HH       TYR  15  -6.741  -9.716   4.258
  114    HA   PRO  16           HA       PRO  16 -16.487  -5.842   7.797
  115    HB2  PRO  16          2HB       PRO  16 -16.045  -5.031  10.350
  116    HB3  PRO  16          3HB       PRO  16 -16.634  -6.647   9.944
  117    HG2  PRO  16          2HG       PRO  16 -13.854  -5.755  10.608
  118    HG3  PRO  16          3HG       PRO  16 -14.725  -7.202  11.150
  119    HD2  PRO  16          2HD       PRO  16 -12.892  -7.264   9.157
  120    HD3  PRO  16          3HD       PRO  16 -14.303  -8.342   9.192
  121    H    VAL  17           HN       VAL  17 -16.687  -3.565   9.227
  122    HA   VAL  17           HA       VAL  17 -14.920  -1.742   7.762
  123    HB   VAL  17           HB       VAL  17 -16.550  -0.044   8.048
  124   HG11  VAL  17          1HG1      VAL  17 -18.375  -2.363   7.663
  125   HG12  VAL  17          2HG1      VAL  17 -18.238  -0.868   6.736
  126   HG13  VAL  17          3HG1      VAL  17 -17.035  -2.144   6.539
  127   HG21  VAL  17          1HG2      VAL  17 -17.479  -1.763  10.267
  128   HG22  VAL  17          2HG2      VAL  17 -17.377  -0.006  10.159
  129   HG23  VAL  17          3HG2      VAL  17 -18.715  -0.860   9.391
  130    H    GLU  18           HN       GLU  18 -15.096  -3.144  10.741
  131    HA   GLU  18           HA       GLU  18 -14.250  -0.810  12.262
  132    HB2  GLU  18          2HB       GLU  18 -15.472  -3.321  12.883
  133    HB3  GLU  18          3HB       GLU  18 -13.973  -3.184  13.792
  134    HG2  GLU  18          2HG       GLU  18 -14.684  -1.242  14.891
  135    HG3  GLU  18          3HG       GLU  18 -16.003  -0.979  13.750
  136    H    GLN  19           HN       GLN  19 -12.852  -3.253  10.400
  137    HA   GLN  19           HA       GLN  19 -10.266  -2.965  11.775
  138    HB2  GLN  19          2HB       GLN  19 -11.439  -5.148  10.085
  139    HB3  GLN  19          3HB       GLN  19  -9.694  -4.991  10.236
  140    HG2  GLN  19          2HG       GLN  19 -10.285  -4.924  12.809
  141    HG3  GLN  19          3HG       GLN  19 -11.711  -5.797  12.252
  142   HE21  GLN  19          1HE2      GLN  19 -11.469  -7.841  11.341
  143   HE22  GLN  19          2HE2      GLN  19 -10.024  -8.768  11.541
  144    H    MET  20           HN       MET  20 -11.520  -1.072   9.860
  145    HA   MET  20           HA       MET  20  -9.311  -1.013   7.920
  146    HB2  MET  20          2HB       MET  20 -11.969   0.064   7.105
  147    HB3  MET  20          3HB       MET  20 -10.682  -0.613   6.114
  148    HG2  MET  20          2HG       MET  20 -11.392  -2.801   7.494
  149    HG3  MET  20          3HG       MET  20 -12.930  -1.941   7.475
  150    HE1  MET  20          1HE       MET  20 -10.492  -2.175   3.771
  151    HE2  MET  20          2HE       MET  20  -9.908  -2.361   5.423
  152    HE3  MET  20          3HE       MET  20 -10.358  -3.783   4.483
  153    H    THR  21           HN       THR  21  -9.401   1.286   6.785
  154    HA   THR  21           HA       THR  21  -9.938   3.342   8.814
  155    HB   THR  21           HB       THR  21  -7.347   2.951   7.318
  156    HG1  THR  21          1HG       THR  21  -8.170   2.882  10.015
  157   HG21  THR  21          1HG2      THR  21  -6.777   5.113   8.697
  158   HG22  THR  21          2HG2      THR  21  -8.514   5.393   8.577
  159   HG23  THR  21          3HG2      THR  21  -7.543   5.237   7.113
  160    H    THR  22           HN       THR  22 -10.557   5.327   8.035
  161    HA   THR  22           HA       THR  22 -11.546   5.376   5.334
  162    HB   THR  22           HB       THR  22 -11.571   7.553   7.435
  163    HG1  THR  22          1HG       THR  22 -12.761   5.515   7.853
  164   HG21  THR  22          1HG2      THR  22 -11.871   8.550   5.283
  165   HG22  THR  22          2HG2      THR  22 -13.462   8.436   6.036
  166   HG23  THR  22          3HG2      THR  22 -12.992   7.282   4.788
  167    H    ILE  23           HN       ILE  23 -10.967   6.822   3.693
  168    HA   ILE  23           HA       ILE  23  -8.219   7.336   3.411
  169    HB   ILE  23           HB       ILE  23 -10.588   8.394   1.874
  170   HG12  ILE  23          2HG1      ILE  23 -10.309   6.033   1.581
  171   HG13  ILE  23          3HG1      ILE  23  -9.678   6.814   0.135
  172   HG21  ILE  23          1HG2      ILE  23  -7.915   9.368   1.878
  173   HG22  ILE  23          2HG2      ILE  23  -8.216   8.558   0.342
  174   HG23  ILE  23          3HG2      ILE  23  -9.271   9.868   0.868
  175   HD11  ILE  23          1HD1      ILE  23  -7.407   6.657   1.442
  176   HD12  ILE  23          2HD1      ILE  23  -8.246   5.350   2.280
  177   HD13  ILE  23          3HD1      ILE  23  -8.040   5.287   0.530
  178    H    ALA  24           HN       ALA  24 -10.515   9.964   2.942
  179    HA   ALA  24           HA       ALA  24 -10.172  11.576   5.079
  180    HB1  ALA  24          1HB       ALA  24  -8.210  13.061   4.043
  181    HB2  ALA  24          2HB       ALA  24  -7.917  11.762   5.201
  182    HB3  ALA  24          3HB       ALA  24  -7.688  11.474   3.476
  183    H    GLN  25           HN       GLN  25  -9.958  11.495   1.569
  184    HA   GLN  25           HA       GLN  25 -11.509  13.993   1.447
  185    HB2  GLN  25          2HB       GLN  25  -9.352  12.881  -0.193
  186    HB3  GLN  25          3HB       GLN  25 -10.715  13.473  -1.135
  187    HG2  GLN  25          2HG       GLN  25  -8.830  15.102  -0.670
  188    HG3  GLN  25          3HG       GLN  25 -10.470  15.654  -0.334
  189   HE21  GLN  25          1HE2      GLN  25  -7.463  14.575   1.068
  190   HE22  GLN  25          2HE2      GLN  25  -7.758  15.185   2.657
  191    H    CYS  26           HN       CYS  26 -11.190  10.871  -0.248
  192    HA   CYS  26           HA       CYS  26 -13.846  11.092  -1.346
  193    HB2  CYS  26          2HB       CYS  26 -13.380   8.866  -2.311
  194    HB3  CYS  26          3HB       CYS  26 -12.097  10.020  -2.660
  195    H    GLN  27           HN       GLN  27 -12.275   9.390   1.287
  196    HA   GLN  27           HA       GLN  27 -13.192   8.476   3.181
  197    HB2  GLN  27          2HB       GLN  27 -15.949   8.738   2.016
  198    HB3  GLN  27          3HB       GLN  27 -15.464   8.732   3.707
  199    HG2  GLN  27          2HG       GLN  27 -15.247  10.937   1.698
  200    HG3  GLN  27          3HG       GLN  27 -16.031  10.944   3.276
  201   HE21  GLN  27          1HE2      GLN  27 -13.968   9.771   4.764
  202   HE22  GLN  27          2HE2      GLN  27 -12.656  10.892   4.852
  203    H    CYS  28           HN       CYS  28 -12.218   6.912   1.145
  204    HA   CYS  28           HA       CYS  28 -14.107   4.820   0.519
  205    HB2  CYS  28          2HB       CYS  28 -11.173   5.223  -0.030
  206    HB3  CYS  28          3HB       CYS  28 -11.982   3.705  -0.404
  207    H    ILE  29           HN       ILE  29 -12.845   2.491   0.785
  208    HA   ILE  29           HA       ILE  29 -12.213   2.269   3.654
  209    HB   ILE  29           HB       ILE  29 -14.506   1.301   2.528
  210   HG12  ILE  29          2HG1      ILE  29 -13.137  -0.115   4.808
  211   HG13  ILE  29          3HG1      ILE  29 -13.722   1.537   4.969
  212   HG21  ILE  29          1HG2      ILE  29 -13.266  -0.316   1.180
  213   HG22  ILE  29          2HG2      ILE  29 -12.549  -0.990   2.642
  214   HG23  ILE  29          3HG2      ILE  29 -14.286  -1.124   2.370
  215   HD11  ILE  29          1HD1      ILE  29 -15.688  -0.339   3.888
  216   HD12  ILE  29          2HD1      ILE  29 -15.164  -0.683   5.537
  217   HD13  ILE  29          3HD1      ILE  29 -15.852   0.892   5.141
  218    H    PHE  30           HN       PHE  30 -10.330   1.330   4.080
  219    HA   PHE  30           HA       PHE  30  -9.296  -0.783   2.391
  220    HB2  PHE  30          2HB       PHE  30  -7.789   1.815   2.754
  221    HB3  PHE  30          3HB       PHE  30  -7.108   0.346   2.061
  222    HD1  PHE  30          1HD       PHE  30  -8.968   3.330   1.432
  223    HD2  PHE  30          2HD       PHE  30  -8.149  -0.572  -0.058
  224    HE1  PHE  30          1HE       PHE  30  -9.774   4.013  -0.791
  225    HE2  PHE  30          2HE       PHE  30  -8.952   0.104  -2.282
  226    HZ   PHE  30           HZ       PHE  30  -9.764   2.400  -2.652
  227    H    CYS  31           HN       CYS  31  -8.125  -2.224   3.527
  228    HA   CYS  31           HA       CYS  31  -8.066  -2.082   6.342
  229    HB2  CYS  31          2HB       CYS  31  -6.995  -4.198   6.288
  230    HB3  CYS  31          3HB       CYS  31  -8.079  -4.176   4.902
  231    H    THR  32           HN       THR  32  -6.633  -1.241   7.711
  232    HA   THR  32           HA       THR  32  -4.762   0.591   7.240
  233    HB   THR  32           HB       THR  32  -4.039  -1.534   9.233
  234    HG1  THR  32          1HG       THR  32  -6.270   0.212   9.269
  235   HG21  THR  32          1HG2      THR  32  -3.926   1.483   9.235
  236   HG22  THR  32          2HG2      THR  32  -2.561   0.375   9.091
  237   HG23  THR  32          3HG2      THR  32  -3.474   0.461  10.598
  238    H    LEU  33           HN       LEU  33  -4.062  -2.898   7.222
  239    HA   LEU  33           HA       LEU  33  -1.401  -2.997   6.802
  240    HB2  LEU  33          2HB       LEU  33  -3.396  -4.552   5.163
  241    HB3  LEU  33          3HB       LEU  33  -1.723  -5.005   5.489
  242    HG   LEU  33           HG       LEU  33  -3.498  -4.637   7.834
  243   HD11  LEU  33          1HD1      LEU  33  -4.728  -6.563   7.583
  244   HD12  LEU  33          2HD1      LEU  33  -3.624  -7.243   6.387
  245   HD13  LEU  33          3HD1      LEU  33  -4.722  -5.940   5.932
  246   HD21  LEU  33          1HD2      LEU  33  -0.974  -5.801   7.207
  247   HD22  LEU  33          2HD2      LEU  33  -2.041  -7.061   7.826
  248   HD23  LEU  33          3HD2      LEU  33  -1.744  -5.607   8.782
  249    H    CYS  34           HN       CYS  34  -3.620  -2.954   4.009
  250    HA   CYS  34           HA       CYS  34  -1.631  -2.255   2.147
  251    HB2  CYS  34          2HB       CYS  34  -4.591  -1.713   1.880
  252    HB3  CYS  34          3HB       CYS  34  -3.425  -1.929   0.579
  253    H    LEU  35           HN       LEU  35  -4.304  -0.233   3.378
  254    HA   LEU  35           HA       LEU  35  -3.550   2.176   2.298
  255    HB2  LEU  35          2HB       LEU  35  -5.593   1.504   3.759
  256    HB3  LEU  35          3HB       LEU  35  -4.591   2.056   5.099
  257    HG   LEU  35           HG       LEU  35  -4.506   4.287   4.163
  258   HD11  LEU  35          1HD1      LEU  35  -5.673   2.927   1.814
  259   HD12  LEU  35          2HD1      LEU  35  -4.546   4.281   1.904
  260   HD13  LEU  35          3HD1      LEU  35  -6.268   4.549   2.169
  261   HD21  LEU  35          1HD2      LEU  35  -7.395   3.615   3.940
  262   HD22  LEU  35          2HD2      LEU  35  -6.602   4.923   4.818
  263   HD23  LEU  35          3HD2      LEU  35  -6.570   3.281   5.463
  264    H    LYS  36           HN       LYS  36  -1.947   0.380   4.718
  265    HA   LYS  36           HA       LYS  36  -0.469   2.680   5.730
  266    HB2  LYS  36          2HB       LYS  36  -1.121   1.075   7.391
  267    HB3  LYS  36          3HB       LYS  36  -0.439  -0.250   6.458
  268    HG2  LYS  36          2HG       LYS  36   1.555   1.755   7.023
  269    HG3  LYS  36          3HG       LYS  36   0.790   1.174   8.503
  270    HD2  LYS  36          2HD       LYS  36   1.398  -1.064   8.054
  271    HD3  LYS  36          3HD       LYS  36   1.820  -0.693   6.381
  272    HE2  LYS  36          2HE       LYS  36   3.806  -1.005   7.797
  273    HE3  LYS  36          3HE       LYS  36   3.717   0.621   7.120
  274    HZ1  LYS  36          1HZ       LYS  36   2.418   0.861   9.484
  275    HZ2  LYS  36          2HZ       LYS  36   4.030   1.293   9.207
  276    HZ3  LYS  36          3HZ       LYS  36   3.660  -0.222   9.865
  277    H    GLN  37           HN       GLN  37   0.478  -0.543   4.520
  278    HA   GLN  37           HA       GLN  37   3.124  -0.059   4.022
  279    HB2  GLN  37          2HB       GLN  37   1.297  -2.085   3.402
  280    HB3  GLN  37          3HB       GLN  37   1.994  -1.616   1.858
  281    HG2  GLN  37          2HG       GLN  37   3.933  -2.597   2.318
  282    HG3  GLN  37          3HG       GLN  37   3.999  -1.898   3.935
  283   HE21  GLN  37          1HE2      GLN  37   3.130  -3.033   5.666
  284   HE22  GLN  37          2HE2      GLN  37   2.754  -4.717   5.568
  285    H    TYR  38           HN       TYR  38   0.429   1.281   2.394
  286    HA   TYR  38           HA       TYR  38   1.930   2.001   0.015
  287    HB2  TYR  38          2HB       TYR  38  -0.189   1.736  -0.736
  288    HB3  TYR  38          3HB       TYR  38  -0.894   2.041   0.848
  289    HD1  TYR  38          1HD       TYR  38  -2.253   3.890   1.010
  290    HD2  TYR  38          2HD       TYR  38   0.960   3.958  -1.779
  291    HE1  TYR  38          1HE       TYR  38  -2.948   6.132   0.272
  292    HE2  TYR  38          2HE       TYR  38   0.274   6.200  -2.523
  293    HH   TYR  38           HH       TYR  38  -1.655   7.624  -2.538
  294    H    VAL  39           HN       VAL  39   0.038   3.870   2.397
  295    HA   VAL  39           HA       VAL  39   1.214   6.348   1.731
  296    HB   VAL  39           HB       VAL  39   0.127   7.252   3.665
  297   HG11  VAL  39          1HG1      VAL  39  -2.169   6.464   3.343
  298   HG12  VAL  39          2HG1      VAL  39  -1.330   6.657   1.802
  299   HG13  VAL  39          3HG1      VAL  39  -1.562   5.048   2.486
  300   HG21  VAL  39          1HG2      VAL  39  -0.998   5.716   5.307
  301   HG22  VAL  39          2HG2      VAL  39  -0.081   4.392   4.588
  302   HG23  VAL  39          3HG2      VAL  39   0.765   5.724   5.375
  303    H    GLU  40           HN       GLU  40   1.790   4.138   4.463
  304    HA   GLU  40           HA       GLU  40   3.567   5.382   6.006
  305    HB2  GLU  40          2HB       GLU  40   2.889   2.874   5.939
  306    HB3  GLU  40          3HB       GLU  40   4.344   2.672   4.975
  307    HG2  GLU  40          2HG       GLU  40   4.938   4.216   7.310
  308    HG3  GLU  40          3HG       GLU  40   4.121   2.723   7.765
  309    H    LEU  41           HN       LEU  41   4.515   3.803   2.955
  310    HA   LEU  41           HA       LEU  41   7.202   4.594   3.003
  311    HB2  LEU  41          2HB       LEU  41   5.310   3.709   0.877
  312    HB3  LEU  41          3HB       LEU  41   6.877   4.364   0.407
  313    HG   LEU  41           HG       LEU  41   6.792   1.881   0.511
  314   HD11  LEU  41          1HD1      LEU  41   8.846   3.403   0.954
  315   HD12  LEU  41          2HD1      LEU  41   8.948   1.680   1.315
  316   HD13  LEU  41          3HD1      LEU  41   8.683   2.839   2.617
  317   HD21  LEU  41          1HD2      LEU  41   5.261   1.761   2.463
  318   HD22  LEU  41          2HD2      LEU  41   6.592   2.293   3.490
  319   HD23  LEU  41          3HD2      LEU  41   6.702   0.757   2.629
  320    H    LEU  42           HN       LEU  42   4.597   5.957   0.977
  321    HA   LEU  42           HA       LEU  42   6.010   8.188   0.095
  322    HB2  LEU  42          2HB       LEU  42   3.054   7.788   0.505
  323    HB3  LEU  42          3HB       LEU  42   3.749   9.185  -0.316
  324    HG   LEU  42           HG       LEU  42   4.418   6.464  -1.328
  325   HD11  LEU  42          1HD1      LEU  42   2.146   7.422  -2.727
  326   HD12  LEU  42          2HD1      LEU  42   1.742   7.352  -1.013
  327   HD13  LEU  42          3HD1      LEU  42   2.336   5.911  -1.838
  328   HD21  LEU  42          1HD2      LEU  42   5.482   7.897  -2.693
  329   HD22  LEU  42          2HD2      LEU  42   4.439   9.251  -2.257
  330   HD23  LEU  42          3HD2      LEU  42   3.896   8.068  -3.447
  331    H    ILE  43           HN       ILE  43   3.416   8.238   2.545
  332    HA   ILE  43           HA       ILE  43   3.598  10.739   3.506
  333    HB   ILE  43           HB       ILE  43   2.633   8.289   4.541
  334   HG12  ILE  43          2HG1      ILE  43   1.418  10.005   6.101
  335   HG13  ILE  43          3HG1      ILE  43   2.227  11.208   5.102
  336   HG21  ILE  43          1HG2      ILE  43   4.213   9.871   6.564
  337   HG22  ILE  43          2HG2      ILE  43   3.047   8.608   6.956
  338   HG23  ILE  43          3HG2      ILE  43   4.510   8.209   6.056
  339   HD11  ILE  43          1HD1      ILE  43   0.843   9.117   3.596
  340   HD12  ILE  43          2HD1      ILE  43  -0.204  10.138   4.581
  341   HD13  ILE  43          3HD1      ILE  43   0.855  10.866   3.374
  342    H    LYS  44           HN       LYS  44   6.014   8.275   3.851
  343    HA   LYS  44           HA       LYS  44   7.493   9.643   5.910
  344    HB2  LYS  44          2HB       LYS  44   7.595   7.078   4.577
  345    HB3  LYS  44          3HB       LYS  44   9.195   7.804   4.650
  346    HG2  LYS  44          2HG       LYS  44   8.649   6.318   6.566
  347    HG3  LYS  44          3HG       LYS  44   9.099   7.962   7.026
  348    HD2  LYS  44          2HD       LYS  44   7.235   7.916   8.272
  349    HD3  LYS  44          3HD       LYS  44   6.385   8.166   6.746
  350    HE2  LYS  44          2HE       LYS  44   5.352   6.223   7.035
  351    HE3  LYS  44          3HE       LYS  44   6.910   5.403   6.947
  352    HZ1  LYS  44          1HZ       LYS  44   5.465   6.329   9.356
  353    HZ2  LYS  44          2HZ       LYS  44   7.114   5.956   9.395
  354    HZ3  LYS  44          3HZ       LYS  44   5.987   4.764   8.981
  355    H    GLU  45           HN       GLU  45   7.795   9.173   2.410
  356    HA   GLU  45           HA       GLU  45  10.204  10.725   2.229
  357    HB2  GLU  45          2HB       GLU  45   9.009   8.873   0.611
  358    HB3  GLU  45          3HB       GLU  45   8.619  10.371  -0.224
  359    HG2  GLU  45          2HG       GLU  45  10.611  10.212  -1.179
  360    HG3  GLU  45          3HG       GLU  45  11.293  10.655   0.385
  361    H    GLY  46           HN       GLY  46   6.975  11.246   0.789
  362    HA2  GLY  46          1HA       GLY  46   5.751  13.174   0.513
  363    HA3  GLY  46          2HA       GLY  46   6.779  13.924   1.725
  364    H    LEU  47           HN       LEU  47   7.145  12.710  -1.611
  365    HA   LEU  47           HA       LEU  47   8.920  14.942  -2.203
  366    HB2  LEU  47          2HB       LEU  47   9.159  13.769  -4.411
  367    HB3  LEU  47          3HB       LEU  47   9.713  12.870  -3.000
  368    HG   LEU  47           HG       LEU  47   6.965  12.389  -4.069
  369   HD11  LEU  47          1HD1      LEU  47   7.648  11.017  -5.776
  370   HD12  LEU  47          2HD1      LEU  47   9.256  10.782  -5.093
  371   HD13  LEU  47          3HD1      LEU  47   8.848  12.305  -5.883
  372   HD21  LEU  47          1HD2      LEU  47   8.259  10.034  -3.315
  373   HD22  LEU  47          2HD2      LEU  47   7.027  10.914  -2.411
  374   HD23  LEU  47          3HD2      LEU  47   8.736  11.236  -2.115
  375    H    GLU  48           HN       GLU  48   5.714  13.775  -2.965
  376    HA   GLU  48           HA       GLU  48   4.520  16.127  -3.545
  377    HB2  GLU  48          2HB       GLU  48   4.542  16.011  -6.147
  378    HB3  GLU  48          3HB       GLU  48   5.877  16.784  -5.304
  379    HG2  GLU  48          2HG       GLU  48   6.560  14.074  -5.528
  380    HG3  GLU  48          3HG       GLU  48   5.907  14.553  -7.093
  381    H    THR  49           HN       THR  49   4.853  12.769  -4.185
  382    HA   THR  49           HA       THR  49   2.776  11.946  -5.656
  383    HB   THR  49           HB       THR  49   3.377  10.812  -2.917
  384    HG1  THR  49          1HG       THR  49   5.201  10.253  -3.816
  385   HG21  THR  49          1HG2      THR  49   2.672   8.837  -4.830
  386   HG22  THR  49          2HG2      THR  49   1.441  10.099  -4.880
  387   HG23  THR  49          3HG2      THR  49   1.814   9.290  -3.359
  388    H    ALA  50           HN       ALA  50   2.524  13.560  -2.578
  389    HA   ALA  50           HA       ALA  50   0.758  14.420  -1.428
  390    HB1  ALA  50          1HB       ALA  50  -1.414  14.607  -2.938
  391    HB2  ALA  50          2HB       ALA  50  -0.034  15.686  -3.146
  392    HB3  ALA  50          3HB       ALA  50  -0.241  14.302  -4.219
  393    H    ILE  51           HN       ILE  51   1.053  11.345  -2.137
  394    HA   ILE  51           HA       ILE  51  -0.124   9.397  -1.769
  395    HB   ILE  51           HB       ILE  51  -0.756  11.002   0.709
  396   HG12  ILE  51          2HG1      ILE  51   1.159   9.854   1.677
  397   HG13  ILE  51          3HG1      ILE  51   1.389   8.929   0.197
  398   HG21  ILE  51          1HG2      ILE  51  -0.816   8.007   0.420
  399   HG22  ILE  51          2HG2      ILE  51  -1.319   8.971   1.807
  400   HG23  ILE  51          3HG2      ILE  51  -2.254   9.022   0.312
  401   HD11  ILE  51          1HD1      ILE  51   2.828  11.063   0.743
  402   HD12  ILE  51          2HD1      ILE  51   2.339  10.676  -0.907
  403   HD13  ILE  51          3HD1      ILE  51   1.449  11.888   0.015
  404    H    SER  52           HN       SER  52  -1.688   9.498  -3.422
  405    HA   SER  52           HA       SER  52  -4.311  10.582  -2.687
  406    HB2  SER  52          2HB       SER  52  -3.615  11.341  -4.836
  407    HB3  SER  52          3HB       SER  52  -3.126   9.720  -5.328
  408    HG   SER  52           HG       SER  52  -5.688  10.831  -5.132
  409    H    CYS  53           HN       CYS  53  -6.229   9.315  -3.046
  410    HA   CYS  53           HA       CYS  53  -6.473   6.986  -1.778
  411    HB2  CYS  53          2HB       CYS  53  -8.386   8.167  -2.745
  412    HB3  CYS  53          3HB       CYS  53  -7.900   7.657  -4.360
  413    HA   PRO  54           HA       PRO  54  -4.061   3.949  -3.889
  414    HB2  PRO  54          2HB       PRO  54  -5.106   1.749  -2.689
  415    HB3  PRO  54          3HB       PRO  54  -3.985   2.845  -1.875
  416    HG2  PRO  54          2HG       PRO  54  -6.969   2.707  -1.689
  417    HG3  PRO  54          3HG       PRO  54  -5.777   2.925  -0.395
  418    HD2  PRO  54          2HD       PRO  54  -7.182   4.988  -1.444
  419    HD3  PRO  54          3HD       PRO  54  -5.524   5.173  -0.835
  420    H    ASP  55           HN       ASP  55  -7.232   4.604  -4.466
  421    HA   ASP  55           HA       ASP  55  -7.533   2.355  -6.345
  422    HB2  ASP  55          2HB       ASP  55  -9.380   3.606  -4.491
  423    HB3  ASP  55          3HB       ASP  55 -10.010   3.636  -6.135
  424    H    ALA  56           HN       ALA  56  -6.105   3.620  -7.772
  425    HA   ALA  56           HA       ALA  56  -6.380   6.090  -8.795
  426    HB1  ALA  56          1HB       ALA  56  -4.985   3.924  -9.561
  427    HB2  ALA  56          2HB       ALA  56  -6.142   4.027 -10.889
  428    HB3  ALA  56          3HB       ALA  56  -5.099   5.400 -10.519
  429    H    ALA  57           HN       ALA  57  -8.655   3.498  -9.158
  430    HA   ALA  57           HA       ALA  57 -10.182   4.982 -11.167
  431    HB1  ALA  57          1HB       ALA  57  -9.929   2.677 -11.698
  432    HB2  ALA  57          2HB       ALA  57 -10.453   2.184 -10.087
  433    HB3  ALA  57          3HB       ALA  57 -11.605   2.915 -11.203
  434    H    CYS  58           HN       CYS  58 -10.069   6.207  -8.675
  435    HA   CYS  58           HA       CYS  58 -12.593   5.586  -7.342
  436    HB2  CYS  58          2HB       CYS  58 -10.491   5.998  -6.025
  437    HB3  CYS  58          3HB       CYS  58 -10.536   7.668  -6.584
  438    HA   PRO  59           HA       PRO  59 -14.735   8.767  -9.538
  439    HB2  PRO  59          2HB       PRO  59 -16.911   8.915  -7.920
  440    HB3  PRO  59          3HB       PRO  59 -16.647   7.587  -9.055
  441    HG2  PRO  59          2HG       PRO  59 -16.125   7.691  -6.109
  442    HG3  PRO  59          3HG       PRO  59 -16.849   6.390  -7.072
  443    HD2  PRO  59          2HD       PRO  59 -14.264   6.342  -6.267
  444    HD3  PRO  59          3HD       PRO  59 -14.801   5.616  -7.795
  445    H    LYS  60           HN       LYS  60 -13.482   9.035  -6.386
  446    HA   LYS  60           HA       LYS  60 -13.977  11.940  -6.407
  447    HB2  LYS  60          2HB       LYS  60 -13.720  10.183  -3.960
  448    HB3  LYS  60          3HB       LYS  60 -14.016  11.917  -3.969
  449    HG2  LYS  60          2HG       LYS  60 -15.908  10.035  -5.322
  450    HG3  LYS  60          3HG       LYS  60 -15.994  10.321  -3.582
  451    HD2  LYS  60          2HD       LYS  60 -16.225  12.733  -4.009
  452    HD3  LYS  60          3HD       LYS  60 -16.184  12.418  -5.746
  453    HE2  LYS  60          2HE       LYS  60 -18.284  11.508  -5.766
  454    HE3  LYS  60          3HE       LYS  60 -18.177  10.952  -4.097
  455    HZ1  LYS  60          1HZ       LYS  60 -19.686  12.955  -4.716
  456    HZ2  LYS  60          2HZ       LYS  60 -18.244  13.837  -4.642
  457    HZ3  LYS  60          3HZ       LYS  60 -18.787  12.988  -3.282
  458    H    GLN  61           HN       GLN  61 -11.726   9.363  -6.171
  459    HA   GLN  61           HA       GLN  61  -9.485   9.287  -5.613
  460    HB2  GLN  61          2HB       GLN  61  -9.861  11.468  -7.635
  461    HB3  GLN  61          3HB       GLN  61  -8.252  11.105  -7.026
  462    HG2  GLN  61          2HG       GLN  61  -8.720   8.695  -7.694
  463    HG3  GLN  61          3HG       GLN  61 -10.098   9.335  -8.590
  464   HE21  GLN  61          1HE2      GLN  61  -9.245  11.553  -9.733
  465   HE22  GLN  61          2HE2      GLN  61  -7.903  11.261 -10.781
  466    H    GLY  62           HN       GLY  62 -10.161  10.037  -3.356
  467    HA2  GLY  62          1HA       GLY  62  -9.511  12.760  -2.664
  468    HA3  GLY  62          2HA       GLY  62  -9.943  11.473  -1.549
  469    H    HIS  63           HN       HIS  63  -7.821  13.452  -1.315
  470    HA   HIS  63           HA       HIS  63  -5.411  11.795  -1.541
  471    HB2  HIS  63          2HB       HIS  63  -5.756  14.752  -1.009
  472    HB3  HIS  63          3HB       HIS  63  -4.202  13.926  -1.024
  473    HD1  HIS  63          1HD       HIS  63  -7.051  14.826  -3.335
  474    HD2  HIS  63          2HD       HIS  63  -3.093  13.574  -3.508
  475    HE1  HIS  63          1HE       HIS  63  -6.395  15.003  -5.757
  476    H    LEU  64           HN       LEU  64  -3.859  11.883   0.284
  477    HA   LEU  64           HA       LEU  64  -5.306  11.775   2.843
  478    HB2  LEU  64          2HB       LEU  64  -2.866  10.325   1.852
  479    HB3  LEU  64          3HB       LEU  64  -3.330  10.352   3.553
  480    HG   LEU  64           HG       LEU  64  -3.980   8.307   2.168
  481   HD11  LEU  64          1HD1      LEU  64  -6.511   8.846   3.201
  482   HD12  LEU  64          2HD1      LEU  64  -5.394   9.772   4.204
  483   HD13  LEU  64          3HD1      LEU  64  -5.175   8.032   4.016
  484   HD21  LEU  64          1HD2      LEU  64  -4.797   9.592   0.219
  485   HD22  LEU  64          2HD2      LEU  64  -6.129  10.192   1.207
  486   HD23  LEU  64          3HD2      LEU  64  -5.997   8.469   0.857
  487    H    GLN  65           HN       GLN  65  -4.000  12.316   4.786
  488    HA   GLN  65           HA       GLN  65  -2.533  14.785   4.298
  489    HB2  GLN  65          2HB       GLN  65  -2.823  14.007   7.086
  490    HB3  GLN  65          3HB       GLN  65  -3.345  15.476   6.271
  491    HG2  GLN  65          2HG       GLN  65  -5.339  14.600   6.987
  492    HG3  GLN  65          3HG       GLN  65  -5.245  13.974   5.342
  493   HE21  GLN  65          1HE2      GLN  65  -3.064  12.119   6.310
  494   HE22  GLN  65          2HE2      GLN  65  -3.918  10.824   7.068
  495    H    GLU  66           HN       GLU  66  -0.551  15.237   5.525
  496    HA   GLU  66           HA       GLU  66   1.223  12.928   5.433
  497    HB2  GLU  66          2HB       GLU  66   1.570  15.879   5.343
  498    HB3  GLU  66          3HB       GLU  66   2.892  14.936   6.018
  499    HG2  GLU  66          2HG       GLU  66   2.744  13.534   3.890
  500    HG3  GLU  66          3HG       GLU  66   1.757  14.846   3.248
  501    H    ASN  67           HN       ASN  67  -0.102  15.224   7.721
  502    HA   ASN  67           HA       ASN  67   1.573  14.316   9.892
  503    HB2  ASN  67          2HB       ASN  67   0.502  16.679   9.525
  504    HB3  ASN  67          3HB       ASN  67  -0.908  15.951  10.289
  505   HD21  ASN  67          1HD2      ASN  67  -0.305  14.668  12.337
  506   HD22  ASN  67          2HD2      ASN  67   0.745  15.489  13.437
  507    H    GLU  68           HN       GLU  68  -1.905  14.169   9.129
  508    HA   GLU  68           HA       GLU  68  -2.704  12.613  11.292
  509    HB2  GLU  68          2HB       GLU  68  -3.815  13.408   8.725
  510    HB3  GLU  68          3HB       GLU  68  -4.328  11.791   9.187
  511    HG2  GLU  68          2HG       GLU  68  -4.492  13.956  11.214
  512    HG3  GLU  68          3HG       GLU  68  -5.678  13.927   9.909
  513    H    ILE  69           HN       ILE  69  -2.184  11.423   7.967
  514    HA   ILE  69           HA       ILE  69  -2.349   8.740   8.382
  515    HB   ILE  69           HB       ILE  69  -0.549  10.294   6.547
  516   HG12  ILE  69          2HG1      ILE  69  -3.236   9.156   6.467
  517   HG13  ILE  69          3HG1      ILE  69  -2.511  10.395   5.449
  518   HG21  ILE  69          1HG2      ILE  69   0.625   8.226   7.074
  519   HG22  ILE  69          2HG2      ILE  69  -0.816   7.294   6.670
  520   HG23  ILE  69          3HG2      ILE  69   0.026   8.203   5.416
  521   HD11  ILE  69          1HD1      ILE  69  -2.147   7.427   5.113
  522   HD12  ILE  69          2HD1      ILE  69  -3.226   8.450   4.163
  523   HD13  ILE  69          3HD1      ILE  69  -1.480   8.686   4.072
  524    H    GLU  70           HN       GLU  70   0.781  10.461   8.375
  525    HA   GLU  70           HA       GLU  70   2.350   8.412   9.343
  526    HB2  GLU  70          2HB       GLU  70   4.003  10.013   9.785
  527    HB3  GLU  70          3HB       GLU  70   3.044  10.735   8.501
  528    HG2  GLU  70          2HG       GLU  70   1.999  12.234   9.978
  529    HG3  GLU  70          3HG       GLU  70   2.553  11.345  11.396
  530    H    CYS  71           HN       CYS  71  -0.079  10.145  10.979
  531    HA   CYS  71           HA       CYS  71   0.938   9.844  13.636
  532    HB2  CYS  71          2HB       CYS  71  -0.903  11.470  12.666
  533    HB3  CYS  71          3HB       CYS  71  -1.983  10.147  13.084
  534    HG   CYS  71           HG       CYS  71  -1.399  12.478  14.997
  535    H    MET  72           HN       MET  72  -1.073   7.946  11.495
  536    HA   MET  72           HA       MET  72  -1.790   6.069  13.589
  537    HB2  MET  72          2HB       MET  72  -3.351   5.246  12.147
  538    HB3  MET  72          3HB       MET  72  -3.137   6.829  11.412
  539    HG2  MET  72          2HG       MET  72  -1.519   5.841   9.836
  540    HG3  MET  72          3HG       MET  72  -1.840   4.258  10.541
  541    HE1  MET  72          1HE       MET  72  -3.969   6.693   7.547
  542    HE2  MET  72          2HE       MET  72  -2.303   6.640   8.122
  543    HE3  MET  72          3HE       MET  72  -2.886   5.413   6.996
  544    H    VAL  73           HN       VAL  73   0.977   6.603  12.046
  545    HA   VAL  73           HA       VAL  73   1.747   3.775  12.160
  546    HB   VAL  73           HB       VAL  73   3.278   4.263  10.157
  547   HG11  VAL  73          1HG1      VAL  73   1.763   3.274   8.738
  548   HG12  VAL  73          2HG1      VAL  73   1.035   2.919  10.305
  549   HG13  VAL  73          3HG1      VAL  73   0.414   4.246   9.324
  550   HG21  VAL  73          1HG2      VAL  73   1.917   5.933   8.605
  551   HG22  VAL  73          2HG2      VAL  73   1.514   6.653  10.164
  552   HG23  VAL  73          3HG2      VAL  73   3.201   6.491   9.677
  553    H    ALA  74           HN       ALA  74   3.152   6.993  11.509
  554    HA   ALA  74           HA       ALA  74   5.460   6.279  13.158
  555    HB1  ALA  74          1HB       ALA  74   4.959   8.207  10.978
  556    HB2  ALA  74          2HB       ALA  74   6.096   8.712  12.229
  557    HB3  ALA  74          3HB       ALA  74   6.383   7.225  11.323
  558    H    ALA  75           HN       ALA  75   3.268   6.555  14.712
  559    HA   ALA  75           HA       ALA  75   2.365   8.889  15.688
  560    HB1  ALA  75          1HB       ALA  75   1.872   6.623  16.606
  561    HB2  ALA  75          2HB       ALA  75   3.393   6.709  17.496
  562    HB3  ALA  75          3HB       ALA  75   2.106   7.867  17.835
  Start of MODEL    4
    1    H1   ALA   1           HN       ALA   1 -20.783 -18.004   5.661
    2    HA   ALA   1           HA       ALA   1 -20.546 -15.532   6.328
    3    HB1  ALA   1          1HB       ALA   1 -19.482 -16.615   4.301
    4    HB2  ALA   1          2HB       ALA   1 -20.850 -16.000   3.374
    5    HB3  ALA   1          3HB       ALA   1 -19.770 -14.878   4.200
    6    H    LEU   2           HN       LEU   2 -22.728 -15.126   7.279
    7    HA   LEU   2           HA       LEU   2 -24.959 -14.464   5.705
    8    HB2  LEU   2          2HB       LEU   2 -24.704 -14.850   8.271
    9    HB3  LEU   2          3HB       LEU   2 -24.412 -13.112   8.314
   10    HG   LEU   2           HG       LEU   2 -26.739 -13.353   6.834
   11   HD11  LEU   2          1HD1      LEU   2 -28.055 -14.682   8.712
   12   HD12  LEU   2          2HD1      LEU   2 -26.522 -15.547   8.817
   13   HD13  LEU   2          3HD1      LEU   2 -27.394 -15.481   7.286
   14   HD21  LEU   2          1HD2      LEU   2 -26.126 -11.680   8.573
   15   HD22  LEU   2          2HD2      LEU   2 -26.524 -12.880   9.803
   16   HD23  LEU   2          3HD2      LEU   2 -27.776 -12.287   8.712
   17    H    ASP   3           HN       ASP   3 -22.247 -12.538   6.872
   18    HA   ASP   3           HA       ASP   3 -23.307 -10.054   5.908
   19    HB2  ASP   3          2HB       ASP   3 -20.881 -10.961   7.304
   20    HB3  ASP   3          3HB       ASP   3 -20.625  -9.605   6.209
   21    HA   PRO   4           HA       PRO   4 -21.975 -10.083   1.730
   22    HB2  PRO   4          2HB       PRO   4 -21.185  -7.511   1.368
   23    HB3  PRO   4          3HB       PRO   4 -22.880  -7.980   1.534
   24    HG2  PRO   4          2HG       PRO   4 -21.019  -6.845   3.586
   25    HG3  PRO   4          3HG       PRO   4 -22.714  -6.437   3.266
   26    HD2  PRO   4          2HD       PRO   4 -21.966  -8.064   5.296
   27    HD3  PRO   4          3HD       PRO   4 -23.504  -8.261   4.434
   28    H    LEU   5           HN       LEU   5 -19.710  -8.688   4.056
   29    HA   LEU   5           HA       LEU   5 -17.437  -8.632   4.152
   30    HB2  LEU   5          2HB       LEU   5 -17.987 -11.207   2.727
   31    HB3  LEU   5          3HB       LEU   5 -16.331 -10.681   3.025
   32    HG   LEU   5           HG       LEU   5 -16.808 -12.160   4.770
   33   HD11  LEU   5          1HD1      LEU   5 -16.592 -10.860   6.707
   34   HD12  LEU   5          2HD1      LEU   5 -17.534  -9.533   6.028
   35   HD13  LEU   5          3HD1      LEU   5 -15.912  -9.866   5.418
   36   HD21  LEU   5          1HD2      LEU   5 -18.888 -11.851   6.188
   37   HD22  LEU   5          2HD2      LEU   5 -19.129 -12.503   4.568
   38   HD23  LEU   5          3HD2      LEU   5 -19.490 -10.809   4.900
   39    H    VAL   6           HN       VAL   6 -15.367  -9.053   2.584
   40    HA   VAL   6           HA       VAL   6 -14.160  -8.261   0.823
   41    HB   VAL   6           HB       VAL   6 -16.779  -8.353  -0.682
   42   HG11  VAL   6          1HG1      VAL   6 -14.784  -8.842  -2.479
   43   HG12  VAL   6          2HG1      VAL   6 -15.565  -7.278  -2.232
   44   HG13  VAL   6          3HG1      VAL   6 -14.038  -7.642  -1.425
   45   HG21  VAL   6          1HG2      VAL   6 -15.642 -10.483   0.475
   46   HG22  VAL   6          2HG2      VAL   6 -16.486 -10.567  -1.071
   47   HG23  VAL   6          3HG2      VAL   6 -14.727 -10.453  -1.032
   48    H    SER   7           HN       SER   7 -13.396  -6.263   0.801
   49    HA   SER   7           HA       SER   7 -15.112  -4.031   0.106
   50    HB2  SER   7          2HB       SER   7 -13.581  -3.230   2.415
   51    HB3  SER   7          3HB       SER   7 -15.321  -3.127   2.146
   52    HG   SER   7           HG       SER   7 -15.592  -4.843   3.331
   53    H    CYS   8           HN       CYS   8 -12.009  -4.113   1.818
   54    HA   CYS   8           HA       CYS   8 -10.645  -2.202   0.534
   55    HB2  CYS   8          2HB       CYS   8  -9.784  -3.749   2.349
   56    HB3  CYS   8          3HB       CYS   8  -9.370  -4.886   1.070
   57    H    LYS   9           HN       LYS   9  -9.255  -2.023  -1.271
   58    HA   LYS   9           HA       LYS   9  -9.757  -3.996  -3.401
   59    HB2  LYS   9          2HB       LYS   9  -9.196  -1.169  -4.132
   60    HB3  LYS   9          3HB       LYS   9 -10.194  -2.364  -4.951
   61    HG2  LYS   9          2HG       LYS   9 -11.994  -2.022  -3.454
   62    HG3  LYS   9          3HG       LYS   9 -10.986  -1.083  -2.349
   63    HD2  LYS   9          2HD       LYS   9 -10.969   0.773  -3.745
   64    HD3  LYS   9          3HD       LYS   9 -11.385  -0.175  -5.175
   65    HE2  LYS   9          2HE       LYS   9 -13.438   0.685  -4.830
   66    HE3  LYS   9          3HE       LYS   9 -13.566  -0.615  -3.647
   67    HZ1  LYS   9          1HZ       LYS   9 -12.737   2.177  -3.066
   68    HZ2  LYS   9          2HZ       LYS   9 -12.849   0.929  -1.930
   69    HZ3  LYS   9          3HZ       LYS   9 -14.243   1.495  -2.702
   70    H    LEU  10           HN       LEU  10  -7.531  -3.762  -1.478
   71    HA   LEU  10           HA       LEU  10  -5.342  -3.390  -3.416
   72    HB2  LEU  10          2HB       LEU  10  -5.452  -2.735  -0.486
   73    HB3  LEU  10          3HB       LEU  10  -3.929  -2.913  -1.354
   74    HG   LEU  10           HG       LEU  10  -5.967  -0.982  -2.368
   75   HD11  LEU  10          1HD1      LEU  10  -5.488  -0.753   0.192
   76   HD12  LEU  10          2HD1      LEU  10  -5.473   0.669  -0.851
   77   HD13  LEU  10          3HD1      LEU  10  -3.954  -0.082  -0.362
   78   HD21  LEU  10          1HD2      LEU  10  -4.243  -0.114  -3.542
   79   HD22  LEU  10          2HD2      LEU  10  -3.573  -1.730  -3.316
   80   HD23  LEU  10          3HD2      LEU  10  -3.072  -0.410  -2.257
   81    H    CYS  11           HN       CYS  11  -6.913  -5.445  -1.186
   82    HA   CYS  11           HA       CYS  11  -4.882  -7.509  -1.666
   83    HB2  CYS  11          2HB       CYS  11  -5.078  -8.293   0.654
   84    HB3  CYS  11          3HB       CYS  11  -4.473  -6.642   0.586
   85    H    LEU  12           HN       LEU  12  -7.892  -6.625  -2.241
   86    HA   LEU  12           HA       LEU  12  -9.958  -7.657  -2.374
   87    HB2  LEU  12          2HB       LEU  12  -8.058  -9.647  -3.605
   88    HB3  LEU  12          3HB       LEU  12  -9.808  -9.681  -3.814
   89    HG   LEU  12           HG       LEU  12  -8.148  -7.313  -4.639
   90   HD11  LEU  12          1HD1      LEU  12  -9.015  -9.087  -6.777
   91   HD12  LEU  12          2HD1      LEU  12  -7.817  -9.819  -5.712
   92   HD13  LEU  12          3HD1      LEU  12  -7.462  -8.293  -6.520
   93   HD21  LEU  12          1HD2      LEU  12 -10.222  -6.510  -4.886
   94   HD22  LEU  12          2HD2      LEU  12 -10.958  -8.110  -4.781
   95   HD23  LEU  12          3HD2      LEU  12 -10.295  -7.543  -6.314
   96    H    GLY  13           HN       GLY  13  -9.262  -7.973   0.196
   97    HA2  GLY  13          1HA       GLY  13  -9.637 -10.837   0.785
   98    HA3  GLY  13          2HA       GLY  13  -8.966  -9.657   1.902
   99    H    GLU  14           HN       GLU  14 -10.602 -10.694   3.334
  100    HA   GLU  14           HA       GLU  14 -13.198  -9.337   3.024
  101    HB2  GLU  14          2HB       GLU  14 -13.071 -11.880   4.561
  102    HB3  GLU  14          3HB       GLU  14 -14.385 -11.211   3.603
  103    HG2  GLU  14          2HG       GLU  14 -13.408 -11.937   1.580
  104    HG3  GLU  14          3HG       GLU  14 -11.879 -12.315   2.371
  105    H    TYR  15           HN       TYR  15 -13.328  -7.790   4.502
  106    HA   TYR  15           HA       TYR  15 -12.785  -8.425   7.287
  107    HB2  TYR  15          2HB       TYR  15 -11.615  -5.861   6.307
  108    HB3  TYR  15          3HB       TYR  15 -11.138  -6.861   7.675
  109    HD1  TYR  15          1HD       TYR  15 -10.733  -6.266   4.100
  110    HD2  TYR  15          2HD       TYR  15  -9.694  -8.814   7.345
  111    HE1  TYR  15          1HE       TYR  15  -8.917  -7.234   2.751
  112    HE2  TYR  15          2HE       TYR  15  -7.875  -9.786   6.006
  113    HH   TYR  15           HH       TYR  15  -6.428  -8.935   3.971
  114    HA   PRO  16           HA       PRO  16 -16.334  -5.921   7.947
  115    HB2  PRO  16          2HB       PRO  16 -15.897  -5.123  10.505
  116    HB3  PRO  16          3HB       PRO  16 -16.370  -6.771  10.080
  117    HG2  PRO  16          2HG       PRO  16 -13.652  -5.682  10.702
  118    HG3  PRO  16          3HG       PRO  16 -14.397  -7.201  11.235
  119    HD2  PRO  16          2HD       PRO  16 -12.612  -7.089   9.202
  120    HD3  PRO  16          3HD       PRO  16 -13.935  -8.272   9.246
  121    H    VAL  17           HN       VAL  17 -16.763  -3.687   9.287
  122    HA   VAL  17           HA       VAL  17 -15.195  -1.710   7.828
  123    HB   VAL  17           HB       VAL  17 -17.880  -1.758   9.073
  124   HG11  VAL  17          1HG1      VAL  17 -17.974   0.720   9.140
  125   HG12  VAL  17          2HG1      VAL  17 -16.908   0.025  10.363
  126   HG13  VAL  17          3HG1      VAL  17 -16.227   0.757   8.909
  127   HG21  VAL  17          1HG2      VAL  17 -16.906  -0.189   6.703
  128   HG22  VAL  17          2HG2      VAL  17 -17.304  -1.905   6.598
  129   HG23  VAL  17          3HG2      VAL  17 -18.544  -0.738   7.058
  130    H    GLU  18           HN       GLU  18 -15.482  -2.998  10.985
  131    HA   GLU  18           HA       GLU  18 -14.375  -0.662  12.303
  132    HB2  GLU  18          2HB       GLU  18 -15.227  -3.389  13.248
  133    HB3  GLU  18          3HB       GLU  18 -14.338  -2.292  14.296
  134    HG2  GLU  18          2HG       GLU  18 -16.811  -1.343  12.931
  135    HG3  GLU  18          3HG       GLU  18 -16.935  -2.360  14.365
  136    H    GLN  19           HN       GLN  19 -13.027  -2.683  10.273
  137    HA   GLN  19           HA       GLN  19 -10.515  -2.894  11.798
  138    HB2  GLN  19          2HB       GLN  19 -11.864  -4.820   9.970
  139    HB3  GLN  19          3HB       GLN  19 -10.106  -4.758   9.943
  140    HG2  GLN  19          2HG       GLN  19  -9.932  -5.427  12.175
  141    HG3  GLN  19          3HG       GLN  19 -11.625  -5.065  12.506
  142   HE21  GLN  19          1HE2      GLN  19  -9.794  -7.024  10.173
  143   HE22  GLN  19          2HE2      GLN  19 -10.753  -8.449  10.362
  144    H    MET  20           HN       MET  20 -12.097  -1.556   9.131
  145    HA   MET  20           HA       MET  20  -9.603  -1.115   7.656
  146    HB2  MET  20          2HB       MET  20 -12.093   0.008   6.564
  147    HB3  MET  20          3HB       MET  20 -10.840  -0.937   5.771
  148    HG2  MET  20          2HG       MET  20 -11.922  -2.853   7.283
  149    HG3  MET  20          3HG       MET  20 -13.330  -1.810   7.092
  150    HE1  MET  20          1HE       MET  20 -10.674  -2.280   3.810
  151    HE2  MET  20          2HE       MET  20 -10.324  -3.083   5.341
  152    HE3  MET  20          3HE       MET  20 -10.924  -4.018   3.971
  153    H    THR  21           HN       THR  21  -9.601   1.174   6.559
  154    HA   THR  21           HA       THR  21 -10.406   3.225   8.500
  155    HB   THR  21           HB       THR  21  -7.628   2.872   7.368
  156    HG1  THR  21          1HG       THR  21  -7.832   1.771   9.271
  157   HG21  THR  21          1HG2      THR  21  -8.881   5.249   8.735
  158   HG22  THR  21          2HG2      THR  21  -8.081   5.197   7.165
  159   HG23  THR  21          3HG2      THR  21  -7.138   4.999   8.642
  160    H    THR  22           HN       THR  22 -11.100   5.101   7.617
  161    HA   THR  22           HA       THR  22 -11.621   5.163   4.805
  162    HB   THR  22           HB       THR  22 -12.131   7.131   7.028
  163    HG1  THR  22          1HG       THR  22 -13.467   5.203   6.730
  164   HG21  THR  22          1HG2      THR  22 -11.900   8.662   5.327
  165   HG22  THR  22          2HG2      THR  22 -13.592   8.208   5.117
  166   HG23  THR  22          3HG2      THR  22 -12.353   7.504   4.078
  167    H    ILE  23           HN       ILE  23 -10.862   6.648   3.271
  168    HA   ILE  23           HA       ILE  23  -8.124   7.211   3.336
  169    HB   ILE  23           HB       ILE  23 -10.322   8.311   1.594
  170   HG12  ILE  23          2HG1      ILE  23  -9.960   6.017   1.135
  171   HG13  ILE  23          3HG1      ILE  23  -9.061   6.880  -0.108
  172   HG21  ILE  23          1HG2      ILE  23  -8.910   9.984   1.116
  173   HG22  ILE  23          2HG2      ILE  23  -7.533   9.160   1.846
  174   HG23  ILE  23          3HG2      ILE  23  -8.027   8.765   0.200
  175   HD11  ILE  23          1HD1      ILE  23  -7.983   5.492   2.324
  176   HD12  ILE  23          2HD1      ILE  23  -7.686   5.115   0.627
  177   HD13  ILE  23          3HD1      ILE  23  -7.021   6.588   1.332
  178    H    ALA  24           HN       ALA  24 -10.145   9.935   2.559
  179    HA   ALA  24           HA       ALA  24 -10.243  11.470   4.776
  180    HB1  ALA  24          1HB       ALA  24  -7.449  11.300   3.779
  181    HB2  ALA  24          2HB       ALA  24  -8.030  12.852   4.383
  182    HB3  ALA  24          3HB       ALA  24  -8.056  11.433   5.430
  183    H    GLN  25           HN       GLN  25 -11.371  11.189   2.155
  184    HA   GLN  25           HA       GLN  25 -12.012  13.823   1.560
  185    HB2  GLN  25          2HB       GLN  25  -9.510  12.970   0.396
  186    HB3  GLN  25          3HB       GLN  25 -10.678  13.349  -0.864
  187    HG2  GLN  25          2HG       GLN  25  -9.636  15.143   1.304
  188    HG3  GLN  25          3HG       GLN  25  -9.490  15.333  -0.443
  189   HE21  GLN  25          1HE2      GLN  25 -11.036  16.456   2.197
  190   HE22  GLN  25          2HE2      GLN  25 -12.473  17.077   1.466
  191    H    CYS  26           HN       CYS  26 -11.439  10.646   0.104
  192    HA   CYS  26           HA       CYS  26 -13.824  10.938  -1.555
  193    HB2  CYS  26          2HB       CYS  26 -13.114   8.872  -2.627
  194    HB3  CYS  26          3HB       CYS  26 -11.765  10.001  -2.557
  195    H    GLN  27           HN       GLN  27 -12.683   9.258   1.277
  196    HA   GLN  27           HA       GLN  27 -13.841   8.164   2.915
  197    HB2  GLN  27          2HB       GLN  27 -16.358   8.429   1.287
  198    HB3  GLN  27          3HB       GLN  27 -16.197   8.267   3.031
  199    HG2  GLN  27          2HG       GLN  27 -15.000  10.645   1.716
  200    HG3  GLN  27          3HG       GLN  27 -16.750  10.574   1.903
  201   HE21  GLN  27          1HE2      GLN  27 -13.720  10.961   3.478
  202   HE22  GLN  27          2HE2      GLN  27 -14.336  11.313   5.054
  203    H    CYS  28           HN       CYS  28 -12.421   6.624   1.351
  204    HA   CYS  28           HA       CYS  28 -14.150   4.473   0.355
  205    HB2  CYS  28          2HB       CYS  28 -11.261   5.174  -0.128
  206    HB3  CYS  28          3HB       CYS  28 -11.913   3.597  -0.561
  207    H    ILE  29           HN       ILE  29 -13.083   2.217   0.665
  208    HA   ILE  29           HA       ILE  29 -12.359   1.980   3.512
  209    HB   ILE  29           HB       ILE  29 -14.541   0.903   2.413
  210   HG12  ILE  29          2HG1      ILE  29 -14.298  -0.934   4.197
  211   HG13  ILE  29          3HG1      ILE  29 -12.726  -0.219   4.541
  212   HG21  ILE  29          1HG2      ILE  29 -14.208  -1.406   1.806
  213   HG22  ILE  29          2HG2      ILE  29 -13.209  -0.384   0.772
  214   HG23  ILE  29          3HG2      ILE  29 -12.475  -1.272   2.109
  215   HD11  ILE  29          1HD1      ILE  29 -13.989   0.877   6.071
  216   HD12  ILE  29          2HD1      ILE  29 -14.178   1.982   4.708
  217   HD13  ILE  29          3HD1      ILE  29 -15.447   0.815   5.081
  218    H    PHE  30           HN       PHE  30 -10.407   1.224   3.978
  219    HA   PHE  30           HA       PHE  30  -9.121  -0.743   2.286
  220    HB2  PHE  30          2HB       PHE  30  -7.907   1.990   2.734
  221    HB3  PHE  30          3HB       PHE  30  -7.031   0.609   2.083
  222    HD1  PHE  30          1HD       PHE  30  -9.060   3.415   1.320
  223    HD2  PHE  30          2HD       PHE  30  -7.967  -0.460  -0.058
  224    HE1  PHE  30          1HE       PHE  30  -9.818   4.011  -0.944
  225    HE2  PHE  30          2HE       PHE  30  -8.722   0.129  -2.324
  226    HZ   PHE  30           HZ       PHE  30  -9.649   2.367  -2.770
  227    H    CYS  31           HN       CYS  31  -8.313  -2.217   3.609
  228    HA   CYS  31           HA       CYS  31  -8.175  -1.977   6.378
  229    HB2  CYS  31          2HB       CYS  31  -7.131  -4.107   6.392
  230    HB3  CYS  31          3HB       CYS  31  -8.199  -4.108   4.991
  231    H    THR  32           HN       THR  32  -6.766  -1.066   7.720
  232    HA   THR  32           HA       THR  32  -4.854   0.707   7.201
  233    HB   THR  32           HB       THR  32  -4.078  -1.266   9.298
  234    HG1  THR  32          1HG       THR  32  -6.401   0.384   9.442
  235   HG21  THR  32          1HG2      THR  32  -4.392   1.739   9.297
  236   HG22  THR  32          2HG2      THR  32  -2.881   0.866   9.045
  237   HG23  THR  32          3HG2      THR  32  -3.708   0.765  10.598
  238    H    LEU  33           HN       LEU  33  -4.264  -2.793   7.274
  239    HA   LEU  33           HA       LEU  33  -1.586  -2.977   6.954
  240    HB2  LEU  33          2HB       LEU  33  -3.879  -4.554   6.050
  241    HB3  LEU  33          3HB       LEU  33  -2.423  -4.794   5.087
  242    HG   LEU  33           HG       LEU  33  -2.936  -6.340   7.127
  243   HD11  LEU  33          1HD1      LEU  33  -0.971  -6.854   6.104
  244   HD12  LEU  33          2HD1      LEU  33  -0.333  -6.203   7.613
  245   HD13  LEU  33          3HD1      LEU  33  -0.374  -5.195   6.165
  246   HD21  LEU  33          1HD2      LEU  33  -1.265  -4.509   8.708
  247   HD22  LEU  33          2HD2      LEU  33  -2.579  -5.573   9.211
  248   HD23  LEU  33          3HD2      LEU  33  -2.941  -4.003   8.491
  249    H    CYS  34           HN       CYS  34  -3.713  -2.976   4.092
  250    HA   CYS  34           HA       CYS  34  -1.641  -2.350   2.287
  251    HB2  CYS  34          2HB       CYS  34  -4.573  -1.794   1.840
  252    HB3  CYS  34          3HB       CYS  34  -3.343  -2.142   0.629
  253    H    LEU  35           HN       LEU  35  -4.292  -0.315   3.531
  254    HA   LEU  35           HA       LEU  35  -3.541   2.072   2.334
  255    HB2  LEU  35          2HB       LEU  35  -5.647   1.507   3.664
  256    HB3  LEU  35          3HB       LEU  35  -4.707   1.915   5.098
  257    HG   LEU  35           HG       LEU  35  -6.279   3.686   4.025
  258   HD11  LEU  35          1HD1      LEU  35  -4.243   3.832   5.760
  259   HD12  LEU  35          2HD1      LEU  35  -5.151   5.241   5.213
  260   HD13  LEU  35          3HD1      LEU  35  -3.602   4.848   4.469
  261   HD21  LEU  35          1HD2      LEU  35  -3.824   4.193   2.367
  262   HD22  LEU  35          2HD2      LEU  35  -5.395   4.990   2.274
  263   HD23  LEU  35          3HD2      LEU  35  -5.223   3.315   1.748
  264    H    LYS  36           HN       LYS  36  -1.922   0.317   4.729
  265    HA   LYS  36           HA       LYS  36  -0.538   2.637   5.825
  266    HB2  LYS  36          2HB       LYS  36  -1.123   0.971   7.440
  267    HB3  LYS  36          3HB       LYS  36  -0.423  -0.311   6.460
  268    HG2  LYS  36          2HG       LYS  36   1.743   1.239   6.805
  269    HG3  LYS  36          3HG       LYS  36   0.868   1.596   8.296
  270    HD2  LYS  36          2HD       LYS  36   1.472  -1.190   7.308
  271    HD3  LYS  36          3HD       LYS  36   2.467  -0.314   8.474
  272    HE2  LYS  36          2HE       LYS  36  -0.468  -0.677   8.944
  273    HE3  LYS  36          3HE       LYS  36   0.664  -1.972   9.327
  274    HZ1  LYS  36          1HZ       LYS  36   0.015   0.154  10.928
  275    HZ2  LYS  36          2HZ       LYS  36   1.554   0.537  10.342
  276    HZ3  LYS  36          3HZ       LYS  36   1.301  -0.922  11.160
  277    H    GLN  37           HN       GLN  37   0.659  -0.524   4.698
  278    HA   GLN  37           HA       GLN  37   3.241   0.135   4.166
  279    HB2  GLN  37          2HB       GLN  37   1.603  -2.033   3.613
  280    HB3  GLN  37          3HB       GLN  37   2.160  -1.522   2.026
  281    HG2  GLN  37          2HG       GLN  37   4.461  -1.727   2.722
  282    HG3  GLN  37          3HG       GLN  37   3.955  -2.123   4.364
  283   HE21  GLN  37          1HE2      GLN  37   2.198  -3.984   4.275
  284   HE22  GLN  37          2HE2      GLN  37   2.704  -5.372   3.380
  285    H    TYR  38           HN       TYR  38   0.455   1.204   2.457
  286    HA   TYR  38           HA       TYR  38   1.914   2.011   0.091
  287    HB2  TYR  38          2HB       TYR  38  -0.149   1.760  -0.746
  288    HB3  TYR  38          3HB       TYR  38  -0.867   1.732   0.861
  289    HD1  TYR  38          1HD       TYR  38   0.883   4.399  -1.091
  290    HD2  TYR  38          2HD       TYR  38  -2.655   3.186   0.937
  291    HE1  TYR  38          1HE       TYR  38  -0.102   6.615  -1.499
  292    HE2  TYR  38          2HE       TYR  38  -3.652   5.399   0.533
  293    HH   TYR  38           HH       TYR  38  -1.843   7.947  -1.157
  294    H    VAL  39           HN       VAL  39  -0.162   3.853   2.333
  295    HA   VAL  39           HA       VAL  39   0.814   6.373   1.666
  296    HB   VAL  39           HB       VAL  39  -0.203   7.199   3.680
  297   HG11  VAL  39          1HG1      VAL  39  -1.762   4.893   2.521
  298   HG12  VAL  39          2HG1      VAL  39  -2.451   6.177   3.516
  299   HG13  VAL  39          3HG1      VAL  39  -1.749   6.558   1.943
  300   HG21  VAL  39          1HG2      VAL  39  -0.125   4.330   4.589
  301   HG22  VAL  39          2HG2      VAL  39   0.643   5.728   5.341
  302   HG23  VAL  39          3HG2      VAL  39  -1.113   5.565   5.370
  303    H    GLU  40           HN       GLU  40   1.759   4.264   4.377
  304    HA   GLU  40           HA       GLU  40   3.525   5.688   5.774
  305    HB2  GLU  40          2HB       GLU  40   3.498   2.866   4.897
  306    HB3  GLU  40          3HB       GLU  40   5.041   3.459   5.494
  307    HG2  GLU  40          2HG       GLU  40   3.369   2.357   7.129
  308    HG3  GLU  40          3HG       GLU  40   4.246   3.805   7.621
  309    H    LEU  41           HN       LEU  41   4.789   3.776   3.046
  310    HA   LEU  41           HA       LEU  41   7.255   4.882   2.803
  311    HB2  LEU  41          2HB       LEU  41   5.353   3.683   0.884
  312    HB3  LEU  41          3HB       LEU  41   6.703   4.582   0.195
  313    HG   LEU  41           HG       LEU  41   8.238   3.021   0.816
  314   HD11  LEU  41          1HD1      LEU  41   8.111   3.090   3.144
  315   HD12  LEU  41          2HD1      LEU  41   7.771   1.406   2.749
  316   HD13  LEU  41          3HD1      LEU  41   6.449   2.497   3.165
  317   HD21  LEU  41          1HD2      LEU  41   7.462   0.884   0.267
  318   HD22  LEU  41          2HD2      LEU  41   6.346   1.978  -0.550
  319   HD23  LEU  41          3HD2      LEU  41   5.866   1.187   0.953
  320    H    LEU  42           HN       LEU  42   4.593   5.950   0.684
  321    HA   LEU  42           HA       LEU  42   5.764   8.229  -0.303
  322    HB2  LEU  42          2HB       LEU  42   2.887   7.602   0.290
  323    HB3  LEU  42          3HB       LEU  42   3.377   9.101  -0.498
  324    HG   LEU  42           HG       LEU  42   4.062   6.393  -1.616
  325   HD11  LEU  42          1HD1      LEU  42   1.516   7.896  -1.702
  326   HD12  LEU  42          2HD1      LEU  42   1.819   6.162  -1.819
  327   HD13  LEU  42          3HD1      LEU  42   2.088   7.200  -3.219
  328   HD21  LEU  42          1HD2      LEU  42   3.838   8.099  -3.694
  329   HD22  LEU  42          2HD2      LEU  42   5.349   7.777  -2.841
  330   HD23  LEU  42          3HD2      LEU  42   4.391   9.202  -2.435
  331    H    ILE  43           HN       ILE  43   3.250   8.381   2.218
  332    HA   ILE  43           HA       ILE  43   3.479  10.921   3.057
  333    HB   ILE  43           HB       ILE  43   2.465   8.555   4.202
  334   HG12  ILE  43          2HG1      ILE  43   1.536  10.537   5.816
  335   HG13  ILE  43          3HG1      ILE  43   2.114  11.477   4.445
  336   HG21  ILE  43          1HG2      ILE  43   4.033  10.151   6.222
  337   HG22  ILE  43          2HG2      ILE  43   2.978   8.779   6.554
  338   HG23  ILE  43          3HG2      ILE  43   4.468   8.544   5.641
  339   HD11  ILE  43          1HD1      ILE  43  -0.340  10.253   4.679
  340   HD12  ILE  43          2HD1      ILE  43   0.381  10.880   3.197
  341   HD13  ILE  43          3HD1      ILE  43   0.565   9.176   3.615
  342    H    LYS  44           HN       LYS  44   5.838   8.411   3.564
  343    HA   LYS  44           HA       LYS  44   7.363   9.845   5.525
  344    HB2  LYS  44          2HB       LYS  44   7.425   7.243   4.277
  345    HB3  LYS  44          3HB       LYS  44   9.031   7.957   4.275
  346    HG2  LYS  44          2HG       LYS  44   8.613   6.569   6.254
  347    HG3  LYS  44          3HG       LYS  44   8.952   8.251   6.668
  348    HD2  LYS  44          2HD       LYS  44   7.124   7.986   7.978
  349    HD3  LYS  44          3HD       LYS  44   6.276   8.365   6.478
  350    HE2  LYS  44          2HE       LYS  44   5.168   6.456   6.959
  351    HE3  LYS  44          3HE       LYS  44   6.563   5.713   6.180
  352    HZ1  LYS  44          1HZ       LYS  44   6.171   4.601   8.230
  353    HZ2  LYS  44          2HZ       LYS  44   6.115   6.054   9.092
  354    HZ3  LYS  44          3HZ       LYS  44   7.575   5.525   8.422
  355    H    GLU  45           HN       GLU  45   7.663   9.251   2.040
  356    HA   GLU  45           HA       GLU  45  10.065  10.796   1.796
  357    HB2  GLU  45          2HB       GLU  45   8.928   8.888   0.254
  358    HB3  GLU  45          3HB       GLU  45   8.408  10.330  -0.609
  359    HG2  GLU  45          2HG       GLU  45  11.147   9.249  -0.197
  360    HG3  GLU  45          3HG       GLU  45  10.381   9.851  -1.665
  361    H    GLY  46           HN       GLY  46   6.679  11.305   0.807
  362    HA2  GLY  46          1HA       GLY  46   5.517  13.223   0.320
  363    HA3  GLY  46          2HA       GLY  46   6.544  13.984   1.526
  364    H    LEU  47           HN       LEU  47   7.101  12.671  -1.742
  365    HA   LEU  47           HA       LEU  47   8.796  14.939  -2.364
  366    HB2  LEU  47          2HB       LEU  47   9.057  13.734  -4.561
  367    HB3  LEU  47          3HB       LEU  47   9.629  12.877  -3.130
  368    HG   LEU  47           HG       LEU  47   6.871  12.281  -4.033
  369   HD11  LEU  47          1HD1      LEU  47   7.459  10.965  -5.859
  370   HD12  LEU  47          2HD1      LEU  47   9.175  10.989  -5.449
  371   HD13  LEU  47          3HD1      LEU  47   8.401  12.438  -6.092
  372   HD21  LEU  47          1HD2      LEU  47   7.248  10.752  -2.460
  373   HD22  LEU  47          2HD2      LEU  47   8.975  11.106  -2.429
  374   HD23  LEU  47          3HD2      LEU  47   8.330   9.962  -3.608
  375    H    GLU  48           HN       GLU  48   5.620  13.712  -3.186
  376    HA   GLU  48           HA       GLU  48   4.452  16.090  -3.834
  377    HB2  GLU  48          2HB       GLU  48   4.432  15.866  -6.409
  378    HB3  GLU  48          3HB       GLU  48   5.840  16.585  -5.639
  379    HG2  GLU  48          2HG       GLU  48   6.547  13.965  -5.697
  380    HG3  GLU  48          3HG       GLU  48   5.586  14.102  -7.168
  381    H    THR  49           HN       THR  49   4.720  12.689  -4.365
  382    HA   THR  49           HA       THR  49   2.554  11.884  -5.729
  383    HB   THR  49           HB       THR  49   3.260  10.745  -3.019
  384    HG1  THR  49          1HG       THR  49   4.494  10.595  -5.532
  385   HG21  THR  49          1HG2      THR  49   2.504   8.818  -4.998
  386   HG22  THR  49          2HG2      THR  49   1.251  10.053  -4.875
  387   HG23  THR  49          3HG2      THR  49   1.753   9.161  -3.440
  388    H    ALA  50           HN       ALA  50   2.501  13.569  -2.691
  389    HA   ALA  50           HA       ALA  50   0.817  14.437  -1.428
  390    HB1  ALA  50          1HB       ALA  50   0.030  15.670  -3.217
  391    HB2  ALA  50          2HB       ALA  50  -0.457  14.237  -4.125
  392    HB3  ALA  50          3HB       ALA  50  -1.403  14.762  -2.733
  393    H    ILE  51           HN       ILE  51   1.054  11.362  -2.079
  394    HA   ILE  51           HA       ILE  51  -0.113   9.427  -1.628
  395    HB   ILE  51           HB       ILE  51  -0.652  11.091   0.834
  396   HG12  ILE  51          2HG1      ILE  51   1.270   9.820   1.755
  397   HG13  ILE  51          3HG1      ILE  51   1.497   9.062   0.182
  398   HG21  ILE  51          1HG2      ILE  51  -2.192   9.160   0.603
  399   HG22  ILE  51          2HG2      ILE  51  -0.789   8.094   0.548
  400   HG23  ILE  51          3HG2      ILE  51  -1.121   9.041   1.998
  401   HD11  ILE  51          1HD1      ILE  51   2.913  11.139   0.908
  402   HD12  ILE  51          2HD1      ILE  51   2.357  10.957  -0.756
  403   HD13  ILE  51          3HD1      ILE  51   1.497  12.028   0.350
  404    H    SER  52           HN       SER  52  -1.736   9.479  -3.218
  405    HA   SER  52           HA       SER  52  -4.341  10.543  -2.377
  406    HB2  SER  52          2HB       SER  52  -4.305   9.527  -5.082
  407    HB3  SER  52          3HB       SER  52  -4.640  11.162  -4.511
  408    HG   SER  52           HG       SER  52  -2.722  11.718  -5.140
  409    H    CYS  53           HN       CYS  53  -6.257   9.251  -2.802
  410    HA   CYS  53           HA       CYS  53  -6.468   6.899  -1.584
  411    HB2  CYS  53          2HB       CYS  53  -8.382   8.071  -2.592
  412    HB3  CYS  53          3HB       CYS  53  -7.866   7.541  -4.190
  413    HA   PRO  54           HA       PRO  54  -3.941   3.954  -3.694
  414    HB2  PRO  54          2HB       PRO  54  -4.940   1.715  -2.528
  415    HB3  PRO  54          3HB       PRO  54  -3.858   2.833  -1.691
  416    HG2  PRO  54          2HG       PRO  54  -6.840   2.610  -1.540
  417    HG3  PRO  54          3HG       PRO  54  -5.668   2.849  -0.230
  418    HD2  PRO  54          2HD       PRO  54  -7.118   4.883  -1.275
  419    HD3  PRO  54          3HD       PRO  54  -5.474   5.108  -0.645
  420    H    ASP  55           HN       ASP  55  -7.170   4.473  -4.239
  421    HA   ASP  55           HA       ASP  55  -7.910   2.140  -5.671
  422    HB2  ASP  55          2HB       ASP  55  -9.447   3.956  -4.734
  423    HB3  ASP  55          3HB       ASP  55  -9.020   4.900  -6.160
  424    H    ALA  56           HN       ALA  56  -8.391   2.117  -8.024
  425    HA   ALA  56           HA       ALA  56  -6.148   3.311  -9.497
  426    HB1  ALA  56          1HB       ALA  56  -7.833   0.874 -10.002
  427    HB2  ALA  56          2HB       ALA  56  -6.775   1.564 -11.234
  428    HB3  ALA  56          3HB       ALA  56  -6.094   0.971  -9.720
  429    H    ALA  57           HN       ALA  57  -8.807   4.570  -8.795
  430    HA   ALA  57           HA       ALA  57  -9.194   6.251 -10.871
  431    HB1  ALA  57          1HB       ALA  57 -11.328   5.133 -11.911
  432    HB2  ALA  57          2HB       ALA  57  -9.718   4.746 -12.518
  433    HB3  ALA  57          3HB       ALA  57 -10.530   3.644 -11.406
  434    H    CYS  58           HN       CYS  58  -9.512   6.197  -8.090
  435    HA   CYS  58           HA       CYS  58 -12.026   5.985  -7.028
  436    HB2  CYS  58          2HB       CYS  58  -9.994   6.596  -5.747
  437    HB3  CYS  58          3HB       CYS  58 -10.060   8.209  -6.449
  438    HA   PRO  59           HA       PRO  59 -14.508   8.875  -9.263
  439    HB2  PRO  59          2HB       PRO  59 -16.621   8.932  -7.560
  440    HB3  PRO  59          3HB       PRO  59 -16.296   7.572  -8.643
  441    HG2  PRO  59          2HG       PRO  59 -15.667   7.867  -5.730
  442    HG3  PRO  59          3HG       PRO  59 -16.320   6.465  -6.598
  443    HD2  PRO  59          2HD       PRO  59 -13.709   6.664  -5.906
  444    HD3  PRO  59          3HD       PRO  59 -14.247   5.821  -7.373
  445    H    LYS  60           HN       LYS  60 -13.195   9.391  -6.155
  446    HA   LYS  60           HA       LYS  60 -13.840  12.257  -6.346
  447    HB2  LYS  60          2HB       LYS  60 -13.617  10.641  -3.800
  448    HB3  LYS  60          3HB       LYS  60 -13.917  12.372  -3.898
  449    HG2  LYS  60          2HG       LYS  60 -16.022  11.864  -5.132
  450    HG3  LYS  60          3HG       LYS  60 -15.735  10.153  -4.808
  451    HD2  LYS  60          2HD       LYS  60 -16.478  10.332  -2.709
  452    HD3  LYS  60          3HD       LYS  60 -15.516  11.782  -2.412
  453    HE2  LYS  60          2HE       LYS  60 -17.195  13.198  -3.214
  454    HE3  LYS  60          3HE       LYS  60 -18.029  11.887  -4.045
  455    HZ1  LYS  60          1HZ       LYS  60 -18.267  12.771  -1.323
  456    HZ2  LYS  60          2HZ       LYS  60 -18.069  11.097  -1.458
  457    HZ3  LYS  60          3HZ       LYS  60 -19.344  11.865  -2.262
  458    H    GLN  61           HN       GLN  61 -11.475   9.904  -6.295
  459    HA   GLN  61           HA       GLN  61  -9.231   9.883  -5.738
  460    HB2  GLN  61          2HB       GLN  61  -9.591  12.435  -7.312
  461    HB3  GLN  61          3HB       GLN  61  -8.027  11.705  -6.974
  462    HG2  GLN  61          2HG       GLN  61  -9.647   9.678  -8.061
  463    HG3  GLN  61          3HG       GLN  61  -9.882  11.113  -9.057
  464   HE21  GLN  61          1HE2      GLN  61  -8.183  11.919 -10.248
  465   HE22  GLN  61          2HE2      GLN  61  -6.712  11.047 -10.487
  466    H    GLY  62           HN       GLY  62  -9.970  10.306  -3.402
  467    HA2  GLY  62          1HA       GLY  62  -9.429  12.950  -2.372
  468    HA3  GLY  62          2HA       GLY  62  -9.839  11.524  -1.430
  469    H    HIS  63           HN       HIS  63  -7.720  13.607  -1.111
  470    HA   HIS  63           HA       HIS  63  -5.307  11.959  -1.347
  471    HB2  HIS  63          2HB       HIS  63  -5.750  14.907  -0.924
  472    HB3  HIS  63          3HB       HIS  63  -4.180  14.162  -0.637
  473    HD1  HIS  63          1HD       HIS  63  -5.894  15.921  -3.161
  474    HD2  HIS  63          2HD       HIS  63  -3.437  12.571  -3.153
  475    HE1  HIS  63          1HE       HIS  63  -5.056  15.697  -5.521
  476    H    LEU  64           HN       LEU  64  -3.784  11.958   0.481
  477    HA   LEU  64           HA       LEU  64  -5.243  11.821   3.030
  478    HB2  LEU  64          2HB       LEU  64  -2.774  10.408   2.053
  479    HB3  LEU  64          3HB       LEU  64  -3.301  10.372   3.734
  480    HG   LEU  64           HG       LEU  64  -3.892   8.363   2.308
  481   HD11  LEU  64          1HD1      LEU  64  -5.794   7.960   3.542
  482   HD12  LEU  64          2HD1      LEU  64  -6.367   9.622   3.402
  483   HD13  LEU  64          3HD1      LEU  64  -5.025   9.241   4.480
  484   HD21  LEU  64          1HD2      LEU  64  -5.765   8.526   0.822
  485   HD22  LEU  64          2HD2      LEU  64  -4.548   9.696   0.313
  486   HD23  LEU  64          3HD2      LEU  64  -5.976  10.236   1.199
  487    H    GLN  65           HN       GLN  65  -3.947  12.319   4.993
  488    HA   GLN  65           HA       GLN  65  -2.517  14.817   4.584
  489    HB2  GLN  65          2HB       GLN  65  -2.738  13.905   7.342
  490    HB3  GLN  65          3HB       GLN  65  -3.292  15.403   6.607
  491    HG2  GLN  65          2HG       GLN  65  -5.261  14.466   7.320
  492    HG3  GLN  65          3HG       GLN  65  -5.193  13.931   5.641
  493   HE21  GLN  65          1HE2      GLN  65  -2.967  12.056   6.478
  494   HE22  GLN  65          2HE2      GLN  65  -3.793  10.709   7.175
  495    H    GLU  66           HN       GLU  66  -0.505  15.260   5.724
  496    HA   GLU  66           HA       GLU  66   1.298  12.978   5.545
  497    HB2  GLU  66          2HB       GLU  66   1.604  15.936   5.491
  498    HB3  GLU  66          3HB       GLU  66   2.961  14.995   6.096
  499    HG2  GLU  66          2HG       GLU  66   3.459  14.147   4.067
  500    HG3  GLU  66          3HG       GLU  66   1.773  14.075   3.560
  501    H    ASN  67           HN       ASN  67  -0.161  15.043   7.910
  502    HA   ASN  67           HA       ASN  67   1.652  14.186  10.018
  503    HB2  ASN  67          2HB       ASN  67   0.518  16.544   9.709
  504    HB3  ASN  67          3HB       ASN  67  -0.827  15.775  10.547
  505   HD21  ASN  67          1HD2      ASN  67  -0.773  15.671  12.688
  506   HD22  ASN  67          2HD2      ASN  67   0.594  16.048  13.674
  507    H    GLU  68           HN       GLU  68  -1.807  13.944   9.231
  508    HA   GLU  68           HA       GLU  68  -2.587  12.386  11.410
  509    HB2  GLU  68          2HB       GLU  68  -3.743  13.280   8.954
  510    HB3  GLU  68          3HB       GLU  68  -4.097  11.569   9.146
  511    HG2  GLU  68          2HG       GLU  68  -4.507  13.118  11.580
  512    HG3  GLU  68          3HG       GLU  68  -5.523  13.630  10.234
  513    H    ILE  69           HN       ILE  69  -2.107  11.175   8.088
  514    HA   ILE  69           HA       ILE  69  -2.173   8.498   8.533
  515    HB   ILE  69           HB       ILE  69  -0.371  10.028   6.665
  516   HG12  ILE  69          2HG1      ILE  69  -3.128   9.022   6.609
  517   HG13  ILE  69          3HG1      ILE  69  -2.379  10.305   5.667
  518   HG21  ILE  69          1HG2      ILE  69   0.088   7.952   5.509
  519   HG22  ILE  69          2HG2      ILE  69   0.623   7.837   7.184
  520   HG23  ILE  69          3HG2      ILE  69  -0.876   7.056   6.681
  521   HD11  ILE  69          1HD1      ILE  69  -3.199   8.451   4.285
  522   HD12  ILE  69          2HD1      ILE  69  -1.458   8.687   4.135
  523   HD13  ILE  69          3HD1      ILE  69  -2.088   7.362   5.114
  524    H    GLU  70           HN       GLU  70   0.874  10.361   8.513
  525    HA   GLU  70           HA       GLU  70   2.539   8.352   9.439
  526    HB2  GLU  70          2HB       GLU  70   4.146  10.006   9.828
  527    HB3  GLU  70          3HB       GLU  70   3.130  10.700   8.573
  528    HG2  GLU  70          2HG       GLU  70   2.069  12.153  10.090
  529    HG3  GLU  70          3HG       GLU  70   2.717  11.291  11.485
  530    H    CYS  71           HN       CYS  71   0.136  10.119  11.128
  531    HA   CYS  71           HA       CYS  71   1.193   9.840  13.758
  532    HB2  CYS  71          2HB       CYS  71  -0.847  11.283  12.678
  533    HB3  CYS  71          3HB       CYS  71  -1.741   9.986  13.465
  534    HG   CYS  71           HG       CYS  71   0.608  11.743  15.196
  535    H    MET  72           HN       MET  72  -1.041   7.946  11.782
  536    HA   MET  72           HA       MET  72  -1.592   6.057  13.873
  537    HB2  MET  72          2HB       MET  72  -3.073   5.073  12.410
  538    HB3  MET  72          3HB       MET  72  -3.020   6.709  11.767
  539    HG2  MET  72          2HG       MET  72  -0.978   5.466  10.425
  540    HG3  MET  72          3HG       MET  72  -2.189   4.195  10.564
  541    HE1  MET  72          1HE       MET  72  -1.484   4.719   7.847
  542    HE2  MET  72          2HE       MET  72  -3.047   3.926   8.045
  543    HE3  MET  72          3HE       MET  72  -2.883   5.291   6.940
  544    H    VAL  73           HN       VAL  73   1.189   6.618  12.459
  545    HA   VAL  73           HA       VAL  73   1.986   3.793  12.515
  546    HB   VAL  73           HB       VAL  73   3.694   4.673  10.640
  547   HG11  VAL  73          1HG1      VAL  73   1.087   3.854   9.531
  548   HG12  VAL  73          2HG1      VAL  73   2.689   3.149   9.309
  549   HG13  VAL  73          3HG1      VAL  73   1.767   2.801  10.771
  550   HG21  VAL  73          1HG2      VAL  73   2.031   6.816  10.768
  551   HG22  VAL  73          2HG2      VAL  73   2.978   6.370   9.349
  552   HG23  VAL  73          3HG2      VAL  73   1.287   5.881   9.471
  553    H    ALA  74           HN       ALA  74   3.546   6.945  11.918
  554    HA   ALA  74           HA       ALA  74   5.715   6.213  13.706
  555    HB1  ALA  74          1HB       ALA  74   6.637   7.247  11.892
  556    HB2  ALA  74          2HB       ALA  74   5.269   8.340  11.678
  557    HB3  ALA  74          3HB       ALA  74   6.444   8.638  12.959
  558    H    ALA  75           HN       ALA  75   2.994   6.753  14.747
  559    HA   ALA  75           HA       ALA  75   2.449   9.102  15.909
  560    HB1  ALA  75          1HB       ALA  75   1.692   6.504  16.389
  561    HB2  ALA  75          2HB       ALA  75   2.378   7.011  17.933
  562    HB3  ALA  75          3HB       ALA  75   1.061   7.932  17.208
  Start of MODEL    5
    1    H1   ALA   1           HN       ALA   1 -24.947 -13.415   9.187
    2    HA   ALA   1           HA       ALA   1 -22.550 -14.044   8.225
    3    HB1  ALA   1          1HB       ALA   1 -22.496 -16.021   9.618
    4    HB2  ALA   1          2HB       ALA   1 -23.377 -14.733  10.441
    5    HB3  ALA   1          3HB       ALA   1 -24.260 -16.058   9.681
    6    H    LEU   2           HN       LEU   2 -25.186 -14.657   6.458
    7    HA   LEU   2           HA       LEU   2 -24.370 -17.206   5.330
    8    HB2  LEU   2          2HB       LEU   2 -26.490 -15.462   4.155
    9    HB3  LEU   2          3HB       LEU   2 -26.379 -17.222   4.182
   10    HG   LEU   2           HG       LEU   2 -26.628 -16.248   6.863
   11   HD11  LEU   2          1HD1      LEU   2 -27.761 -14.402   5.302
   12   HD12  LEU   2          2HD1      LEU   2 -28.427 -14.874   6.865
   13   HD13  LEU   2          3HD1      LEU   2 -29.092 -15.557   5.381
   14   HD21  LEU   2          1HD2      LEU   2 -28.288 -17.866   7.002
   15   HD22  LEU   2          2HD2      LEU   2 -27.232 -18.489   5.735
   16   HD23  LEU   2          3HD2      LEU   2 -28.744 -17.687   5.308
   17    H    ASP   3           HN       ASP   3 -23.018 -14.368   5.089
   18    HA   ASP   3           HA       ASP   3 -21.991 -14.857   2.444
   19    HB2  ASP   3          2HB       ASP   3 -22.490 -12.334   1.877
   20    HB3  ASP   3          3HB       ASP   3 -23.695 -13.578   1.556
   21    HA   PRO   4           HA       PRO   4 -18.396 -13.149   4.305
   22    HB2  PRO   4          2HB       PRO   4 -17.017 -12.424   2.082
   23    HB3  PRO   4          3HB       PRO   4 -17.219 -14.108   2.582
   24    HG2  PRO   4          2HG       PRO   4 -18.724 -12.551   0.514
   25    HG3  PRO   4          3HG       PRO   4 -18.106 -14.212   0.435
   26    HD2  PRO   4          2HD       PRO   4 -20.703 -13.645   0.955
   27    HD3  PRO   4          3HD       PRO   4 -19.879 -15.061   1.638
   28    H    LEU   5           HN       LEU   5 -16.914 -11.135   4.033
   29    HA   LEU   5           HA       LEU   5 -18.663  -8.808   4.096
   30    HB2  LEU   5          2HB       LEU   5 -15.816  -9.277   4.938
   31    HB3  LEU   5          3HB       LEU   5 -16.553  -7.676   4.934
   32    HG   LEU   5           HG       LEU   5 -18.021  -9.760   6.419
   33   HD11  LEU   5          1HD1      LEU   5 -16.509  -9.447   8.393
   34   HD12  LEU   5          2HD1      LEU   5 -15.319  -8.761   7.288
   35   HD13  LEU   5          3HD1      LEU   5 -15.843 -10.432   7.090
   36   HD21  LEU   5          1HD2      LEU   5 -17.813  -6.914   6.288
   37   HD22  LEU   5          2HD2      LEU   5 -17.469  -7.447   7.935
   38   HD23  LEU   5          3HD2      LEU   5 -18.986  -7.904   7.158
   39    H    VAL   6           HN       VAL   6 -15.275  -8.725   3.166
   40    HA   VAL   6           HA       VAL   6 -14.215  -8.073   1.248
   41    HB   VAL   6           HB       VAL   6 -16.865  -8.057  -0.179
   42   HG11  VAL   6          1HG1      VAL   6 -15.665  -7.723  -2.024
   43   HG12  VAL   6          2HG1      VAL   6 -14.277  -7.421  -0.976
   44   HG13  VAL   6          3HG1      VAL   6 -14.561  -9.038  -1.620
   45   HG21  VAL   6          1HG2      VAL   6 -15.078 -10.402   0.435
   46   HG22  VAL   6          2HG2      VAL   6 -16.773 -10.196   0.876
   47   HG23  VAL   6          3HG2      VAL   6 -16.323 -10.419  -0.815
   48    H    SER   7           HN       SER   7 -13.491  -6.067   1.036
   49    HA   SER   7           HA       SER   7 -15.251  -3.874   0.423
   50    HB2  SER   7          2HB       SER   7 -13.675  -3.100   2.749
   51    HB3  SER   7          3HB       SER   7 -15.392  -2.861   2.426
   52    HG   SER   7           HG       SER   7 -15.230  -4.208   4.180
   53    H    CYS   8           HN       CYS   8 -12.033  -4.337   1.897
   54    HA   CYS   8           HA       CYS   8 -10.715  -2.269   0.647
   55    HB2  CYS   8          2HB       CYS   8  -9.812  -3.772   2.458
   56    HB3  CYS   8          3HB       CYS   8  -9.481  -4.969   1.211
   57    H    LYS   9           HN       LYS   9  -9.545  -2.017  -1.241
   58    HA   LYS   9           HA       LYS   9 -10.137  -3.989  -3.347
   59    HB2  LYS   9          2HB       LYS   9  -9.379  -1.129  -3.874
   60    HB3  LYS   9          3HB       LYS   9 -10.227  -2.253  -4.927
   61    HG2  LYS   9          2HG       LYS   9 -11.830  -1.996  -2.648
   62    HG3  LYS   9          3HG       LYS   9 -11.284  -0.365  -3.045
   63    HD2  LYS   9          2HD       LYS   9 -11.964  -0.944  -5.455
   64    HD3  LYS   9          3HD       LYS   9 -12.848  -2.293  -4.736
   65    HE2  LYS   9          2HE       LYS   9 -14.350  -0.916  -3.672
   66    HE3  LYS   9          3HE       LYS   9 -13.230   0.444  -3.620
   67    HZ1  LYS   9          1HZ       LYS   9 -15.260   0.311  -5.308
   68    HZ2  LYS   9          2HZ       LYS   9 -14.079  -0.436  -6.260
   69    HZ3  LYS   9          3HZ       LYS   9 -13.824   1.128  -5.670
   70    H    LEU  10           HN       LEU  10  -7.665  -2.460  -1.560
   71    HA   LEU  10           HA       LEU  10  -5.544  -2.594  -3.420
   72    HB2  LEU  10          2HB       LEU  10  -5.745  -2.406  -0.449
   73    HB3  LEU  10          3HB       LEU  10  -4.182  -2.758  -1.184
   74    HG   LEU  10           HG       LEU  10  -5.799  -0.355  -1.984
   75   HD11  LEU  10          1HD1      LEU  10  -4.875   0.950  -0.315
   76   HD12  LEU  10          2HD1      LEU  10  -3.601  -0.217   0.037
   77   HD13  LEU  10          3HD1      LEU  10  -5.258  -0.543   0.543
   78   HD21  LEU  10          1HD2      LEU  10  -3.069  -1.400  -2.459
   79   HD22  LEU  10          2HD2      LEU  10  -3.238   0.344  -2.253
   80   HD23  LEU  10          3HD2      LEU  10  -4.138  -0.487  -3.524
   81    H    CYS  11           HN       CYS  11  -6.697  -4.862  -0.950
   82    HA   CYS  11           HA       CYS  11  -5.021  -6.940  -2.200
   83    HB2  CYS  11          2HB       CYS  11  -4.832  -8.028  -0.049
   84    HB3  CYS  11          3HB       CYS  11  -4.324  -6.351   0.116
   85    H    LEU  12           HN       LEU  12  -8.033  -5.886  -2.192
   86    HA   LEU  12           HA       LEU  12 -10.122  -6.782  -2.407
   87    HB2  LEU  12          2HB       LEU  12  -8.421  -8.964  -3.600
   88    HB3  LEU  12          3HB       LEU  12 -10.176  -8.904  -3.731
   89    HG   LEU  12           HG       LEU  12  -9.393  -6.438  -4.682
   90   HD11  LEU  12          1HD1      LEU  12  -7.678  -6.979  -6.385
   91   HD12  LEU  12          2HD1      LEU  12  -7.425  -8.533  -5.590
   92   HD13  LEU  12          3HD1      LEU  12  -7.066  -7.035  -4.732
   93   HD21  LEU  12          1HD2      LEU  12 -10.031  -9.019  -6.098
   94   HD22  LEU  12          2HD2      LEU  12  -9.913  -7.460  -6.916
   95   HD23  LEU  12          3HD2      LEU  12 -11.139  -7.714  -5.672
   96    H    GLY  13           HN       GLY  13  -8.583  -7.420   0.084
   97    HA2  GLY  13          1HA       GLY  13  -9.280 -10.070   0.879
   98    HA3  GLY  13          2HA       GLY  13  -8.752  -8.773   1.940
   99    H    GLU  14           HN       GLU  14 -10.228  -7.684   3.138
  100    HA   GLU  14           HA       GLU  14 -12.899  -7.271   2.634
  101    HB2  GLU  14          2HB       GLU  14 -13.756  -9.092   4.349
  102    HB3  GLU  14          3HB       GLU  14 -13.601  -9.451   2.635
  103    HG2  GLU  14          2HG       GLU  14 -11.959 -10.937   2.961
  104    HG3  GLU  14          3HG       GLU  14 -11.187  -9.965   4.214
  105    H    TYR  15           HN       TYR  15 -11.827  -8.844   5.607
  106    HA   TYR  15           HA       TYR  15 -11.617  -8.091   7.743
  107    HB2  TYR  15          2HB       TYR  15 -10.902  -5.391   6.619
  108    HB3  TYR  15          3HB       TYR  15 -10.329  -6.146   8.102
  109    HD1  TYR  15          1HD       TYR  15  -8.441  -7.596   8.096
  110    HD2  TYR  15          2HD       TYR  15 -10.064  -6.198   4.420
  111    HE1  TYR  15          1HE       TYR  15  -6.456  -8.434   6.909
  112    HE2  TYR  15          2HE       TYR  15  -8.084  -7.034   3.221
  113    HH   TYR  15           HH       TYR  15  -6.318  -8.709   3.529
  114    HA   PRO  16           HA       PRO  16 -15.442  -6.219   8.829
  115    HB2  PRO  16          2HB       PRO  16 -14.913  -5.510  11.396
  116    HB3  PRO  16          3HB       PRO  16 -15.169  -7.186  10.895
  117    HG2  PRO  16          2HG       PRO  16 -12.601  -5.726  11.384
  118    HG3  PRO  16          3HG       PRO  16 -13.063  -7.370  11.865
  119    HD2  PRO  16          2HD       PRO  16 -11.494  -6.867   9.717
  120    HD3  PRO  16          3HD       PRO  16 -12.617  -8.241   9.779
  121    H    VAL  17           HN       VAL  17 -16.447  -4.213   9.251
  122    HA   VAL  17           HA       VAL  17 -15.219  -1.959   8.166
  123    HB   VAL  17           HB       VAL  17 -17.779  -2.598   9.186
  124   HG11  VAL  17          1HG1      VAL  17 -18.420  -0.653  10.427
  125   HG12  VAL  17          2HG1      VAL  17 -17.029  -1.383  11.230
  126   HG13  VAL  17          3HG1      VAL  17 -16.819   0.059  10.235
  127   HG21  VAL  17          1HG2      VAL  17 -17.884  -1.665   7.128
  128   HG22  VAL  17          2HG2      VAL  17 -18.130  -0.186   8.058
  129   HG23  VAL  17          3HG2      VAL  17 -16.529  -0.578   7.430
  130    H    GLU  18           HN       GLU  18 -14.893  -3.317  11.268
  131    HA   GLU  18           HA       GLU  18 -14.009  -0.805  12.474
  132    HB2  GLU  18          2HB       GLU  18 -13.703  -2.351  14.515
  133    HB3  GLU  18          3HB       GLU  18 -15.339  -1.978  13.992
  134    HG2  GLU  18          2HG       GLU  18 -15.764  -4.098  13.330
  135    HG3  GLU  18          3HG       GLU  18 -14.096  -4.400  12.845
  136    H    GLN  19           HN       GLN  19 -12.630  -2.741  10.409
  137    HA   GLN  19           HA       GLN  19 -10.020  -2.736  11.778
  138    HB2  GLN  19          2HB       GLN  19 -11.353  -4.799  10.118
  139    HB3  GLN  19          3HB       GLN  19  -9.629  -4.572   9.846
  140    HG2  GLN  19          2HG       GLN  19  -9.247  -4.913  12.265
  141    HG3  GLN  19          3HG       GLN  19 -10.965  -5.257  12.454
  142   HE21  GLN  19          1HE2      GLN  19 -10.862  -7.352  13.037
  143   HE22  GLN  19          2HE2      GLN  19 -10.221  -8.611  12.043
  144    H    MET  20           HN       MET  20 -11.865  -1.638   9.142
  145    HA   MET  20           HA       MET  20  -9.561  -1.070   7.461
  146    HB2  MET  20          2HB       MET  20 -12.230   0.051   6.806
  147    HB3  MET  20          3HB       MET  20 -11.035  -0.697   5.754
  148    HG2  MET  20          2HG       MET  20 -11.835  -2.787   7.338
  149    HG3  MET  20          3HG       MET  20 -13.321  -1.865   7.122
  150    HE1  MET  20          1HE       MET  20 -10.672  -4.080   4.380
  151    HE2  MET  20          2HE       MET  20 -10.597  -2.442   3.731
  152    HE3  MET  20          3HE       MET  20 -10.186  -2.740   5.420
  153    H    THR  21           HN       THR  21  -9.582   1.231   6.459
  154    HA   THR  21           HA       THR  21 -10.148   3.250   8.514
  155    HB   THR  21           HB       THR  21  -7.511   2.920   7.075
  156    HG1  THR  21          1HG       THR  21  -8.127   1.738   9.147
  157   HG21  THR  21          1HG2      THR  21  -8.609   5.190   8.717
  158   HG22  THR  21          2HG2      THR  21  -7.883   5.247   7.109
  159   HG23  THR  21          3HG2      THR  21  -6.876   4.925   8.521
  160    H    THR  22           HN       THR  22 -10.898   5.153   7.748
  161    HA   THR  22           HA       THR  22 -11.626   5.301   4.975
  162    HB   THR  22           HB       THR  22 -12.012   7.223   7.271
  163    HG1  THR  22          1HG       THR  22 -13.742   6.049   7.541
  164   HG21  THR  22          1HG2      THR  22 -13.747   7.838   5.121
  165   HG22  THR  22          2HG2      THR  22 -12.109   7.772   4.470
  166   HG23  THR  22          3HG2      THR  22 -12.479   8.845   5.820
  167    H    ILE  23           HN       ILE  23 -10.760   6.527   3.384
  168    HA   ILE  23           HA       ILE  23  -8.115   7.275   3.390
  169    HB   ILE  23           HB       ILE  23 -10.384   8.353   1.723
  170   HG12  ILE  23          2HG1      ILE  23 -10.023   6.032   1.306
  171   HG13  ILE  23          3HG1      ILE  23  -9.254   6.901  -0.018
  172   HG21  ILE  23          1HG2      ILE  23  -9.038   9.922   0.918
  173   HG22  ILE  23          2HG2      ILE  23  -7.747   9.392   1.994
  174   HG23  ILE  23          3HG2      ILE  23  -7.911   8.672   0.393
  175   HD11  ILE  23          1HD1      ILE  23  -7.788   5.166   0.620
  176   HD12  ILE  23          2HD1      ILE  23  -7.091   6.666   1.232
  177   HD13  ILE  23          3HD1      ILE  23  -7.935   5.574   2.329
  178    H    ALA  24           HN       ALA  24 -10.418   9.878   2.854
  179    HA   ALA  24           HA       ALA  24 -10.313  11.383   5.091
  180    HB1  ALA  24          1HB       ALA  24  -8.077  11.582   5.430
  181    HB2  ALA  24          2HB       ALA  24  -7.688  11.418   3.717
  182    HB3  ALA  24          3HB       ALA  24  -8.297  12.951   4.341
  183    H    GLN  25           HN       GLN  25 -10.217  11.212   1.662
  184    HA   GLN  25           HA       GLN  25 -11.633  13.790   1.500
  185    HB2  GLN  25          2HB       GLN  25  -9.391  12.724  -0.087
  186    HB3  GLN  25          3HB       GLN  25 -10.694  13.433  -1.033
  187    HG2  GLN  25          2HG       GLN  25  -9.015  14.752   1.077
  188    HG3  GLN  25          3HG       GLN  25  -9.112  15.141  -0.639
  189   HE21  GLN  25          1HE2      GLN  25 -10.522  15.550   2.469
  190   HE22  GLN  25          2HE2      GLN  25 -11.736  16.690   2.011
  191    H    CYS  26           HN       CYS  26 -11.155  10.727  -0.262
  192    HA   CYS  26           HA       CYS  26 -13.738  10.941  -1.523
  193    HB2  CYS  26          2HB       CYS  26 -13.178   8.755  -2.519
  194    HB3  CYS  26          3HB       CYS  26 -11.879   9.924  -2.737
  195    H    GLN  27           HN       GLN  27 -12.357   9.314   1.235
  196    HA   GLN  27           HA       GLN  27 -13.377   8.314   3.022
  197    HB2  GLN  27          2HB       GLN  27 -16.036   8.574   1.640
  198    HB3  GLN  27          3HB       GLN  27 -15.703   8.486   3.365
  199    HG2  GLN  27          2HG       GLN  27 -14.652  10.779   1.776
  200    HG3  GLN  27          3HG       GLN  27 -16.345  10.750   2.263
  201   HE21  GLN  27          1HE2      GLN  27 -13.270  11.643   3.145
  202   HE22  GLN  27          2HE2      GLN  27 -13.530  11.884   4.835
  203    H    CYS  28           HN       CYS  28 -12.201   6.771   1.126
  204    HA   CYS  28           HA       CYS  28 -14.026   4.634   0.380
  205    HB2  CYS  28          2HB       CYS  28 -11.110   5.171  -0.155
  206    HB3  CYS  28          3HB       CYS  28 -11.852   3.623  -0.546
  207    H    ILE  29           HN       ILE  29 -12.841   2.339   0.661
  208    HA   ILE  29           HA       ILE  29 -12.185   2.117   3.526
  209    HB   ILE  29           HB       ILE  29 -14.398   1.069   2.392
  210   HG12  ILE  29          2HG1      ILE  29 -14.491  -0.447   4.327
  211   HG13  ILE  29          3HG1      ILE  29 -12.763  -0.225   4.587
  212   HG21  ILE  29          1HG2      ILE  29 -14.102  -1.282   1.957
  213   HG22  ILE  29          2HG2      ILE  29 -13.038  -0.357   0.899
  214   HG23  ILE  29          3HG2      ILE  29 -12.381  -1.169   2.320
  215   HD11  ILE  29          1HD1      ILE  29 -14.496   2.183   4.550
  216   HD12  ILE  29          2HD1      ILE  29 -14.549   1.124   5.960
  217   HD13  ILE  29          3HD1      ILE  29 -13.024   1.857   5.465
  218    H    PHE  30           HN       PHE  30 -10.265   1.282   3.999
  219    HA   PHE  30           HA       PHE  30  -9.053  -0.734   2.308
  220    HB2  PHE  30          2HB       PHE  30  -7.772   1.971   2.729
  221    HB3  PHE  30          3HB       PHE  30  -6.905   0.558   2.136
  222    HD1  PHE  30          1HD       PHE  30  -8.045  -0.620   0.061
  223    HD2  PHE  30          2HD       PHE  30  -8.630   3.441   1.193
  224    HE1  PHE  30          1HE       PHE  30  -8.737  -0.082  -2.238
  225    HE2  PHE  30          2HE       PHE  30  -9.325   3.985  -1.104
  226    HZ   PHE  30           HZ       PHE  30  -9.380   2.223  -2.823
  227    H    CYS  31           HN       CYS  31  -8.288  -2.234   3.629
  228    HA   CYS  31           HA       CYS  31  -8.142  -1.998   6.398
  229    HB2  CYS  31          2HB       CYS  31  -7.166  -4.160   6.412
  230    HB3  CYS  31          3HB       CYS  31  -8.233  -4.128   5.012
  231    H    THR  32           HN       THR  32  -6.718  -1.100   7.729
  232    HA   THR  32           HA       THR  32  -4.740   0.595   7.195
  233    HB   THR  32           HB       THR  32  -4.460  -1.481   9.375
  234    HG1  THR  32          1HG       THR  32  -6.256   0.563   9.004
  235   HG21  THR  32          1HG2      THR  32  -3.137   0.136  10.530
  236   HG22  THR  32          2HG2      THR  32  -3.499   1.377   9.330
  237   HG23  THR  32          3HG2      THR  32  -2.484   0.002   8.898
  238    H    LEU  33           HN       LEU  33  -4.192  -2.912   7.492
  239    HA   LEU  33           HA       LEU  33  -1.516  -3.104   7.101
  240    HB2  LEU  33          2HB       LEU  33  -3.784  -4.789   6.128
  241    HB3  LEU  33          3HB       LEU  33  -2.130  -5.194   5.672
  242    HG   LEU  33           HG       LEU  33  -2.508  -4.782   8.548
  243   HD11  LEU  33          1HD1      LEU  33  -4.116  -6.804   7.050
  244   HD12  LEU  33          2HD1      LEU  33  -4.573  -5.803   8.428
  245   HD13  LEU  33          3HD1      LEU  33  -3.495  -7.180   8.657
  246   HD21  LEU  33          1HD2      LEU  33  -0.443  -5.639   7.713
  247   HD22  LEU  33          2HD2      LEU  33  -1.270  -6.908   6.809
  248   HD23  LEU  33          3HD2      LEU  33  -1.257  -6.945   8.573
  249    H    CYS  34           HN       CYS  34  -3.949  -2.746   4.536
  250    HA   CYS  34           HA       CYS  34  -1.942  -2.584   2.473
  251    HB2  CYS  34          2HB       CYS  34  -4.934  -2.162   2.450
  252    HB3  CYS  34          3HB       CYS  34  -3.923  -2.026   1.014
  253    H    LEU  35           HN       LEU  35  -4.405  -0.310   3.698
  254    HA   LEU  35           HA       LEU  35  -3.508   1.942   2.326
  255    HB2  LEU  35          2HB       LEU  35  -5.653   1.600   3.671
  256    HB3  LEU  35          3HB       LEU  35  -4.696   2.046   5.083
  257    HG   LEU  35           HG       LEU  35  -6.149   3.832   3.872
  258   HD11  LEU  35          1HD1      LEU  35  -5.036   4.975   5.416
  259   HD12  LEU  35          2HD1      LEU  35  -3.817   5.307   4.185
  260   HD13  LEU  35          3HD1      LEU  35  -3.622   3.930   5.270
  261   HD21  LEU  35          1HD2      LEU  35  -5.058   3.224   1.645
  262   HD22  LEU  35          2HD2      LEU  35  -3.650   4.111   2.229
  263   HD23  LEU  35          3HD2      LEU  35  -5.197   4.937   2.038
  264    H    LYS  36           HN       LYS  36  -1.984   0.234   4.797
  265    HA   LYS  36           HA       LYS  36  -0.486   2.524   5.799
  266    HB2  LYS  36          2HB       LYS  36  -1.174   0.918   7.458
  267    HB3  LYS  36          3HB       LYS  36  -0.462  -0.404   6.542
  268    HG2  LYS  36          2HG       LYS  36   1.625   1.397   6.969
  269    HG3  LYS  36          3HG       LYS  36   0.741   1.327   8.496
  270    HD2  LYS  36          2HD       LYS  36   0.844  -1.306   7.793
  271    HD3  LYS  36          3HD       LYS  36   2.382  -0.711   7.166
  272    HE2  LYS  36          2HE       LYS  36   2.494   0.440   9.544
  273    HE3  LYS  36          3HE       LYS  36   1.399  -0.875   9.971
  274    HZ1  LYS  36          1HZ       LYS  36   3.661  -1.749   8.438
  275    HZ2  LYS  36          2HZ       LYS  36   3.045  -2.351   9.893
  276    HZ3  LYS  36          3HZ       LYS  36   4.105  -1.033   9.905
  277    H    GLN  37           HN       GLN  37   0.552  -0.731   4.790
  278    HA   GLN  37           HA       GLN  37   3.158  -0.264   4.244
  279    HB2  GLN  37          2HB       GLN  37   1.411  -2.324   3.728
  280    HB3  GLN  37          3HB       GLN  37   1.909  -1.839   2.112
  281    HG2  GLN  37          2HG       GLN  37   4.080  -2.468   2.436
  282    HG3  GLN  37          3HG       GLN  37   4.005  -2.228   4.180
  283   HE21  GLN  37          1HE2      GLN  37   2.637  -3.781   5.380
  284   HE22  GLN  37          2HE2      GLN  37   2.629  -5.426   4.854
  285    H    TYR  38           HN       TYR  38   0.458   0.960   2.478
  286    HA   TYR  38           HA       TYR  38   2.008   1.679   0.143
  287    HB2  TYR  38          2HB       TYR  38  -0.066   1.491  -0.702
  288    HB3  TYR  38          3HB       TYR  38  -0.810   1.620   0.887
  289    HD1  TYR  38          1HD       TYR  38  -2.457   3.232   0.869
  290    HD2  TYR  38          2HD       TYR  38   1.175   3.997  -1.211
  291    HE1  TYR  38          1HE       TYR  38  -3.256   5.491   0.316
  292    HE2  TYR  38          2HE       TYR  38   0.387   6.258  -1.769
  293    HH   TYR  38           HH       TYR  38  -1.223   7.763  -1.506
  294    H    VAL  39           HN       VAL  39  -0.011   3.655   2.320
  295    HA   VAL  39           HA       VAL  39   1.166   6.101   1.668
  296    HB   VAL  39           HB       VAL  39   0.083   7.029   3.585
  297   HG11  VAL  39          1HG1      VAL  39  -2.203   6.136   3.346
  298   HG12  VAL  39          2HG1      VAL  39  -1.408   6.380   1.791
  299   HG13  VAL  39          3HG1      VAL  39  -1.552   4.756   2.464
  300   HG21  VAL  39          1HG2      VAL  39   0.790   5.566   5.325
  301   HG22  VAL  39          2HG2      VAL  39  -0.973   5.524   5.298
  302   HG23  VAL  39          3HG2      VAL  39  -0.049   4.195   4.599
  303    H    GLU  40           HN       GLU  40   1.821   3.947   4.427
  304    HA   GLU  40           HA       GLU  40   3.676   5.377   5.814
  305    HB2  GLU  40          2HB       GLU  40   2.794   2.828   5.947
  306    HB3  GLU  40          3HB       GLU  40   4.421   2.551   5.344
  307    HG2  GLU  40          2HG       GLU  40   4.317   4.430   7.568
  308    HG3  GLU  40          3HG       GLU  40   3.710   2.825   7.969
  309    H    LEU  41           HN       LEU  41   4.078   3.873   2.698
  310    HA   LEU  41           HA       LEU  41   6.944   4.162   2.659
  311    HB2  LEU  41          2HB       LEU  41   4.898   3.396   0.600
  312    HB3  LEU  41          3HB       LEU  41   6.598   3.615   0.190
  313    HG   LEU  41           HG       LEU  41   5.564   1.238   0.761
  314   HD11  LEU  41          1HD1      LEU  41   7.780   0.470   1.217
  315   HD12  LEU  41          2HD1      LEU  41   8.277   2.067   1.774
  316   HD13  LEU  41          3HD1      LEU  41   7.891   1.808   0.073
  317   HD21  LEU  41          1HD2      LEU  41   5.875   0.590   3.033
  318   HD22  LEU  41          2HD2      LEU  41   4.852   2.028   3.029
  319   HD23  LEU  41          3HD2      LEU  41   6.562   2.161   3.449
  320    H    LEU  42           HN       LEU  42   4.181   5.811   1.166
  321    HA   LEU  42           HA       LEU  42   5.894   7.799  -0.054
  322    HB2  LEU  42          2HB       LEU  42   2.943   7.298   0.004
  323    HB3  LEU  42          3HB       LEU  42   3.578   8.836  -0.577
  324    HG   LEU  42           HG       LEU  42   4.608   6.302  -1.768
  325   HD11  LEU  42          1HD1      LEU  42   2.733   6.633  -3.496
  326   HD12  LEU  42          2HD1      LEU  42   1.896   7.495  -2.206
  327   HD13  LEU  42          3HD1      LEU  42   2.346   5.805  -1.988
  328   HD21  LEU  42          1HD2      LEU  42   4.445   9.177  -2.449
  329   HD22  LEU  42          2HD2      LEU  42   4.312   8.029  -3.781
  330   HD23  LEU  42          3HD2      LEU  42   5.737   8.011  -2.740
  331    H    ILE  43           HN       ILE  43   3.136   7.990   2.205
  332    HA   ILE  43           HA       ILE  43   3.223  10.555   3.003
  333    HB   ILE  43           HB       ILE  43   2.113   8.246   4.061
  334   HG12  ILE  43          2HG1      ILE  43   1.253  10.175   5.778
  335   HG13  ILE  43          3HG1      ILE  43   1.916  11.162   4.480
  336   HG21  ILE  43          1HG2      ILE  43   4.088   8.050   5.541
  337   HG22  ILE  43          2HG2      ILE  43   3.687   9.622   6.231
  338   HG23  ILE  43          3HG2      ILE  43   2.576   8.266   6.424
  339   HD11  ILE  43          1HD1      ILE  43   0.274   9.015   3.459
  340   HD12  ILE  43          2HD1      ILE  43  -0.606  10.046   4.589
  341   HD13  ILE  43          3HD1      ILE  43   0.174  10.752   3.174
  342    H    LYS  44           HN       LYS  44   5.659   8.171   3.628
  343    HA   LYS  44           HA       LYS  44   6.983   9.605   5.723
  344    HB2  LYS  44          2HB       LYS  44   7.217   7.057   4.474
  345    HB3  LYS  44          3HB       LYS  44   8.784   7.850   4.371
  346    HG2  LYS  44          2HG       LYS  44   8.550   6.458   6.380
  347    HG3  LYS  44          3HG       LYS  44   8.834   8.158   6.762
  348    HD2  LYS  44          2HD       LYS  44   7.089   7.895   8.158
  349    HD3  LYS  44          3HD       LYS  44   6.121   8.084   6.694
  350    HE2  LYS  44          2HE       LYS  44   5.336   6.017   6.901
  351    HE3  LYS  44          3HE       LYS  44   6.973   5.362   6.931
  352    HZ1  LYS  44          1HZ       LYS  44   5.197   5.326   8.994
  353    HZ2  LYS  44          2HZ       LYS  44   6.237   6.594   9.407
  354    HZ3  LYS  44          3HZ       LYS  44   6.862   5.048   9.116
  355    H    GLU  45           HN       GLU  45   7.596   9.142   2.252
  356    HA   GLU  45           HA       GLU  45   9.894  10.810   2.185
  357    HB2  GLU  45          2HB       GLU  45   8.448   9.167   0.358
  358    HB3  GLU  45          3HB       GLU  45   8.641  10.755  -0.371
  359    HG2  GLU  45          2HG       GLU  45  10.564   9.808  -1.085
  360    HG3  GLU  45          3HG       GLU  45  11.131  10.425   0.465
  361    H    GLY  46           HN       GLY  46   6.779  11.391   0.549
  362    HA2  GLY  46          1HA       GLY  46   5.508  13.309   0.389
  363    HA3  GLY  46          2HA       GLY  46   6.471  13.997   1.689
  364    H    LEU  47           HN       LEU  47   6.817  13.089  -1.743
  365    HA   LEU  47           HA       LEU  47   8.528  15.453  -2.105
  366    HB2  LEU  47          2HB       LEU  47   9.251  14.356  -4.198
  367    HB3  LEU  47          3HB       LEU  47   9.618  13.422  -2.749
  368    HG   LEU  47           HG       LEU  47   7.185  12.836  -4.407
  369   HD11  LEU  47          1HD1      LEU  47   9.729  11.329  -4.788
  370   HD12  LEU  47          2HD1      LEU  47   9.465  12.827  -5.680
  371   HD13  LEU  47          3HD1      LEU  47   8.337  11.483  -5.862
  372   HD21  LEU  47          1HD2      LEU  47   6.886  11.200  -2.939
  373   HD22  LEU  47          2HD2      LEU  47   8.230  11.846  -1.996
  374   HD23  LEU  47          3HD2      LEU  47   8.521  10.600  -3.212
  375    H    GLU  48           HN       GLU  48   5.533  13.983  -3.029
  376    HA   GLU  48           HA       GLU  48   4.287  16.249  -3.915
  377    HB2  GLU  48          2HB       GLU  48   4.341  15.795  -6.452
  378    HB3  GLU  48          3HB       GLU  48   5.715  16.616  -5.724
  379    HG2  GLU  48          2HG       GLU  48   6.953  14.512  -5.676
  380    HG3  GLU  48          3HG       GLU  48   5.576  13.688  -6.406
  381    H    THR  49           HN       THR  49   4.731  12.814  -4.326
  382    HA   THR  49           HA       THR  49   2.553  11.881  -5.583
  383    HB   THR  49           HB       THR  49   3.364  10.802  -2.880
  384    HG1  THR  49          1HG       THR  49   4.506  10.346  -5.454
  385   HG21  THR  49          1HG2      THR  49   1.940   9.151  -3.327
  386   HG22  THR  49          2HG2      THR  49   2.797   8.808  -4.830
  387   HG23  THR  49          3HG2      THR  49   1.465   9.963  -4.818
  388    H    ALA  50           HN       ALA  50   2.540  13.609  -2.569
  389    HA   ALA  50           HA       ALA  50   0.875  14.330  -1.190
  390    HB1  ALA  50          1HB       ALA  50   0.152  15.628  -3.020
  391    HB2  ALA  50          2HB       ALA  50  -0.546  14.229  -3.837
  392    HB3  ALA  50          3HB       ALA  50  -1.302  14.865  -2.375
  393    H    ILE  51           HN       ILE  51   1.163  11.323  -1.891
  394    HA   ILE  51           HA       ILE  51  -0.014   9.354  -1.588
  395    HB   ILE  51           HB       ILE  51  -0.585  10.886   0.951
  396   HG12  ILE  51          2HG1      ILE  51   1.369   9.709   1.829
  397   HG13  ILE  51          3HG1      ILE  51   1.579   8.874   0.293
  398   HG21  ILE  51          1HG2      ILE  51  -0.588   7.898   0.624
  399   HG22  ILE  51          2HG2      ILE  51  -1.128   8.847   2.008
  400   HG23  ILE  51          3HG2      ILE  51  -2.053   8.873   0.507
  401   HD11  ILE  51          1HD1      ILE  51   2.506  10.674  -0.713
  402   HD12  ILE  51          2HD1      ILE  51   1.566  11.830   0.233
  403   HD13  ILE  51          3HD1      ILE  51   2.966  11.034   0.951
  404    H    SER  52           HN       SER  52  -1.623   9.533  -3.204
  405    HA   SER  52           HA       SER  52  -4.233  10.548  -2.336
  406    HB2  SER  52          2HB       SER  52  -2.869  10.748  -4.761
  407    HB3  SER  52          3HB       SER  52  -4.132   9.557  -5.068
  408    HG   SER  52           HG       SER  52  -5.139  11.437  -5.418
  409    H    CYS  53           HN       CYS  53  -6.158   9.273  -2.835
  410    HA   CYS  53           HA       CYS  53  -6.401   6.907  -1.639
  411    HB2  CYS  53          2HB       CYS  53  -8.301   8.081  -2.641
  412    HB3  CYS  53          3HB       CYS  53  -7.755   7.619  -4.250
  413    HA   PRO  54           HA       PRO  54  -3.864   3.970  -3.744
  414    HB2  PRO  54          2HB       PRO  54  -4.905   1.721  -2.634
  415    HB3  PRO  54          3HB       PRO  54  -3.831   2.818  -1.757
  416    HG2  PRO  54          2HG       PRO  54  -6.816   2.620  -1.670
  417    HG3  PRO  54          3HG       PRO  54  -5.670   2.827  -0.334
  418    HD2  PRO  54          2HD       PRO  54  -7.081   4.890  -1.376
  419    HD3  PRO  54          3HD       PRO  54  -5.448   5.091  -0.709
  420    H    ASP  55           HN       ASP  55  -7.028   4.582  -4.406
  421    HA   ASP  55           HA       ASP  55  -7.440   2.262  -6.136
  422    HB2  ASP  55          2HB       ASP  55  -9.254   3.281  -4.619
  423    HB3  ASP  55          3HB       ASP  55  -9.343   4.574  -5.811
  424    H    ALA  56           HN       ALA  56  -6.853   2.308  -8.193
  425    HA   ALA  56           HA       ALA  56  -6.048   4.796  -9.432
  426    HB1  ALA  56          1HB       ALA  56  -4.590   3.007  -9.867
  427    HB2  ALA  56          2HB       ALA  56  -5.914   1.919 -10.287
  428    HB3  ALA  56          3HB       ALA  56  -5.485   3.244 -11.369
  429    H    ALA  57           HN       ALA  57  -8.901   4.320  -8.824
  430    HA   ALA  57           HA       ALA  57  -9.971   5.246 -11.313
  431    HB1  ALA  57          1HB       ALA  57 -11.387   3.493 -11.901
  432    HB2  ALA  57          2HB       ALA  57  -9.873   2.683 -11.492
  433    HB3  ALA  57          3HB       ALA  57 -11.207   2.696 -10.338
  434    H    CYS  58           HN       CYS  58  -9.762   6.062  -8.506
  435    HA   CYS  58           HA       CYS  58 -12.305   5.838  -7.257
  436    HB2  CYS  58          2HB       CYS  58 -10.087   6.405  -6.141
  437    HB3  CYS  58          3HB       CYS  58 -10.290   8.033  -6.780
  438    HA   PRO  59           HA       PRO  59 -14.554   8.788  -9.660
  439    HB2  PRO  59          2HB       PRO  59 -16.662   9.083  -7.975
  440    HB3  PRO  59          3HB       PRO  59 -16.436   7.654  -8.990
  441    HG2  PRO  59          2HG       PRO  59 -15.797   8.039  -6.091
  442    HG3  PRO  59          3HG       PRO  59 -16.551   6.650  -6.895
  443    HD2  PRO  59          2HD       PRO  59 -13.935   6.685  -6.196
  444    HD3  PRO  59          3HD       PRO  59 -14.530   5.816  -7.626
  445    H    LYS  60           HN       LYS  60 -13.372   9.334  -6.466
  446    HA   LYS  60           HA       LYS  60 -13.689  12.236  -6.859
  447    HB2  LYS  60          2HB       LYS  60 -13.955  10.645  -4.308
  448    HB3  LYS  60          3HB       LYS  60 -13.752  12.392  -4.333
  449    HG2  LYS  60          2HG       LYS  60 -15.818  12.336  -5.916
  450    HG3  LYS  60          3HG       LYS  60 -16.081  10.743  -5.200
  451    HD2  LYS  60          2HD       LYS  60 -17.273  12.013  -3.726
  452    HD3  LYS  60          3HD       LYS  60 -15.686  12.098  -2.956
  453    HE2  LYS  60          2HE       LYS  60 -15.309  14.218  -4.294
  454    HE3  LYS  60          3HE       LYS  60 -17.025  14.159  -4.693
  455    HZ1  LYS  60          1HZ       LYS  60 -17.622  14.752  -2.616
  456    HZ2  LYS  60          2HZ       LYS  60 -16.077  15.438  -2.581
  457    HZ3  LYS  60          3HZ       LYS  60 -16.346  13.926  -1.873
  458    H    GLN  61           HN       GLN  61 -11.599   9.638  -6.414
  459    HA   GLN  61           HA       GLN  61  -9.415   9.452  -5.671
  460    HB2  GLN  61          2HB       GLN  61  -9.228  11.890  -7.448
  461    HB3  GLN  61          3HB       GLN  61  -7.922  10.774  -7.069
  462    HG2  GLN  61          2HG       GLN  61  -9.195   8.971  -8.182
  463    HG3  GLN  61          3HG       GLN  61 -10.412  10.159  -8.641
  464   HE21  GLN  61          1HE2      GLN  61  -7.546   8.652  -9.507
  465   HE22  GLN  61          2HE2      GLN  61  -7.112   9.667 -10.837
  466    H    GLY  62           HN       GLY  62 -10.135  10.169  -3.452
  467    HA2  GLY  62          1HA       GLY  62  -9.529  12.870  -2.664
  468    HA3  GLY  62          2HA       GLY  62  -9.960  11.542  -1.597
  469    H    HIS  63           HN       HIS  63  -7.822  13.618  -1.447
  470    HA   HIS  63           HA       HIS  63  -5.391  12.018  -1.632
  471    HB2  HIS  63          2HB       HIS  63  -5.927  14.930  -1.082
  472    HB3  HIS  63          3HB       HIS  63  -4.336  14.219  -0.821
  473    HD1  HIS  63          1HD       HIS  63  -6.550  15.536  -3.444
  474    HD2  HIS  63          2HD       HIS  63  -3.074  13.272  -3.228
  475    HE1  HIS  63          1HE       HIS  63  -5.581  15.571  -5.764
  476    H    LEU  64           HN       LEU  64  -3.873  12.013   0.212
  477    HA   LEU  64           HA       LEU  64  -5.341  11.764   2.752
  478    HB2  LEU  64          2HB       LEU  64  -3.001  10.281   1.613
  479    HB3  LEU  64          3HB       LEU  64  -3.296  10.306   3.350
  480    HG   LEU  64           HG       LEU  64  -5.447   9.418   1.464
  481   HD11  LEU  64          1HD1      LEU  64  -2.962   7.966   2.205
  482   HD12  LEU  64          2HD1      LEU  64  -3.908   7.909   0.718
  483   HD13  LEU  64          3HD1      LEU  64  -4.478   7.065   2.157
  484   HD21  LEU  64          1HD2      LEU  64  -4.888   9.341   4.355
  485   HD22  LEU  64          2HD2      LEU  64  -5.594   7.876   3.672
  486   HD23  LEU  64          3HD2      LEU  64  -6.425   9.423   3.494
  487    H    GLN  65           HN       GLN  65  -4.168  12.295   4.717
  488    HA   GLN  65           HA       GLN  65  -2.595  14.707   4.362
  489    HB2  GLN  65          2HB       GLN  65  -2.956  13.808   7.109
  490    HB3  GLN  65          3HB       GLN  65  -3.417  15.329   6.355
  491    HG2  GLN  65          2HG       GLN  65  -5.450  14.482   6.992
  492    HG3  GLN  65          3HG       GLN  65  -5.342  13.938   5.318
  493   HE21  GLN  65          1HE2      GLN  65  -3.241  11.966   6.223
  494   HE22  GLN  65          2HE2      GLN  65  -4.149  10.662   6.900
  495    H    GLU  66           HN       GLU  66  -0.603  15.068   5.552
  496    HA   GLU  66           HA       GLU  66   1.100  12.706   5.455
  497    HB2  GLU  66          2HB       GLU  66   1.524  15.639   5.331
  498    HB3  GLU  66          3HB       GLU  66   2.811  14.692   6.065
  499    HG2  GLU  66          2HG       GLU  66   3.355  13.651   4.113
  500    HG3  GLU  66          3HG       GLU  66   1.724  13.783   3.459
  501    H    ASN  67           HN       ASN  67  -0.392  14.804   7.750
  502    HA   ASN  67           HA       ASN  67   1.338  13.943   9.927
  503    HB2  ASN  67          2HB       ASN  67   0.645  15.797  11.001
  504    HB3  ASN  67          3HB       ASN  67  -0.056  16.274   9.457
  505   HD21  ASN  67          1HD2      ASN  67  -2.223  16.354   9.234
  506   HD22  ASN  67          2HD2      ASN  67  -3.342  16.005  10.501
  507    H    GLU  68           HN       GLU  68  -2.135  13.827   9.133
  508    HA   GLU  68           HA       GLU  68  -2.983  12.258  11.255
  509    HB2  GLU  68          2HB       GLU  68  -4.047  13.128   8.732
  510    HB3  GLU  68          3HB       GLU  68  -4.476  11.444   9.000
  511    HG2  GLU  68          2HG       GLU  68  -4.859  13.239  11.300
  512    HG3  GLU  68          3HG       GLU  68  -5.905  13.531   9.911
  513    H    ILE  69           HN       ILE  69  -2.184  11.112   7.971
  514    HA   ILE  69           HA       ILE  69  -2.390   8.401   8.411
  515    HB   ILE  69           HB       ILE  69  -0.561   9.941   6.585
  516   HG12  ILE  69          2HG1      ILE  69  -3.283   8.900   6.481
  517   HG13  ILE  69          3HG1      ILE  69  -2.500  10.097   5.455
  518   HG21  ILE  69          1HG2      ILE  69  -0.903   6.951   6.751
  519   HG22  ILE  69          2HG2      ILE  69  -0.086   7.807   5.445
  520   HG23  ILE  69          3HG2      ILE  69   0.570   7.864   7.081
  521   HD11  ILE  69          1HD1      ILE  69  -1.564   8.367   4.075
  522   HD12  ILE  69          2HD1      ILE  69  -2.195   7.121   5.154
  523   HD13  ILE  69          3HD1      ILE  69  -3.305   8.125   4.223
  524    H    GLU  70           HN       GLU  70   0.674  10.237   8.472
  525    HA   GLU  70           HA       GLU  70   2.285   8.213   9.468
  526    HB2  GLU  70          2HB       GLU  70   3.904   9.854   9.894
  527    HB3  GLU  70          3HB       GLU  70   2.948  10.525   8.579
  528    HG2  GLU  70          2HG       GLU  70   1.812  12.004  10.046
  529    HG3  GLU  70          3HG       GLU  70   2.478  11.203  11.468
  530    H    CYS  71           HN       CYS  71  -0.136  10.041  11.063
  531    HA   CYS  71           HA       CYS  71   0.861   9.722  13.727
  532    HB2  CYS  71          2HB       CYS  71  -0.695  11.283  14.097
  533    HB3  CYS  71          3HB       CYS  71  -1.304  11.082  12.459
  534    HG   CYS  71           HG       CYS  71  -2.621  10.091  15.350
  535    H    MET  72           HN       MET  72  -1.010   7.798  11.542
  536    HA   MET  72           HA       MET  72  -1.908   6.008  13.661
  537    HB2  MET  72          2HB       MET  72  -3.407   5.128  12.155
  538    HB3  MET  72          3HB       MET  72  -3.240   6.760  11.522
  539    HG2  MET  72          2HG       MET  72  -1.272   5.520  10.167
  540    HG3  MET  72          3HG       MET  72  -2.405   4.187  10.374
  541    HE1  MET  72          1HE       MET  72  -3.777   4.269   7.316
  542    HE2  MET  72          2HE       MET  72  -2.393   5.269   6.877
  543    HE3  MET  72          3HE       MET  72  -2.210   3.988   8.076
  544    H    VAL  73           HN       VAL  73   0.877   6.434  12.024
  545    HA   VAL  73           HA       VAL  73   1.566   3.583  12.232
  546    HB   VAL  73           HB       VAL  73   3.168   4.025  10.273
  547   HG11  VAL  73          1HG1      VAL  73   1.325   3.603   8.606
  548   HG12  VAL  73          2HG1      VAL  73   1.365   2.510   9.991
  549   HG13  VAL  73          3HG1      VAL  73   0.185   3.821   9.934
  550   HG21  VAL  73          1HG2      VAL  73   3.171   6.265   9.821
  551   HG22  VAL  73          2HG2      VAL  73   1.935   5.735   8.680
  552   HG23  VAL  73          3HG2      VAL  73   1.463   6.459  10.217
  553    H    ALA  74           HN       ALA  74   3.047   6.785  11.686
  554    HA   ALA  74           HA       ALA  74   5.336   5.981  13.313
  555    HB1  ALA  74          1HB       ALA  74   5.685   8.624  12.443
  556    HB2  ALA  74          2HB       ALA  74   6.447   7.168  11.801
  557    HB3  ALA  74          3HB       ALA  74   4.942   7.759  11.096
  558    H    ALA  75           HN       ALA  75   2.687   6.513  14.493
  559    HA   ALA  75           HA       ALA  75   2.299   8.921  15.693
  560    HB1  ALA  75          1HB       ALA  75   1.328   6.361  16.067
  561    HB2  ALA  75          2HB       ALA  75   2.001   6.791  17.641
  562    HB3  ALA  75          3HB       ALA  75   0.779   7.820  16.892
  Start of MODEL    6
    1    H1   ALA   1           HN       ALA   1 -26.408  -4.246   1.352
    2    HA   ALA   1           HA       ALA   1 -27.766  -4.107   3.802
    3    HB1  ALA   1          1HB       ALA   1 -29.458  -4.542   1.428
    4    HB2  ALA   1          2HB       ALA   1 -29.738  -5.630   2.788
    5    HB3  ALA   1          3HB       ALA   1 -29.868  -3.885   3.013
    6    H    LEU   2           HN       LEU   2 -26.999  -6.098   0.991
    7    HA   LEU   2           HA       LEU   2 -26.552  -8.401   2.758
    8    HB2  LEU   2          2HB       LEU   2 -27.812  -8.209   0.316
    9    HB3  LEU   2          3HB       LEU   2 -26.224  -8.849  -0.103
   10    HG   LEU   2           HG       LEU   2 -26.638 -10.660   1.609
   11   HD11  LEU   2          1HD1      LEU   2 -29.469  -9.645   1.420
   12   HD12  LEU   2          2HD1      LEU   2 -28.425  -9.492   2.832
   13   HD13  LEU   2          3HD1      LEU   2 -28.923 -11.089   2.273
   14   HD21  LEU   2          1HD2      LEU   2 -28.428 -11.757   0.054
   15   HD22  LEU   2          2HD2      LEU   2 -26.809 -11.417  -0.555
   16   HD23  LEU   2          3HD2      LEU   2 -28.144 -10.332  -0.945
   17    H    ASP   3           HN       ASP   3 -24.683  -6.378   2.949
   18    HA   ASP   3           HA       ASP   3 -22.341  -7.589   1.632
   19    HB2  ASP   3          2HB       ASP   3 -22.513  -4.686   2.429
   20    HB3  ASP   3          3HB       ASP   3 -21.323  -5.459   1.385
   21    HA   PRO   4           HA       PRO   4 -21.884  -7.933   6.233
   22    HB2  PRO   4          2HB       PRO   4 -20.958 -10.485   6.179
   23    HB3  PRO   4          3HB       PRO   4 -22.680 -10.089   6.212
   24    HG2  PRO   4          2HG       PRO   4 -20.955 -10.843   3.885
   25    HG3  PRO   4          3HG       PRO   4 -22.598 -11.380   4.280
   26    HD2  PRO   4          2HD       PRO   4 -22.095  -9.462   2.436
   27    HD3  PRO   4          3HD       PRO   4 -23.562  -9.462   3.437
   28    H    LEU   5           HN       LEU   5 -19.731  -9.190   3.690
   29    HA   LEU   5           HA       LEU   5 -17.481  -7.889   5.057
   30    HB2  LEU   5          2HB       LEU   5 -16.063  -9.845   4.389
   31    HB3  LEU   5          3HB       LEU   5 -17.228 -10.154   5.675
   32    HG   LEU   5           HG       LEU   5 -18.170 -10.817   2.970
   33   HD11  LEU   5          1HD1      LEU   5 -15.583 -11.740   3.884
   34   HD12  LEU   5          2HD1      LEU   5 -16.369 -11.947   2.319
   35   HD13  LEU   5          3HD1      LEU   5 -16.709 -13.074   3.632
   36   HD21  LEU   5          1HD2      LEU   5 -19.048 -12.750   4.116
   37   HD22  LEU   5          2HD2      LEU   5 -19.400 -11.301   5.058
   38   HD23  LEU   5          3HD2      LEU   5 -18.091 -12.377   5.550
   39    H    VAL   6           HN       VAL   6 -15.468  -8.056   3.493
   40    HA   VAL   6           HA       VAL   6 -14.532  -7.715   1.409
   41    HB   VAL   6           HB       VAL   6 -17.241  -7.510   0.137
   42   HG11  VAL   6          1HG1      VAL   6 -15.660  -7.019  -1.452
   43   HG12  VAL   6          2HG1      VAL   6 -14.449  -8.085  -0.735
   44   HG13  VAL   6          3HG1      VAL   6 -15.791  -8.766  -1.655
   45   HG21  VAL   6          1HG2      VAL   6 -16.239  -9.792   1.548
   46   HG22  VAL   6          2HG2      VAL   6 -17.760  -9.602   0.676
   47   HG23  VAL   6          3HG2      VAL   6 -16.318 -10.150  -0.178
   48    H    SER   7           HN       SER   7 -13.686  -5.737   1.569
   49    HA   SER   7           HA       SER   7 -15.345  -3.459   0.807
   50    HB2  SER   7          2HB       SER   7 -13.614  -2.621   2.944
   51    HB3  SER   7          3HB       SER   7 -15.370  -2.499   2.831
   52    HG   SER   7           HG       SER   7 -15.103  -3.806   4.525
   53    H    CYS   8           HN       CYS   8 -12.066  -4.189   2.015
   54    HA   CYS   8           HA       CYS   8 -10.715  -2.208   0.622
   55    HB2  CYS   8          2HB       CYS   8  -9.818  -3.748   2.441
   56    HB3  CYS   8          3HB       CYS   8  -9.566  -4.943   1.172
   57    H    LYS   9           HN       LYS   9  -9.430  -2.264  -1.287
   58    HA   LYS   9           HA       LYS   9 -10.130  -4.358  -3.224
   59    HB2  LYS   9          2HB       LYS   9  -9.942  -1.518  -4.142
   60    HB3  LYS   9          3HB       LYS   9 -10.795  -2.871  -4.874
   61    HG2  LYS   9          2HG       LYS   9 -12.387  -2.779  -2.928
   62    HG3  LYS   9          3HG       LYS   9 -11.612  -1.259  -2.473
   63    HD2  LYS   9          2HD       LYS   9 -12.166  -1.004  -5.195
   64    HD3  LYS   9          3HD       LYS   9 -13.595  -1.779  -4.508
   65    HE2  LYS   9          2HE       LYS   9 -13.744  -0.007  -2.827
   66    HE3  LYS   9          3HE       LYS   9 -12.312   0.763  -3.509
   67    HZ1  LYS   9          1HZ       LYS   9 -13.598   0.903  -5.642
   68    HZ2  LYS   9          2HZ       LYS   9 -14.165   1.887  -4.390
   69    HZ3  LYS   9          3HZ       LYS   9 -14.975   0.451  -4.768
   70    H    LEU  10           HN       LEU  10  -7.735  -3.867  -1.626
   71    HA   LEU  10           HA       LEU  10  -5.815  -3.354  -3.803
   72    HB2  LEU  10          2HB       LEU  10  -5.248  -3.032  -0.867
   73    HB3  LEU  10          3HB       LEU  10  -4.259  -2.501  -2.226
   74    HG   LEU  10           HG       LEU  10  -6.972  -1.347  -1.612
   75   HD11  LEU  10          1HD1      LEU  10  -4.271  -0.280  -0.804
   76   HD12  LEU  10          2HD1      LEU  10  -5.460  -0.990   0.288
   77   HD13  LEU  10          3HD1      LEU  10  -5.828   0.512  -0.560
   78   HD21  LEU  10          1HD2      LEU  10  -6.002  -1.133  -3.923
   79   HD22  LEU  10          2HD2      LEU  10  -4.691  -0.197  -3.206
   80   HD23  LEU  10          3HD2      LEU  10  -6.352   0.390  -3.106
   81    H    CYS  11           HN       CYS  11  -6.736  -5.404  -1.127
   82    HA   CYS  11           HA       CYS  11  -4.668  -7.336  -1.955
   83    HB2  CYS  11          2HB       CYS  11  -4.727  -8.209   0.359
   84    HB3  CYS  11          3HB       CYS  11  -4.217  -6.526   0.294
   85    H    LEU  12           HN       LEU  12  -7.787  -6.728  -2.341
   86    HA   LEU  12           HA       LEU  12  -9.635  -7.953  -2.846
   87    HB2  LEU  12          2HB       LEU  12  -7.862 -10.374  -2.924
   88    HB3  LEU  12          3HB       LEU  12  -9.337 -10.066  -3.840
   89    HG   LEU  12           HG       LEU  12  -6.568  -9.023  -4.310
   90   HD11  LEU  12          1HD1      LEU  12  -6.979 -10.962  -5.536
   91   HD12  LEU  12          2HD1      LEU  12  -7.311  -9.659  -6.677
   92   HD13  LEU  12          3HD1      LEU  12  -8.645 -10.501  -5.888
   93   HD21  LEU  12          1HD2      LEU  12  -9.158  -7.802  -5.238
   94   HD22  LEU  12          2HD2      LEU  12  -7.610  -7.518  -6.033
   95   HD23  LEU  12          3HD2      LEU  12  -7.846  -7.021  -4.356
   96    H    GLY  13           HN       GLY  13  -8.755  -7.679  -0.046
   97    HA2  GLY  13          1HA       GLY  13  -9.698 -10.175   1.162
   98    HA3  GLY  13          2HA       GLY  13  -8.947  -8.833   2.013
   99    H    GLU  14           HN       GLU  14 -10.620  -8.874   3.570
  100    HA   GLU  14           HA       GLU  14 -13.015  -7.446   2.685
  101    HB2  GLU  14          2HB       GLU  14 -14.115  -9.055   4.569
  102    HB3  GLU  14          3HB       GLU  14 -14.180  -9.375   2.841
  103    HG2  GLU  14          2HG       GLU  14 -11.795 -10.380   4.244
  104    HG3  GLU  14          3HG       GLU  14 -13.324 -11.149   4.663
  105    H    TYR  15           HN       TYR  15 -12.000  -8.952   5.745
  106    HA   TYR  15           HA       TYR  15 -11.695  -8.101   7.831
  107    HB2  TYR  15          2HB       TYR  15 -10.995  -5.467   6.551
  108    HB3  TYR  15          3HB       TYR  15 -10.373  -6.157   8.047
  109    HD1  TYR  15          1HD       TYR  15 -10.117  -6.155   4.399
  110    HD2  TYR  15          2HD       TYR  15  -8.640  -7.869   8.002
  111    HE1  TYR  15          1HE       TYR  15  -8.195  -7.072   3.168
  112    HE2  TYR  15          2HE       TYR  15  -6.713  -8.790   6.782
  113    HH   TYR  15           HH       TYR  15  -5.765  -9.086   4.792
  114    HA   PRO  16           HA       PRO  16 -15.452  -6.131   8.977
  115    HB2  PRO  16          2HB       PRO  16 -14.814  -5.313  11.485
  116    HB3  PRO  16          3HB       PRO  16 -15.109  -7.006  11.074
  117    HG2  PRO  16          2HG       PRO  16 -12.507  -5.560  11.394
  118    HG3  PRO  16          3HG       PRO  16 -12.969  -7.173  11.969
  119    HD2  PRO  16          2HD       PRO  16 -11.479  -6.792   9.739
  120    HD3  PRO  16          3HD       PRO  16 -12.616  -8.145   9.909
  121    H    VAL  17           HN       VAL  17 -16.221  -4.022  10.083
  122    HA   VAL  17           HA       VAL  17 -15.076  -1.832   8.607
  123    HB   VAL  17           HB       VAL  17 -17.522  -2.257  10.225
  124   HG11  VAL  17          1HG1      VAL  17 -16.320   0.478   9.812
  125   HG12  VAL  17          2HG1      VAL  17 -17.969   0.165  10.356
  126   HG13  VAL  17          3HG1      VAL  17 -16.602  -0.325  11.356
  127   HG21  VAL  17          1HG2      VAL  17 -18.608  -1.596   8.319
  128   HG22  VAL  17          2HG2      VAL  17 -17.318  -0.498   7.830
  129   HG23  VAL  17          3HG2      VAL  17 -17.120  -2.238   7.623
  130    H    GLU  18           HN       GLU  18 -14.546  -3.193  11.650
  131    HA   GLU  18           HA       GLU  18 -13.634  -0.686  12.844
  132    HB2  GLU  18          2HB       GLU  18 -14.758  -3.062  13.881
  133    HB3  GLU  18          3HB       GLU  18 -13.104  -2.991  14.477
  134    HG2  GLU  18          2HG       GLU  18 -13.476  -1.095  15.702
  135    HG3  GLU  18          3HG       GLU  18 -14.792  -0.551  14.664
  136    H    GLN  19           HN       GLN  19 -12.401  -2.905  10.794
  137    HA   GLN  19           HA       GLN  19  -9.692  -2.760  11.934
  138    HB2  GLN  19          2HB       GLN  19 -11.086  -4.764  10.227
  139    HB3  GLN  19          3HB       GLN  19  -9.354  -4.553  10.001
  140    HG2  GLN  19          2HG       GLN  19  -9.090  -4.928  12.467
  141    HG3  GLN  19          3HG       GLN  19 -10.793  -5.380  12.505
  142   HE21  GLN  19          1HE2      GLN  19 -10.783  -7.499  12.842
  143   HE22  GLN  19          2HE2      GLN  19  -9.922  -8.662  11.897
  144    H    MET  20           HN       MET  20 -11.701  -1.613   9.440
  145    HA   MET  20           HA       MET  20  -9.458  -0.924   7.699
  146    HB2  MET  20          2HB       MET  20 -12.143   0.048   6.988
  147    HB3  MET  20          3HB       MET  20 -10.949  -0.787   6.003
  148    HG2  MET  20          2HG       MET  20 -11.685  -2.804   7.596
  149    HG3  MET  20          3HG       MET  20 -13.175  -1.864   7.608
  150    HE1  MET  20          1HE       MET  20 -10.830  -2.352   4.040
  151    HE2  MET  20          2HE       MET  20 -10.356  -3.089   5.571
  152    HE3  MET  20          3HE       MET  20 -11.094  -4.076   4.309
  153    H    THR  21           HN       THR  21  -9.586   1.356   6.731
  154    HA   THR  21           HA       THR  21 -10.421   3.351   8.707
  155    HB   THR  21           HB       THR  21  -7.622   3.082   7.608
  156    HG1  THR  21          1HG       THR  21  -8.595   3.312  10.279
  157   HG21  THR  21          1HG2      THR  21  -7.491   5.239   9.228
  158   HG22  THR  21          2HG2      THR  21  -9.100   5.459   8.541
  159   HG23  THR  21          3HG2      THR  21  -7.697   5.340   7.480
  160    H    THR  22           HN       THR  22 -11.144   5.227   7.840
  161    HA   THR  22           HA       THR  22 -11.761   5.312   5.076
  162    HB   THR  22           HB       THR  22 -11.888   7.542   7.118
  163    HG1  THR  22          1HG       THR  22 -13.350   5.310   6.806
  164   HG21  THR  22          1HG2      THR  22 -13.638   8.432   5.526
  165   HG22  THR  22          2HG2      THR  22 -13.044   7.263   4.348
  166   HG23  THR  22          3HG2      THR  22 -11.973   8.525   4.954
  167    H    ILE  23           HN       ILE  23 -11.214   7.195   3.660
  168    HA   ILE  23           HA       ILE  23  -8.355   7.457   3.503
  169    HB   ILE  23           HB       ILE  23 -10.580   8.555   1.788
  170   HG12  ILE  23          2HG1      ILE  23 -10.276   6.167   1.563
  171   HG13  ILE  23          3HG1      ILE  23  -9.629   6.954   0.128
  172   HG21  ILE  23          1HG2      ILE  23  -8.096   8.682   0.443
  173   HG22  ILE  23          2HG2      ILE  23  -9.167  10.008   0.892
  174   HG23  ILE  23          3HG2      ILE  23  -7.900   9.485   2.000
  175   HD11  ILE  23          1HD1      ILE  23  -8.037   5.357   0.629
  176   HD12  ILE  23          2HD1      ILE  23  -7.369   6.820   1.354
  177   HD13  ILE  23          3HD1      ILE  23  -8.173   5.620   2.367
  178    H    ALA  24           HN       ALA  24 -10.534  10.135   2.835
  179    HA   ALA  24           HA       ALA  24 -10.355  11.746   4.992
  180    HB1  ALA  24          1HB       ALA  24  -7.735  11.602   3.609
  181    HB2  ALA  24          2HB       ALA  24  -8.270  13.178   4.193
  182    HB3  ALA  24          3HB       ALA  24  -8.105  11.830   5.318
  183    H    GLN  25           HN       GLN  25 -10.267  11.394   1.578
  184    HA   GLN  25           HA       GLN  25 -11.579  14.015   1.282
  185    HB2  GLN  25          2HB       GLN  25  -9.344  12.821  -0.219
  186    HB3  GLN  25          3HB       GLN  25 -10.608  13.529  -1.216
  187    HG2  GLN  25          2HG       GLN  25  -8.579  14.960  -0.435
  188    HG3  GLN  25          3HG       GLN  25 -10.200  15.653  -0.474
  189   HE21  GLN  25          1HE2      GLN  25 -10.521  16.916   1.199
  190   HE22  GLN  25          2HE2      GLN  25  -9.996  16.622   2.819
  191    H    CYS  26           HN       CYS  26 -11.150  10.896  -0.399
  192    HA   CYS  26           HA       CYS  26 -13.723  11.132  -1.675
  193    HB2  CYS  26          2HB       CYS  26 -13.195   8.904  -2.614
  194    HB3  CYS  26          3HB       CYS  26 -11.896  10.064  -2.875
  195    H    GLN  27           HN       GLN  27 -12.383   9.535   1.120
  196    HA   GLN  27           HA       GLN  27 -13.444   8.612   2.927
  197    HB2  GLN  27          2HB       GLN  27 -16.079   8.783   1.493
  198    HB3  GLN  27          3HB       GLN  27 -15.768   8.795   3.223
  199    HG2  GLN  27          2HG       GLN  27 -14.506  11.012   1.827
  200    HG3  GLN  27          3HG       GLN  27 -16.260  10.987   1.650
  201   HE21  GLN  27          1HE2      GLN  27 -13.611  11.160   3.916
  202   HE22  GLN  27          2HE2      GLN  27 -14.525  11.795   5.238
  203    H    CYS  28           HN       CYS  28 -12.203   7.001   1.154
  204    HA   CYS  28           HA       CYS  28 -14.004   4.826   0.440
  205    HB2  CYS  28          2HB       CYS  28 -11.089   5.379  -0.086
  206    HB3  CYS  28          3HB       CYS  28 -11.806   3.809  -0.428
  207    H    ILE  29           HN       ILE  29 -12.806   2.557   0.817
  208    HA   ILE  29           HA       ILE  29 -12.039   2.453   3.661
  209    HB   ILE  29           HB       ILE  29 -14.418   1.551   2.828
  210   HG12  ILE  29          2HG1      ILE  29 -12.969  -0.192   4.778
  211   HG13  ILE  29          3HG1      ILE  29 -13.137   1.523   5.140
  212   HG21  ILE  29          1HG2      ILE  29 -14.404  -0.802   2.387
  213   HG22  ILE  29          2HG2      ILE  29 -13.325  -0.020   1.234
  214   HG23  ILE  29          3HG2      ILE  29 -12.658  -0.884   2.618
  215   HD11  ILE  29          1HD1      ILE  29 -14.948  -0.440   5.744
  216   HD12  ILE  29          2HD1      ILE  29 -15.275   1.293   5.702
  217   HD13  ILE  29          3HD1      ILE  29 -15.631   0.294   4.293
  218    H    PHE  30           HN       PHE  30 -10.204   1.408   4.085
  219    HA   PHE  30           HA       PHE  30  -9.278  -0.747   2.389
  220    HB2  PHE  30          2HB       PHE  30  -7.682   1.802   2.706
  221    HB3  PHE  30          3HB       PHE  30  -7.053   0.306   2.024
  222    HD1  PHE  30          1HD       PHE  30  -8.926   3.308   1.405
  223    HD2  PHE  30          2HD       PHE  30  -8.052  -0.577  -0.096
  224    HE1  PHE  30          1HE       PHE  30  -9.738   3.988  -0.816
  225    HE2  PHE  30          2HE       PHE  30  -8.861   0.096  -2.320
  226    HZ   PHE  30           HZ       PHE  30  -9.705   2.381  -2.682
  227    H    CYS  31           HN       CYS  31  -8.229  -2.246   3.546
  228    HA   CYS  31           HA       CYS  31  -8.108  -2.129   6.335
  229    HB2  CYS  31          2HB       CYS  31  -7.035  -4.243   6.252
  230    HB3  CYS  31          3HB       CYS  31  -8.114  -4.199   4.862
  231    H    THR  32           HN       THR  32  -6.674  -1.331   7.731
  232    HA   THR  32           HA       THR  32  -4.810   0.519   7.307
  233    HB   THR  32           HB       THR  32  -4.320  -1.728   9.269
  234    HG1  THR  32          1HG       THR  32  -5.878   0.642   9.577
  235   HG21  THR  32          1HG2      THR  32  -2.483  -0.055   8.902
  236   HG22  THR  32          2HG2      THR  32  -3.108  -0.112  10.551
  237   HG23  THR  32          3HG2      THR  32  -3.593   1.192   9.468
  238    H    LEU  33           HN       LEU  33  -4.057  -2.963   7.263
  239    HA   LEU  33           HA       LEU  33  -1.407  -3.025   6.812
  240    HB2  LEU  33          2HB       LEU  33  -3.663  -4.666   5.960
  241    HB3  LEU  33          3HB       LEU  33  -2.268  -4.793   4.890
  242    HG   LEU  33           HG       LEU  33  -2.606  -6.422   6.941
  243   HD11  LEU  33          1HD1      LEU  33  -0.783  -6.608   5.397
  244   HD12  LEU  33          2HD1      LEU  33  -0.135  -6.671   7.036
  245   HD13  LEU  33          3HD1      LEU  33   0.010  -5.191   6.087
  246   HD21  LEU  33          1HD2      LEU  33  -0.756  -4.629   8.353
  247   HD22  LEU  33          2HD2      LEU  33  -2.015  -5.692   8.983
  248   HD23  LEU  33          3HD2      LEU  33  -2.440  -4.105   8.337
  249    H    CYS  34           HN       CYS  34  -3.631  -3.004   4.024
  250    HA   CYS  34           HA       CYS  34  -1.685  -2.281   2.145
  251    HB2  CYS  34          2HB       CYS  34  -4.651  -1.715   1.977
  252    HB3  CYS  34          3HB       CYS  34  -3.524  -1.852   0.630
  253    H    LEU  35           HN       LEU  35  -4.321  -0.215   3.379
  254    HA   LEU  35           HA       LEU  35  -3.512   2.187   2.342
  255    HB2  LEU  35          2HB       LEU  35  -5.569   1.555   3.785
  256    HB3  LEU  35          3HB       LEU  35  -4.558   2.041   5.144
  257    HG   LEU  35           HG       LEU  35  -4.336   4.288   4.098
  258   HD11  LEU  35          1HD1      LEU  35  -4.797   4.377   1.914
  259   HD12  LEU  35          2HD1      LEU  35  -6.483   4.486   2.420
  260   HD13  LEU  35          3HD1      LEU  35  -5.798   2.926   1.967
  261   HD21  LEU  35          1HD2      LEU  35  -6.265   5.059   5.056
  262   HD22  LEU  35          2HD2      LEU  35  -6.202   3.439   5.752
  263   HD23  LEU  35          3HD2      LEU  35  -7.254   3.768   4.374
  264    H    LYS  36           HN       LYS  36  -1.963   0.341   4.770
  265    HA   LYS  36           HA       LYS  36  -0.441   2.588   5.817
  266    HB2  LYS  36          2HB       LYS  36  -1.063   0.972   7.452
  267    HB3  LYS  36          3HB       LYS  36  -0.485  -0.359   6.458
  268    HG2  LYS  36          2HG       LYS  36   1.651   1.488   6.970
  269    HG3  LYS  36          3HG       LYS  36   0.893   0.990   8.484
  270    HD2  LYS  36          2HD       LYS  36   1.052  -1.400   7.396
  271    HD3  LYS  36          3HD       LYS  36   2.334  -0.643   6.447
  272    HE2  LYS  36          2HE       LYS  36   3.577  -0.107   8.398
  273    HE3  LYS  36          3HE       LYS  36   2.224  -0.516   9.452
  274    HZ1  LYS  36          1HZ       LYS  36   3.925  -2.360   7.881
  275    HZ2  LYS  36          2HZ       LYS  36   2.450  -2.841   8.552
  276    HZ3  LYS  36          3HZ       LYS  36   3.706  -2.317   9.557
  277    H    GLN  37           HN       GLN  37   0.595  -0.624   4.675
  278    HA   GLN  37           HA       GLN  37   3.200  -0.062   4.106
  279    HB2  GLN  37          2HB       GLN  37   1.392  -2.146   3.504
  280    HB3  GLN  37          3HB       GLN  37   2.182  -1.718   1.992
  281    HG2  GLN  37          2HG       GLN  37   4.159  -2.549   2.639
  282    HG3  GLN  37          3HG       GLN  37   3.980  -1.972   4.295
  283   HE21  GLN  37          1HE2      GLN  37   3.267  -3.335   5.837
  284   HE22  GLN  37          2HE2      GLN  37   2.859  -4.992   5.562
  285    H    TYR  38           HN       TYR  38   0.431   1.101   2.448
  286    HA   TYR  38           HA       TYR  38   1.832   1.776   0.013
  287    HB2  TYR  38          2HB       TYR  38  -0.306   1.586  -0.663
  288    HB3  TYR  38          3HB       TYR  38  -0.933   1.812   0.966
  289    HD1  TYR  38          1HD       TYR  38   1.059   4.093  -1.216
  290    HD2  TYR  38          2HD       TYR  38  -2.611   3.407   0.825
  291    HE1  TYR  38          1HE       TYR  38   0.304   6.353  -1.828
  292    HE2  TYR  38          2HE       TYR  38  -3.377   5.664   0.218
  293    HH   TYR  38           HH       TYR  38  -1.367   7.815  -1.770
  294    H    VAL  39           HN       VAL  39   0.235   3.668   2.584
  295    HA   VAL  39           HA       VAL  39   1.399   6.131   1.726
  296    HB   VAL  39           HB       VAL  39   0.437   7.105   3.727
  297   HG11  VAL  39          1HG1      VAL  39  -1.020   5.629   1.774
  298   HG12  VAL  39          2HG1      VAL  39  -1.882   5.541   3.311
  299   HG13  VAL  39          3HG1      VAL  39  -1.481   7.110   2.611
  300   HG21  VAL  39          1HG2      VAL  39   0.067   4.243   4.567
  301   HG22  VAL  39          2HG2      VAL  39   0.909   5.536   5.420
  302   HG23  VAL  39          3HG2      VAL  39  -0.849   5.565   5.289
  303    H    GLU  40           HN       GLU  40   1.955   4.027   4.549
  304    HA   GLU  40           HA       GLU  40   3.870   5.325   5.921
  305    HB2  GLU  40          2HB       GLU  40   2.996   2.707   5.813
  306    HB3  GLU  40          3HB       GLU  40   4.707   2.568   5.432
  307    HG2  GLU  40          2HG       GLU  40   4.396   4.342   7.638
  308    HG3  GLU  40          3HG       GLU  40   3.493   2.861   7.957
  309    H    LEU  41           HN       LEU  41   4.250   3.888   2.760
  310    HA   LEU  41           HA       LEU  41   7.120   4.259   2.730
  311    HB2  LEU  41          2HB       LEU  41   5.083   3.152   0.869
  312    HB3  LEU  41          3HB       LEU  41   6.612   3.710   0.191
  313    HG   LEU  41           HG       LEU  41   6.490   1.256   0.665
  314   HD11  LEU  41          1HD1      LEU  41   8.670   1.805   0.457
  315   HD12  LEU  41          2HD1      LEU  41   8.693   1.450   2.185
  316   HD13  LEU  41          3HD1      LEU  41   8.566   3.119   1.629
  317   HD21  LEU  41          1HD2      LEU  41   6.715   2.057   3.556
  318   HD22  LEU  41          2HD2      LEU  41   6.537   0.437   2.882
  319   HD23  LEU  41          3HD2      LEU  41   5.191   1.575   2.808
  320    H    LEU  42           HN       LEU  42   4.260   5.809   1.368
  321    HA   LEU  42           HA       LEU  42   5.870   7.788  -0.021
  322    HB2  LEU  42          2HB       LEU  42   2.965   7.130   0.120
  323    HB3  LEU  42          3HB       LEU  42   3.460   8.729  -0.431
  324    HG   LEU  42           HG       LEU  42   4.601   6.283  -1.722
  325   HD11  LEU  42          1HD1      LEU  42   1.895   7.493  -2.236
  326   HD12  LEU  42          2HD1      LEU  42   2.274   5.819  -1.830
  327   HD13  LEU  42          3HD1      LEU  42   2.747   6.474  -3.397
  328   HD21  LEU  42          1HD2      LEU  42   4.400   9.176  -2.264
  329   HD22  LEU  42          2HD2      LEU  42   4.209   8.108  -3.655
  330   HD23  LEU  42          3HD2      LEU  42   5.674   8.026  -2.675
  331    H    ILE  43           HN       ILE  43   3.150   7.997   2.281
  332    HA   ILE  43           HA       ILE  43   3.225  10.584   3.009
  333    HB   ILE  43           HB       ILE  43   2.158   8.284   4.149
  334   HG12  ILE  43          2HG1      ILE  43   1.235  10.244   5.778
  335   HG13  ILE  43          3HG1      ILE  43   1.902  11.214   4.469
  336   HG21  ILE  43          1HG2      ILE  43   4.111   8.164   5.640
  337   HG22  ILE  43          2HG2      ILE  43   3.739   9.782   6.235
  338   HG23  ILE  43          3HG2      ILE  43   2.612   8.455   6.524
  339   HD11  ILE  43          1HD1      ILE  43   0.123  10.810   3.227
  340   HD12  ILE  43          2HD1      ILE  43   0.372   9.069   3.373
  341   HD13  ILE  43          3HD1      ILE  43  -0.586   9.927   4.579
  342    H    LYS  44           HN       LYS  44   5.684   8.237   3.675
  343    HA   LYS  44           HA       LYS  44   7.016   9.753   5.711
  344    HB2  LYS  44          2HB       LYS  44   7.231   7.151   4.592
  345    HB3  LYS  44          3HB       LYS  44   8.798   7.931   4.412
  346    HG2  LYS  44          2HG       LYS  44   8.655   6.670   6.491
  347    HG3  LYS  44          3HG       LYS  44   8.865   8.395   6.795
  348    HD2  LYS  44          2HD       LYS  44   7.182   7.981   8.272
  349    HD3  LYS  44          3HD       LYS  44   6.207   8.314   6.839
  350    HE2  LYS  44          2HE       LYS  44   5.370   6.255   6.861
  351    HE3  LYS  44          3HE       LYS  44   6.984   5.548   6.893
  352    HZ1  LYS  44          1HZ       LYS  44   5.214   6.225   9.144
  353    HZ2  LYS  44          2HZ       LYS  44   6.887   6.181   9.382
  354    HZ3  LYS  44          3HZ       LYS  44   6.071   4.797   8.851
  355    H    GLU  45           HN       GLU  45   7.498   9.224   2.240
  356    HA   GLU  45           HA       GLU  45   9.810  10.923   2.124
  357    HB2  GLU  45          2HB       GLU  45   8.884   8.943   0.523
  358    HB3  GLU  45          3HB       GLU  45   8.326  10.351  -0.368
  359    HG2  GLU  45          2HG       GLU  45  10.380  10.881  -1.055
  360    HG3  GLU  45          3HG       GLU  45  11.097  10.553   0.520
  361    H    GLY  46           HN       GLY  46   6.441  11.194   0.999
  362    HA2  GLY  46          1HA       GLY  46   5.221  13.028   0.326
  363    HA3  GLY  46          2HA       GLY  46   5.981  13.797   1.712
  364    H    LEU  47           HN       LEU  47   7.049  12.779  -1.538
  365    HA   LEU  47           HA       LEU  47   8.611  15.222  -1.767
  366    HB2  LEU  47          2HB       LEU  47   9.470  14.221  -3.831
  367    HB3  LEU  47          3HB       LEU  47   9.663  13.159  -2.439
  368    HG   LEU  47           HG       LEU  47   7.317  12.803  -4.259
  369   HD11  LEU  47          1HD1      LEU  47  10.167  12.165  -4.851
  370   HD12  LEU  47          2HD1      LEU  47   8.884  12.710  -5.931
  371   HD13  LEU  47          3HD1      LEU  47   8.907  11.041  -5.362
  372   HD21  LEU  47          1HD2      LEU  47   8.365  10.365  -3.488
  373   HD22  LEU  47          2HD2      LEU  47   6.988  11.191  -2.757
  374   HD23  LEU  47          3HD2      LEU  47   8.601  11.391  -2.073
  375    H    GLU  48           HN       GLU  48   5.614  13.910  -2.850
  376    HA   GLU  48           HA       GLU  48   4.467  16.218  -3.710
  377    HB2  GLU  48          2HB       GLU  48   4.654  15.856  -6.273
  378    HB3  GLU  48          3HB       GLU  48   5.959  16.678  -5.429
  379    HG2  GLU  48          2HG       GLU  48   7.371  14.825  -5.560
  380    HG3  GLU  48          3HG       GLU  48   6.044  13.727  -5.932
  381    H    THR  49           HN       THR  49   4.843  12.803  -4.098
  382    HA   THR  49           HA       THR  49   2.756  11.943  -5.579
  383    HB   THR  49           HB       THR  49   3.428  10.822  -2.851
  384    HG1  THR  49          1HG       THR  49   4.718  10.736  -5.322
  385   HG21  THR  49          1HG2      THR  49   1.438  10.092  -4.704
  386   HG22  THR  49          2HG2      THR  49   1.966   9.196  -3.280
  387   HG23  THR  49          3HG2      THR  49   2.716   8.885  -4.845
  388    H    ALA  50           HN       ALA  50   2.551  13.643  -2.563
  389    HA   ALA  50           HA       ALA  50   0.802  14.429  -1.334
  390    HB1  ALA  50          1HB       ALA  50   0.145  15.657  -3.221
  391    HB2  ALA  50          2HB       ALA  50  -0.446  14.220  -4.056
  392    HB3  ALA  50          3HB       ALA  50  -1.326  14.856  -2.668
  393    H    ILE  51           HN       ILE  51   1.135  11.385  -1.979
  394    HA   ILE  51           HA       ILE  51  -0.057   9.424  -1.674
  395    HB   ILE  51           HB       ILE  51  -0.648  10.991   0.840
  396   HG12  ILE  51          2HG1      ILE  51   1.284   9.805   1.754
  397   HG13  ILE  51          3HG1      ILE  51   1.502   8.948   0.233
  398   HG21  ILE  51          1HG2      ILE  51  -2.135   8.993   0.409
  399   HG22  ILE  51          2HG2      ILE  51  -0.686   8.000   0.538
  400   HG23  ILE  51          3HG2      ILE  51  -1.218   8.965   1.914
  401   HD11  ILE  51          1HD1      ILE  51   2.903  11.102   0.878
  402   HD12  ILE  51          2HD1      ILE  51   2.459  10.726  -0.786
  403   HD13  ILE  51          3HD1      ILE  51   1.520  11.903   0.133
  404    H    SER  52           HN       SER  52  -1.648   9.568  -3.302
  405    HA   SER  52           HA       SER  52  -4.269  10.595  -2.470
  406    HB2  SER  52          2HB       SER  52  -4.412  11.352  -4.572
  407    HB3  SER  52          3HB       SER  52  -2.842  10.639  -4.942
  408    HG   SER  52           HG       SER  52  -5.020   9.940  -6.035
  409    H    CYS  53           HN       CYS  53  -6.180   9.321  -2.964
  410    HA   CYS  53           HA       CYS  53  -6.409   6.933  -1.808
  411    HB2  CYS  53          2HB       CYS  53  -8.320   8.125  -2.772
  412    HB3  CYS  53          3HB       CYS  53  -7.788   7.690  -4.393
  413    HA   PRO  54           HA       PRO  54  -3.890   4.039  -3.994
  414    HB2  PRO  54          2HB       PRO  54  -4.917   1.770  -2.917
  415    HB3  PRO  54          3HB       PRO  54  -3.835   2.850  -2.029
  416    HG2  PRO  54          2HG       PRO  54  -6.820   2.646  -1.918
  417    HG3  PRO  54          3HG       PRO  54  -5.661   2.830  -0.589
  418    HD2  PRO  54          2HD       PRO  54  -7.084   4.910  -1.578
  419    HD3  PRO  54          3HD       PRO  54  -5.445   5.100  -0.923
  420    H    ASP  55           HN       ASP  55  -7.063   4.656  -4.610
  421    HA   ASP  55           HA       ASP  55  -7.267   2.496  -6.603
  422    HB2  ASP  55          2HB       ASP  55  -9.168   3.541  -4.702
  423    HB3  ASP  55          3HB       ASP  55  -9.782   3.732  -6.341
  424    H    ALA  56           HN       ALA  56  -5.924   3.773  -8.029
  425    HA   ALA  56           HA       ALA  56  -6.281   6.333  -8.897
  426    HB1  ALA  56          1HB       ALA  56  -5.657   3.984 -10.682
  427    HB2  ALA  56          2HB       ALA  56  -5.275   5.677 -10.998
  428    HB3  ALA  56          3HB       ALA  56  -4.489   4.829  -9.666
  429    H    ALA  57           HN       ALA  57  -8.432   3.688  -9.327
  430    HA   ALA  57           HA       ALA  57  -9.916   5.047 -11.450
  431    HB1  ALA  57          1HB       ALA  57 -10.081   2.296 -10.258
  432    HB2  ALA  57          2HB       ALA  57 -11.342   2.933 -11.316
  433    HB3  ALA  57          3HB       ALA  57  -9.692   2.761 -11.915
  434    H    CYS  58           HN       CYS  58  -9.763   6.005  -8.624
  435    HA   CYS  58           HA       CYS  58 -12.371   5.549  -7.498
  436    HB2  CYS  58          2HB       CYS  58 -10.287   6.031  -6.156
  437    HB3  CYS  58          3HB       CYS  58 -10.381   7.691  -6.735
  438    HA   PRO  59           HA       PRO  59 -14.496   8.647  -9.825
  439    HB2  PRO  59          2HB       PRO  59 -16.715   8.802  -8.269
  440    HB3  PRO  59          3HB       PRO  59 -16.403   7.451  -9.365
  441    HG2  PRO  59          2HG       PRO  59 -15.962   7.631  -6.411
  442    HG3  PRO  59          3HG       PRO  59 -16.642   6.297  -7.361
  443    HD2  PRO  59          2HD       PRO  59 -14.079   6.305  -6.488
  444    HD3  PRO  59          3HD       PRO  59 -14.566   5.536  -8.012
  445    H    LYS  60           HN       LYS  60 -13.348   9.002  -6.638
  446    HA   LYS  60           HA       LYS  60 -13.866  11.900  -6.748
  447    HB2  LYS  60          2HB       LYS  60 -13.532  10.396  -4.165
  448    HB3  LYS  60          3HB       LYS  60 -14.215  11.997  -4.423
  449    HG2  LYS  60          2HG       LYS  60 -15.964  10.581  -5.846
  450    HG3  LYS  60          3HG       LYS  60 -15.460   9.330  -4.707
  451    HD2  LYS  60          2HD       LYS  60 -16.311  10.452  -2.889
  452    HD3  LYS  60          3HD       LYS  60 -16.159  12.033  -3.661
  453    HE2  LYS  60          2HE       LYS  60 -17.970  11.124  -5.284
  454    HE3  LYS  60          3HE       LYS  60 -18.278   9.947  -4.008
  455    HZ1  LYS  60          1HZ       LYS  60 -19.465  12.315  -4.124
  456    HZ2  LYS  60          2HZ       LYS  60 -18.128  12.727  -3.175
  457    HZ3  LYS  60          3HZ       LYS  60 -19.176  11.500  -2.670
  458    H    GLN  61           HN       GLN  61 -11.604   9.347  -6.351
  459    HA   GLN  61           HA       GLN  61  -9.388   9.317  -5.685
  460    HB2  GLN  61          2HB       GLN  61  -9.172  11.699  -7.504
  461    HB3  GLN  61          3HB       GLN  61  -8.043  10.367  -7.302
  462    HG2  GLN  61          2HG       GLN  61  -9.674   8.857  -8.356
  463    HG3  GLN  61          3HG       GLN  61 -10.748  10.232  -8.614
  464   HE21  GLN  61          1HE2      GLN  61  -7.597   8.894  -9.410
  465   HE22  GLN  61          2HE2      GLN  61  -7.418   9.723 -10.916
  466    H    GLY  62           HN       GLY  62 -10.030  10.133  -3.489
  467    HA2  GLY  62          1HA       GLY  62  -9.451  12.921  -2.942
  468    HA3  GLY  62          2HA       GLY  62  -9.934  11.705  -1.770
  469    H    HIS  63           HN       HIS  63  -7.791  13.702  -1.625
  470    HA   HIS  63           HA       HIS  63  -5.361  12.093  -1.726
  471    HB2  HIS  63          2HB       HIS  63  -5.850  15.011  -1.116
  472    HB3  HIS  63          3HB       HIS  63  -4.264  14.252  -1.012
  473    HD1  HIS  63          1HD       HIS  63  -6.766  15.531  -3.444
  474    HD2  HIS  63          2HD       HIS  63  -3.104  13.568  -3.497
  475    HE1  HIS  63          1HE       HIS  63  -5.955  15.685  -5.820
  476    H    LEU  64           HN       LEU  64  -3.893  12.094   0.151
  477    HA   LEU  64           HA       LEU  64  -5.418  11.922   2.666
  478    HB2  LEU  64          2HB       LEU  64  -3.135  10.322   1.577
  479    HB3  LEU  64          3HB       LEU  64  -3.419  10.404   3.313
  480    HG   LEU  64           HG       LEU  64  -5.612   9.554   1.460
  481   HD11  LEU  64          1HD1      LEU  64  -4.291   7.876   0.767
  482   HD12  LEU  64          2HD1      LEU  64  -4.632   7.198   2.358
  483   HD13  LEU  64          3HD1      LEU  64  -3.139   8.096   2.084
  484   HD21  LEU  64          1HD2      LEU  64  -5.045   9.532   4.352
  485   HD22  LEU  64          2HD2      LEU  64  -5.817   8.083   3.710
  486   HD23  LEU  64          3HD2      LEU  64  -6.581   9.659   3.494
  487    H    GLN  65           HN       GLN  65  -4.048  12.241   4.654
  488    HA   GLN  65           HA       GLN  65  -2.365  14.608   4.253
  489    HB2  GLN  65          2HB       GLN  65  -2.928  14.024   7.019
  490    HB3  GLN  65          3HB       GLN  65  -3.346  15.447   6.075
  491    HG2  GLN  65          2HG       GLN  65  -5.408  14.692   6.736
  492    HG3  GLN  65          3HG       GLN  65  -5.249  13.957   5.142
  493   HE21  GLN  65          1HE2      GLN  65  -3.199  12.091   6.343
  494   HE22  GLN  65          2HE2      GLN  65  -4.142  10.880   7.134
  495    H    GLU  66           HN       GLU  66  -0.541  14.860   5.859
  496    HA   GLU  66           HA       GLU  66   1.038  12.412   5.816
  497    HB2  GLU  66          2HB       GLU  66   1.616  15.312   5.943
  498    HB3  GLU  66          3HB       GLU  66   2.730  14.268   6.814
  499    HG2  GLU  66          2HG       GLU  66   3.719  13.624   4.942
  500    HG3  GLU  66          3HG       GLU  66   2.178  13.225   4.185
  501    H    ASN  67           HN       ASN  67   0.291  14.985   8.172
  502    HA   ASN  67           HA       ASN  67   1.352  13.682  10.409
  503    HB2  ASN  67          2HB       ASN  67   0.554  15.450  11.614
  504    HB3  ASN  67          3HB       ASN  67   0.371  16.143  10.005
  505   HD21  ASN  67          1HD2      ASN  67  -1.726  15.999   8.998
  506   HD22  ASN  67          2HD2      ASN  67  -3.144  15.981   9.984
  507    H    GLU  68           HN       GLU  68  -2.041  13.891   9.333
  508    HA   GLU  68           HA       GLU  68  -3.184  12.294  11.284
  509    HB2  GLU  68          2HB       GLU  68  -3.943  13.321   8.689
  510    HB3  GLU  68          3HB       GLU  68  -4.577  11.699   8.926
  511    HG2  GLU  68          2HG       GLU  68  -4.909  13.621  11.151
  512    HG3  GLU  68          3HG       GLU  68  -5.878  13.878   9.701
  513    H    ILE  69           HN       ILE  69  -2.130  11.262   8.034
  514    HA   ILE  69           HA       ILE  69  -2.575   8.525   8.407
  515    HB   ILE  69           HB       ILE  69  -0.743  10.039   6.568
  516   HG12  ILE  69          2HG1      ILE  69  -3.470   9.033   6.508
  517   HG13  ILE  69          3HG1      ILE  69  -2.682  10.195   5.447
  518   HG21  ILE  69          1HG2      ILE  69  -1.083   7.048   6.732
  519   HG22  ILE  69          2HG2      ILE  69  -0.298   7.904   5.407
  520   HG23  ILE  69          3HG2      ILE  69   0.397   7.960   7.026
  521   HD11  ILE  69          1HD1      ILE  69  -2.428   7.209   5.195
  522   HD12  ILE  69          2HD1      ILE  69  -3.547   8.211   4.270
  523   HD13  ILE  69          3HD1      ILE  69  -1.806   8.426   4.081
  524    H    GLU  70           HN       GLU  70   0.589  10.183   8.406
  525    HA   GLU  70           HA       GLU  70   2.161   8.126   9.298
  526    HB2  GLU  70          2HB       GLU  70   3.795   9.696   9.756
  527    HB3  GLU  70          3HB       GLU  70   2.751  10.587   8.656
  528    HG2  GLU  70          2HG       GLU  70   1.699  11.715  10.522
  529    HG3  GLU  70          3HG       GLU  70   2.669  10.779  11.659
  530    H    CYS  71           HN       CYS  71  -0.138   9.991  11.105
  531    HA   CYS  71           HA       CYS  71   0.811   9.394  13.706
  532    HB2  CYS  71          2HB       CYS  71  -0.709  11.007  14.059
  533    HB3  CYS  71          3HB       CYS  71  -1.501  10.693  12.520
  534    HG   CYS  71           HG       CYS  71  -2.272   9.535  15.599
  535    H    MET  72           HN       MET  72  -1.443   7.787  11.523
  536    HA   MET  72           HA       MET  72  -2.182   5.787  13.457
  537    HB2  MET  72          2HB       MET  72  -3.742   5.113  11.944
  538    HB3  MET  72          3HB       MET  72  -3.441   6.716  11.288
  539    HG2  MET  72          2HG       MET  72  -1.697   5.594   9.807
  540    HG3  MET  72          3HG       MET  72  -2.440   4.073  10.295
  541    HE1  MET  72          1HE       MET  72  -1.981   5.222   7.447
  542    HE2  MET  72          2HE       MET  72  -2.939   3.742   7.393
  543    HE3  MET  72          3HE       MET  72  -3.494   5.183   6.540
  544    H    VAL  73           HN       VAL  73   0.668   6.274  12.194
  545    HA   VAL  73           HA       VAL  73   1.315   3.424  12.104
  546    HB   VAL  73           HB       VAL  73   3.007   4.218  10.190
  547   HG11  VAL  73          1HG1      VAL  73   1.787   2.326   9.727
  548   HG12  VAL  73          2HG1      VAL  73   0.241   3.110  10.059
  549   HG13  VAL  73          3HG1      VAL  73   1.103   3.457   8.561
  550   HG21  VAL  73          1HG2      VAL  73   0.683   5.607   9.078
  551   HG22  VAL  73          2HG2      VAL  73   1.470   6.466  10.402
  552   HG23  VAL  73          3HG2      VAL  73   2.398   6.004   8.975
  553    H    ALA  74           HN       ALA  74   3.071   6.449  11.424
  554    HA   ALA  74           HA       ALA  74   5.147   5.620  13.301
  555    HB1  ALA  74          1HB       ALA  74   6.455   7.470  12.335
  556    HB2  ALA  74          2HB       ALA  74   5.888   6.333  11.110
  557    HB3  ALA  74          3HB       ALA  74   5.078   7.887  11.313
  558    H    ALA  75           HN       ALA  75   3.161   6.109  14.869
  559    HA   ALA  75           HA       ALA  75   2.199   8.465  15.656
  560    HB1  ALA  75          1HB       ALA  75   2.382   6.077  16.868
  561    HB2  ALA  75          2HB       ALA  75   3.475   7.015  17.888
  562    HB3  ALA  75          3HB       ALA  75   1.802   7.534  17.676
  Start of MODEL    7
    1    H1   ALA   1           HN       ALA   1 -28.338 -13.558  -0.502
    2    HA   ALA   1           HA       ALA   1 -26.573 -14.694  -2.334
    3    HB1  ALA   1          1HB       ALA   1 -26.947 -13.348  -4.337
    4    HB2  ALA   1          2HB       ALA   1 -28.345 -14.363  -3.978
    5    HB3  ALA   1          3HB       ALA   1 -28.384 -12.641  -3.598
    6    H    LEU   2           HN       LEU   2 -27.967 -11.612  -1.272
    7    HA   LEU   2           HA       LEU   2 -26.066  -9.783  -1.659
    8    HB2  LEU   2          2HB       LEU   2 -27.799 -10.354   0.677
    9    HB3  LEU   2          3HB       LEU   2 -26.516  -9.166   0.894
   10    HG   LEU   2           HG       LEU   2 -28.501  -7.977   0.361
   11   HD11  LEU   2          1HD1      LEU   2 -26.216  -7.652  -1.009
   12   HD12  LEU   2          2HD1      LEU   2 -27.632  -6.620  -1.216
   13   HD13  LEU   2          3HD1      LEU   2 -27.332  -7.941  -2.345
   14   HD21  LEU   2          1HD2      LEU   2 -29.445 -10.156  -0.798
   15   HD22  LEU   2          2HD2      LEU   2 -28.882  -9.337  -2.255
   16   HD23  LEU   2          3HD2      LEU   2 -30.061  -8.553  -1.202
   17    H    ASP   3           HN       ASP   3 -24.119  -9.103  -0.754
   18    HA   ASP   3           HA       ASP   3 -22.811 -10.316   1.408
   19    HB2  ASP   3          2HB       ASP   3 -20.977 -11.409  -0.132
   20    HB3  ASP   3          3HB       ASP   3 -22.423 -12.311   0.313
   21    HA   PRO   4           HA       PRO   4 -21.097  -6.362  -0.387
   22    HB2  PRO   4          2HB       PRO   4 -21.464  -4.884   1.860
   23    HB3  PRO   4          3HB       PRO   4 -22.709  -5.070   0.618
   24    HG2  PRO   4          2HG       PRO   4 -22.412  -6.500   3.231
   25    HG3  PRO   4          3HG       PRO   4 -23.875  -5.838   2.477
   26    HD2  PRO   4          2HD       PRO   4 -23.253  -8.472   2.387
   27    HD3  PRO   4          3HD       PRO   4 -24.125  -7.651   1.077
   28    H    LEU   5           HN       LEU   5 -19.311  -8.151   0.009
   29    HA   LEU   5           HA       LEU   5 -17.613  -7.222   2.232
   30    HB2  LEU   5          2HB       LEU   5 -17.082  -9.850   0.981
   31    HB3  LEU   5          3HB       LEU   5 -16.899  -9.336   2.656
   32    HG   LEU   5           HG       LEU   5 -19.569  -9.897   1.380
   33   HD11  LEU   5          1HD1      LEU   5 -19.388 -12.088   1.790
   34   HD12  LEU   5          2HD1      LEU   5 -18.526 -11.834   3.307
   35   HD13  LEU   5          3HD1      LEU   5 -17.649 -11.793   1.777
   36   HD21  LEU   5          1HD2      LEU   5 -20.089  -8.705   3.248
   37   HD22  LEU   5          2HD2      LEU   5 -18.605  -9.157   4.087
   38   HD23  LEU   5          3HD2      LEU   5 -19.940 -10.305   3.976
   39    H    VAL   6           HN       VAL   6 -15.235  -8.372   1.489
   40    HA   VAL   6           HA       VAL   6 -13.355  -7.740   0.341
   41    HB   VAL   6           HB       VAL   6 -14.779  -8.068  -2.246
   42   HG11  VAL   6          1HG1      VAL   6 -12.314  -7.846  -2.045
   43   HG12  VAL   6          2HG1      VAL   6 -12.290  -9.359  -1.137
   44   HG13  VAL   6          3HG1      VAL   6 -12.825  -9.346  -2.818
   45   HG21  VAL   6          1HG2      VAL   6 -14.559 -10.231  -0.166
   46   HG22  VAL   6          2HG2      VAL   6 -16.005  -9.676  -1.008
   47   HG23  VAL   6          3HG2      VAL   6 -14.760 -10.567  -1.885
   48    H    SER   7           HN       SER   7 -14.023  -5.470   1.139
   49    HA   SER   7           HA       SER   7 -14.878  -3.659  -0.953
   50    HB2  SER   7          2HB       SER   7 -15.281  -3.570   1.688
   51    HB3  SER   7          3HB       SER   7 -13.791  -2.629   1.621
   52    HG   SER   7           HG       SER   7 -16.294  -2.080   0.459
   53    H    CYS   8           HN       CYS   8 -12.053  -3.671   1.227
   54    HA   CYS   8           HA       CYS   8 -10.433  -1.853   0.150
   55    HB2  CYS   8          2HB       CYS   8  -9.887  -3.526   1.992
   56    HB3  CYS   8          3HB       CYS   8  -9.371  -4.621   0.714
   57    H    LYS   9           HN       LYS   9  -9.242  -1.481  -1.648
   58    HA   LYS   9           HA       LYS   9  -9.523  -3.424  -3.840
   59    HB2  LYS   9          2HB       LYS   9  -8.763  -0.539  -4.199
   60    HB3  LYS   9          3HB       LYS   9  -9.463  -1.644  -5.373
   61    HG2  LYS   9          2HG       LYS   9 -11.059  -1.006  -2.957
   62    HG3  LYS   9          3HG       LYS   9 -10.886   0.244  -4.192
   63    HD2  LYS   9          2HD       LYS   9 -11.515  -2.403  -5.267
   64    HD3  LYS   9          3HD       LYS   9 -12.763  -1.753  -4.202
   65    HE2  LYS   9          2HE       LYS   9 -12.193   0.425  -5.705
   66    HE3  LYS   9          3HE       LYS   9 -11.891  -0.864  -6.870
   67    HZ1  LYS   9          1HZ       LYS   9 -14.103  -1.706  -6.495
   68    HZ2  LYS   9          2HZ       LYS   9 -14.191  -0.073  -6.924
   69    HZ3  LYS   9          3HZ       LYS   9 -14.397  -0.535  -5.310
   70    H    LEU  10           HN       LEU  10  -7.433  -3.188  -1.627
   71    HA   LEU  10           HA       LEU  10  -5.056  -2.962  -3.348
   72    HB2  LEU  10          2HB       LEU  10  -5.348  -2.696  -0.361
   73    HB3  LEU  10          3HB       LEU  10  -3.801  -2.723  -1.204
   74    HG   LEU  10           HG       LEU  10  -5.692  -0.691  -2.169
   75   HD11  LEU  10          1HD1      LEU  10  -5.790   0.668  -0.334
   76   HD12  LEU  10          2HD1      LEU  10  -4.359  -0.044   0.410
   77   HD13  LEU  10          3HD1      LEU  10  -5.894  -0.912   0.446
   78   HD21  LEU  10          1HD2      LEU  10  -2.781  -0.976  -1.600
   79   HD22  LEU  10          2HD2      LEU  10  -3.480   0.641  -1.698
   80   HD23  LEU  10          3HD2      LEU  10  -3.596  -0.458  -3.075
   81    H    CYS  11           HN       CYS  11  -6.890  -5.045  -1.273
   82    HA   CYS  11           HA       CYS  11  -5.091  -7.257  -1.964
   83    HB2  CYS  11          2HB       CYS  11  -5.236  -8.174   0.291
   84    HB3  CYS  11          3HB       CYS  11  -4.549  -6.553   0.338
   85    H    LEU  12           HN       LEU  12  -8.032  -6.033  -2.309
   86    HA   LEU  12           HA       LEU  12 -10.188  -6.849  -2.440
   87    HB2  LEU  12          2HB       LEU  12  -8.597  -8.982  -3.856
   88    HB3  LEU  12          3HB       LEU  12 -10.328  -8.704  -4.046
   89    HG   LEU  12           HG       LEU  12  -9.569  -6.318  -4.797
   90   HD11  LEU  12          1HD1      LEU  12  -7.228  -7.487  -6.034
   91   HD12  LEU  12          2HD1      LEU  12  -7.085  -7.427  -4.278
   92   HD13  LEU  12          3HD1      LEU  12  -7.412  -5.951  -5.186
   93   HD21  LEU  12          1HD2      LEU  12 -10.736  -7.822  -6.253
   94   HD22  LEU  12          2HD2      LEU  12  -9.291  -8.809  -6.474
   95   HD23  LEU  12          3HD2      LEU  12  -9.349  -7.171  -7.127
   96    H    GLY  13           HN       GLY  13  -9.939  -7.302   0.008
   97    HA2  GLY  13          1HA       GLY  13 -10.727 -10.104   0.414
   98    HA3  GLY  13          2HA       GLY  13  -9.477  -9.416   1.439
   99    H    GLU  14           HN       GLU  14 -12.212 -10.466   2.029
  100    HA   GLU  14           HA       GLU  14 -13.776  -8.190   2.818
  101    HB2  GLU  14          2HB       GLU  14 -15.093 -10.008   4.076
  102    HB3  GLU  14          3HB       GLU  14 -15.070 -10.073   2.319
  103    HG2  GLU  14          2HG       GLU  14 -14.143 -12.084   2.324
  104    HG3  GLU  14          3HG       GLU  14 -12.878 -11.573   3.440
  105    H    TYR  15           HN       TYR  15 -13.549  -7.027   4.603
  106    HA   TYR  15           HA       TYR  15 -12.494  -8.268   7.027
  107    HB2  TYR  15          2HB       TYR  15 -11.378  -5.635   6.073
  108    HB3  TYR  15          3HB       TYR  15 -10.789  -6.658   7.378
  109    HD1  TYR  15          1HD       TYR  15  -9.638  -8.803   6.834
  110    HD2  TYR  15          2HD       TYR  15 -10.675  -5.976   3.828
  111    HE1  TYR  15          1HE       TYR  15  -8.060  -9.880   5.285
  112    HE2  TYR  15          2HE       TYR  15  -9.101  -7.046   2.271
  113    HH   TYR  15           HH       TYR  15  -6.975  -9.657   3.312
  114    HA   PRO  16           HA       PRO  16 -15.592  -5.856   8.998
  115    HB2  PRO  16          2HB       PRO  16 -14.513  -5.610  11.478
  116    HB3  PRO  16          3HB       PRO  16 -15.196  -7.125  10.873
  117    HG2  PRO  16          2HG       PRO  16 -12.334  -6.259  11.013
  118    HG3  PRO  16          3HG       PRO  16 -13.047  -7.834  11.409
  119    HD2  PRO  16          2HD       PRO  16 -11.779  -7.357   9.064
  120    HD3  PRO  16          3HD       PRO  16 -13.141  -8.486   9.200
  121    H    VAL  17           HN       VAL  17 -15.988  -3.797  10.080
  122    HA   VAL  17           HA       VAL  17 -14.494  -1.679   8.930
  123    HB   VAL  17           HB       VAL  17 -16.865  -1.910  10.665
  124   HG11  VAL  17          1HG1      VAL  17 -16.797   0.506  11.257
  125   HG12  VAL  17          2HG1      VAL  17 -15.589  -0.469  12.096
  126   HG13  VAL  17          3HG1      VAL  17 -15.114   0.542  10.730
  127   HG21  VAL  17          1HG2      VAL  17 -17.867  -0.624   9.035
  128   HG22  VAL  17          2HG2      VAL  17 -16.372   0.218   8.629
  129   HG23  VAL  17          3HG2      VAL  17 -16.615  -1.448   8.103
  130    H    GLU  18           HN       GLU  18 -14.190  -3.439  11.862
  131    HA   GLU  18           HA       GLU  18 -12.667  -1.371  13.213
  132    HB2  GLU  18          2HB       GLU  18 -12.543  -2.894  15.067
  133    HB3  GLU  18          3HB       GLU  18 -14.192  -2.902  14.455
  134    HG2  GLU  18          2HG       GLU  18 -14.077  -5.105  14.338
  135    HG3  GLU  18          3HG       GLU  18 -12.870  -4.932  13.065
  136    H    GLN  19           HN       GLN  19 -11.713  -2.484  10.661
  137    HA   GLN  19           HA       GLN  19  -8.997  -3.039  11.508
  138    HB2  GLN  19          2HB       GLN  19 -10.691  -5.017  10.014
  139    HB3  GLN  19          3HB       GLN  19  -8.947  -4.984   9.789
  140    HG2  GLN  19          2HG       GLN  19  -8.811  -5.161  12.341
  141    HG3  GLN  19          3HG       GLN  19 -10.507  -5.635  12.258
  142   HE21  GLN  19          1HE2      GLN  19 -10.786  -7.735  12.294
  143   HE22  GLN  19          2HE2      GLN  19  -9.730  -8.922  11.615
  144    H    MET  20           HN       MET  20 -10.783  -1.106   9.897
  145    HA   MET  20           HA       MET  20  -8.912  -0.861   7.644
  146    HB2  MET  20          2HB       MET  20 -11.603   0.111   7.047
  147    HB3  MET  20          3HB       MET  20 -10.522  -0.876   6.074
  148    HG2  MET  20          2HG       MET  20 -11.235  -2.714   7.853
  149    HG3  MET  20          3HG       MET  20 -12.660  -1.682   7.950
  150    HE1  MET  20          1HE       MET  20 -10.618  -2.234   4.416
  151    HE2  MET  20          2HE       MET  20 -10.196  -3.405   5.665
  152    HE3  MET  20          3HE       MET  20 -11.127  -3.916   4.256
  153    H    THR  21           HN       THR  21  -9.267   1.402   6.578
  154    HA   THR  21           HA       THR  21  -9.864   3.437   8.599
  155    HB   THR  21           HB       THR  21  -7.244   3.192   7.120
  156    HG1  THR  21          1HG       THR  21  -8.105   2.736   9.674
  157   HG21  THR  21          1HG2      THR  21  -8.271   5.542   8.716
  158   HG22  THR  21          2HG2      THR  21  -8.051   5.505   6.967
  159   HG23  THR  21          3HG2      THR  21  -6.653   5.379   8.034
  160    H    THR  22           HN       THR  22 -10.533   5.408   7.780
  161    HA   THR  22           HA       THR  22 -11.421   5.350   5.016
  162    HB   THR  22           HB       THR  22 -11.920   7.421   7.163
  163    HG1  THR  22          1HG       THR  22 -13.309   5.982   7.839
  164   HG21  THR  22          1HG2      THR  22 -12.714   8.689   5.509
  165   HG22  THR  22          2HG2      THR  22 -13.947   7.460   5.228
  166   HG23  THR  22          3HG2      THR  22 -12.432   7.410   4.329
  167    H    ILE  23           HN       ILE  23 -10.622   6.552   3.389
  168    HA   ILE  23           HA       ILE  23  -8.071   7.583   3.409
  169    HB   ILE  23           HB       ILE  23 -10.342   8.479   1.632
  170   HG12  ILE  23          2HG1      ILE  23  -9.929   6.023   1.644
  171   HG13  ILE  23          3HG1      ILE  23  -9.592   6.772   0.087
  172   HG21  ILE  23          1HG2      ILE  23  -8.105   9.822   1.797
  173   HG22  ILE  23          2HG2      ILE  23  -7.473   8.496   0.822
  174   HG23  ILE  23          3HG2      ILE  23  -8.818   9.468   0.223
  175   HD11  ILE  23          1HD1      ILE  23  -7.925   5.100   1.540
  176   HD12  ILE  23          2HD1      ILE  23  -7.496   6.061   0.124
  177   HD13  ILE  23          3HD1      ILE  23  -7.235   6.709   1.743
  178    H    ALA  24           HN       ALA  24 -11.103   9.223   4.122
  179    HA   ALA  24           HA       ALA  24 -11.441  11.100   5.418
  180    HB1  ALA  24          1HB       ALA  24  -9.781  11.922   6.695
  181    HB2  ALA  24          2HB       ALA  24  -8.895  10.513   6.107
  182    HB3  ALA  24          3HB       ALA  24  -8.670  12.084   5.335
  183    H    GLN  25           HN       GLN  25 -11.362  10.887   2.477
  184    HA   GLN  25           HA       GLN  25 -11.593  13.697   1.904
  185    HB2  GLN  25          2HB       GLN  25  -9.244  12.153   1.044
  186    HB3  GLN  25          3HB       GLN  25 -10.048  13.026  -0.253
  187    HG2  GLN  25          2HG       GLN  25  -8.559  14.602   0.444
  188    HG3  GLN  25          3HG       GLN  25  -9.949  15.017   1.446
  189   HE21  GLN  25          1HE2      GLN  25  -8.373  16.041   2.824
  190   HE22  GLN  25          2HE2      GLN  25  -7.501  15.093   3.974
  191    H    CYS  26           HN       CYS  26 -11.170  10.609   0.162
  192    HA   CYS  26           HA       CYS  26 -13.422  11.288  -1.560
  193    HB2  CYS  26          2HB       CYS  26 -12.748   9.084  -2.684
  194    HB3  CYS  26          3HB       CYS  26 -11.610  10.423  -2.793
  195    H    GLN  27           HN       GLN  27 -12.987   9.801   1.362
  196    HA   GLN  27           HA       GLN  27 -14.302   8.501   2.687
  197    HB2  GLN  27          2HB       GLN  27 -16.243   9.353   0.567
  198    HB3  GLN  27          3HB       GLN  27 -16.733   8.185   1.788
  199    HG2  GLN  27          2HG       GLN  27 -17.396  10.410   2.442
  200    HG3  GLN  27          3HG       GLN  27 -16.168   9.792   3.544
  201   HE21  GLN  27          1HE2      GLN  27 -14.754  11.262   4.115
  202   HE22  GLN  27          2HE2      GLN  27 -14.172  12.561   3.135
  203    H    CYS  28           HN       CYS  28 -12.643   6.904   1.726
  204    HA   CYS  28           HA       CYS  28 -14.101   4.723   0.384
  205    HB2  CYS  28          2HB       CYS  28 -11.222   5.583   0.179
  206    HB3  CYS  28          3HB       CYS  28 -11.738   3.967  -0.291
  207    H    ILE  29           HN       ILE  29 -12.685   2.575   0.797
  208    HA   ILE  29           HA       ILE  29 -12.066   2.423   3.665
  209    HB   ILE  29           HB       ILE  29 -14.433   1.495   2.739
  210   HG12  ILE  29          2HG1      ILE  29 -12.949  -0.024   4.870
  211   HG13  ILE  29          3HG1      ILE  29 -13.408   1.658   5.108
  212   HG21  ILE  29          1HG2      ILE  29 -12.582  -0.883   2.697
  213   HG22  ILE  29          2HG2      ILE  29 -14.331  -0.909   2.487
  214   HG23  ILE  29          3HG2      ILE  29 -13.309  -0.137   1.274
  215   HD11  ILE  29          1HD1      ILE  29 -15.126   0.451   6.096
  216   HD12  ILE  29          2HD1      ILE  29 -15.776   0.887   4.515
  217   HD13  ILE  29          3HD1      ILE  29 -15.164  -0.742   4.797
  218    H    PHE  30           HN       PHE  30 -10.228   1.383   4.084
  219    HA   PHE  30           HA       PHE  30  -9.294  -0.760   2.373
  220    HB2  PHE  30          2HB       PHE  30  -7.672   1.769   2.730
  221    HB3  PHE  30          3HB       PHE  30  -7.085   0.285   1.984
  222    HD1  PHE  30          1HD       PHE  30  -8.113  -0.498  -0.151
  223    HD2  PHE  30          2HD       PHE  30  -8.939   3.332   1.512
  224    HE1  PHE  30          1HE       PHE  30  -8.951   0.267  -2.335
  225    HE2  PHE  30          2HE       PHE  30  -9.779   4.102  -0.668
  226    HZ   PHE  30           HZ       PHE  30  -9.786   2.568  -2.596
  227    H    CYS  31           HN       CYS  31  -8.312  -2.279   3.549
  228    HA   CYS  31           HA       CYS  31  -8.177  -2.175   6.328
  229    HB2  CYS  31          2HB       CYS  31  -7.102  -4.288   6.236
  230    HB3  CYS  31          3HB       CYS  31  -8.171  -4.235   4.838
  231    H    THR  32           HN       THR  32  -6.756  -1.375   7.734
  232    HA   THR  32           HA       THR  32  -4.886   0.475   7.328
  233    HB   THR  32           HB       THR  32  -4.315  -1.753   9.280
  234    HG1  THR  32          1HG       THR  32  -6.428   0.030   9.169
  235   HG21  THR  32          1HG2      THR  32  -3.181  -0.139  10.547
  236   HG22  THR  32          2HG2      THR  32  -3.932   1.200   9.678
  237   HG23  THR  32          3HG2      THR  32  -2.704   0.213   8.886
  238    H    LEU  33           HN       LEU  33  -4.148  -3.008   7.265
  239    HA   LEU  33           HA       LEU  33  -1.492  -3.080   6.847
  240    HB2  LEU  33          2HB       LEU  33  -3.695  -4.639   5.559
  241    HB3  LEU  33          3HB       LEU  33  -2.016  -4.941   5.117
  242    HG   LEU  33           HG       LEU  33  -2.508  -4.972   8.004
  243   HD11  LEU  33          1HD1      LEU  33  -3.414  -7.438   7.561
  244   HD12  LEU  33          2HD1      LEU  33  -4.135  -6.630   6.170
  245   HD13  LEU  33          3HD1      LEU  33  -4.486  -6.058   7.801
  246   HD21  LEU  33          1HD2      LEU  33  -0.426  -5.667   6.746
  247   HD22  LEU  33          2HD2      LEU  33  -1.330  -7.085   6.214
  248   HD23  LEU  33          3HD2      LEU  33  -1.036  -6.819   7.934
  249    H    CYS  34           HN       CYS  34  -3.684  -3.023   4.034
  250    HA   CYS  34           HA       CYS  34  -1.682  -2.248   2.212
  251    HB2  CYS  34          2HB       CYS  34  -4.650  -1.780   1.895
  252    HB3  CYS  34          3HB       CYS  34  -3.454  -1.965   0.616
  253    H    LEU  35           HN       LEU  35  -4.469  -0.314   3.325
  254    HA   LEU  35           HA       LEU  35  -3.790   2.121   2.321
  255    HB2  LEU  35          2HB       LEU  35  -5.849   1.591   3.595
  256    HB3  LEU  35          3HB       LEU  35  -4.907   1.659   5.083
  257    HG   LEU  35           HG       LEU  35  -4.601   3.996   4.895
  258   HD11  LEU  35          1HD1      LEU  35  -5.347   5.286   2.946
  259   HD12  LEU  35          2HD1      LEU  35  -5.768   3.784   2.124
  260   HD13  LEU  35          3HD1      LEU  35  -4.086   4.125   2.530
  261   HD21  LEU  35          1HD2      LEU  35  -7.315   4.215   3.944
  262   HD22  LEU  35          2HD2      LEU  35  -6.669   4.457   5.568
  263   HD23  LEU  35          3HD2      LEU  35  -7.132   2.841   5.033
  264    H    LYS  36           HN       LYS  36  -2.160   0.390   4.802
  265    HA   LYS  36           HA       LYS  36  -0.705   2.738   5.731
  266    HB2  LYS  36          2HB       LYS  36  -1.420   1.098   7.397
  267    HB3  LYS  36          3HB       LYS  36  -0.530  -0.166   6.560
  268    HG2  LYS  36          2HG       LYS  36   1.195   2.053   7.182
  269    HG3  LYS  36          3HG       LYS  36   0.380   1.459   8.630
  270    HD2  LYS  36          2HD       LYS  36   1.665  -0.449   6.711
  271    HD3  LYS  36          3HD       LYS  36   2.633   0.394   7.921
  272    HE2  LYS  36          2HE       LYS  36   0.332  -0.623   9.220
  273    HE3  LYS  36          3HE       LYS  36   0.997  -1.920   8.228
  274    HZ1  LYS  36          1HZ       LYS  36   3.171  -0.767   9.435
  275    HZ2  LYS  36          2HZ       LYS  36   2.448  -2.237   9.859
  276    HZ3  LYS  36          3HZ       LYS  36   1.999  -0.814  10.654
  277    H    GLN  37           HN       GLN  37   0.396  -0.530   4.830
  278    HA   GLN  37           HA       GLN  37   2.995  -0.020   4.271
  279    HB2  GLN  37          2HB       GLN  37   1.183  -2.098   3.700
  280    HB3  GLN  37          3HB       GLN  37   1.974  -1.713   2.177
  281    HG2  GLN  37          2HG       GLN  37   4.079  -2.266   2.982
  282    HG3  GLN  37          3HG       GLN  37   3.575  -2.130   4.666
  283   HE21  GLN  37          1HE2      GLN  37   1.743  -3.703   5.233
  284   HE22  GLN  37          2HE2      GLN  37   1.958  -5.328   4.687
  285    H    TYR  38           HN       TYR  38   0.270   1.077   2.470
  286    HA   TYR  38           HA       TYR  38   1.752   1.695   0.076
  287    HB2  TYR  38          2HB       TYR  38  -0.354   1.533  -0.685
  288    HB3  TYR  38          3HB       TYR  38  -1.033   1.734   0.926
  289    HD1  TYR  38          1HD       TYR  38   0.932   3.998  -1.310
  290    HD2  TYR  38          2HD       TYR  38  -2.652   3.376   0.897
  291    HE1  TYR  38          1HE       TYR  38   0.172   6.257  -1.917
  292    HE2  TYR  38          2HE       TYR  38  -3.422   5.633   0.294
  293    HH   TYR  38           HH       TYR  38  -3.029   7.435  -0.970
  294    H    VAL  39           HN       VAL  39   0.113   3.658   2.564
  295    HA   VAL  39           HA       VAL  39   1.357   6.081   1.666
  296    HB   VAL  39           HB       VAL  39   0.303   7.130   3.609
  297   HG11  VAL  39          1HG1      VAL  39  -0.946   6.265   1.430
  298   HG12  VAL  39          2HG1      VAL  39  -1.839   5.328   2.628
  299   HG13  VAL  39          3HG1      VAL  39  -1.798   7.088   2.735
  300   HG21  VAL  39          1HG2      VAL  39   0.486   5.589   5.351
  301   HG22  VAL  39          2HG2      VAL  39  -1.240   5.599   4.986
  302   HG23  VAL  39          3HG2      VAL  39  -0.222   4.284   4.399
  303    H    GLU  40           HN       GLU  40   1.656   4.092   4.609
  304    HA   GLU  40           HA       GLU  40   3.467   5.360   6.099
  305    HB2  GLU  40          2HB       GLU  40   2.660   2.714   5.866
  306    HB3  GLU  40          3HB       GLU  40   4.406   2.636   5.674
  307    HG2  GLU  40          2HG       GLU  40   3.450   4.309   7.894
  308    HG3  GLU  40          3HG       GLU  40   3.140   2.581   8.047
  309    H    LEU  41           HN       LEU  41   4.118   3.936   2.972
  310    HA   LEU  41           HA       LEU  41   6.971   4.372   3.162
  311    HB2  LEU  41          2HB       LEU  41   5.143   2.984   1.388
  312    HB3  LEU  41          3HB       LEU  41   6.356   3.903   0.499
  313    HG   LEU  41           HG       LEU  41   8.117   2.628   1.345
  314   HD11  LEU  41          1HD1      LEU  41   7.919   2.496   3.617
  315   HD12  LEU  41          2HD1      LEU  41   7.491   0.843   3.176
  316   HD13  LEU  41          3HD1      LEU  41   6.224   2.010   3.554
  317   HD21  LEU  41          1HD2      LEU  41   5.906   1.335   0.167
  318   HD22  LEU  41          2HD2      LEU  41   6.544   0.243   1.396
  319   HD23  LEU  41          3HD2      LEU  41   7.601   0.851   0.121
  320    H    LEU  42           HN       LEU  42   4.232   5.779   1.407
  321    HA   LEU  42           HA       LEU  42   5.860   7.786   0.147
  322    HB2  LEU  42          2HB       LEU  42   2.900   7.308   0.315
  323    HB3  LEU  42          3HB       LEU  42   3.571   8.745  -0.453
  324    HG   LEU  42           HG       LEU  42   4.329   5.972  -1.333
  325   HD11  LEU  42          1HD1      LEU  42   2.111   5.775  -1.794
  326   HD12  LEU  42          2HD1      LEU  42   2.616   6.666  -3.229
  327   HD13  LEU  42          3HD1      LEU  42   1.857   7.518  -1.884
  328   HD21  LEU  42          1HD2      LEU  42   5.800   7.303  -2.411
  329   HD22  LEU  42          2HD2      LEU  42   4.789   8.739  -2.250
  330   HD23  LEU  42          3HD2      LEU  42   4.438   7.550  -3.505
  331    H    ILE  43           HN       ILE  43   3.089   8.068   2.379
  332    HA   ILE  43           HA       ILE  43   3.186  10.658   3.079
  333    HB   ILE  43           HB       ILE  43   2.062   8.388   4.226
  334   HG12  ILE  43          2HG1      ILE  43   1.123  10.372   5.807
  335   HG13  ILE  43          3HG1      ILE  43   1.845  11.326   4.516
  336   HG21  ILE  43          1HG2      ILE  43   2.465   8.590   6.610
  337   HG22  ILE  43          2HG2      ILE  43   3.974   8.253   5.762
  338   HG23  ILE  43          3HG2      ILE  43   3.625   9.888   6.323
  339   HD11  ILE  43          1HD1      ILE  43  -0.678  10.255   4.522
  340   HD12  ILE  43          2HD1      ILE  43   0.198  10.839   3.107
  341   HD13  ILE  43          3HD1      ILE  43   0.233   9.125   3.521
  342    H    LYS  44           HN       LYS  44   5.572   8.265   3.887
  343    HA   LYS  44           HA       LYS  44   6.886   9.792   5.916
  344    HB2  LYS  44          2HB       LYS  44   7.084   7.178   4.848
  345    HB3  LYS  44          3HB       LYS  44   8.662   7.929   4.646
  346    HG2  LYS  44          2HG       LYS  44   8.548   6.732   6.745
  347    HG3  LYS  44          3HG       LYS  44   8.709   8.466   7.032
  348    HD2  LYS  44          2HD       LYS  44   6.994   8.153   8.456
  349    HD3  LYS  44          3HD       LYS  44   6.008   8.193   6.991
  350    HE2  LYS  44          2HE       LYS  44   5.318   6.131   7.437
  351    HE3  LYS  44          3HE       LYS  44   6.974   5.559   7.246
  352    HZ1  LYS  44          1HZ       LYS  44   6.987   6.595   9.738
  353    HZ2  LYS  44          2HZ       LYS  44   6.781   4.957   9.372
  354    HZ3  LYS  44          3HZ       LYS  44   5.431   5.937   9.645
  355    H    GLU  45           HN       GLU  45   7.465   9.216   2.464
  356    HA   GLU  45           HA       GLU  45   9.814  10.835   2.363
  357    HB2  GLU  45          2HB       GLU  45   8.736   8.967   0.709
  358    HB3  GLU  45          3HB       GLU  45   8.290  10.444  -0.133
  359    HG2  GLU  45          2HG       GLU  45  10.986   9.309   0.406
  360    HG3  GLU  45          3HG       GLU  45  10.314   9.961  -1.088
  361    H    GLY  46           HN       GLY  46   6.777  11.352   0.573
  362    HA2  GLY  46          1HA       GLY  46   5.503  13.264   0.315
  363    HA3  GLY  46          2HA       GLY  46   6.449  14.017   1.591
  364    H    LEU  47           HN       LEU  47   7.205  12.744  -1.655
  365    HA   LEU  47           HA       LEU  47   8.859  15.092  -2.150
  366    HB2  LEU  47          2HB       LEU  47   9.479  13.864  -4.235
  367    HB3  LEU  47          3HB       LEU  47   9.882  13.036  -2.734
  368    HG   LEU  47           HG       LEU  47   7.319  12.334  -4.069
  369   HD11  LEU  47          1HD1      LEU  47   9.287  12.461  -5.768
  370   HD12  LEU  47          2HD1      LEU  47   8.246  11.039  -5.733
  371   HD13  LEU  47          3HD1      LEU  47   9.830  10.990  -4.963
  372   HD21  LEU  47          1HD2      LEU  47   7.398  10.662  -2.613
  373   HD22  LEU  47          2HD2      LEU  47   8.848  11.388  -1.919
  374   HD23  LEU  47          3HD2      LEU  47   8.992  10.172  -3.189
  375    H    GLU  48           HN       GLU  48   5.853  13.648  -3.186
  376    HA   GLU  48           HA       GLU  48   4.674  15.953  -4.097
  377    HB2  GLU  48          2HB       GLU  48   4.818  15.376  -6.652
  378    HB3  GLU  48          3HB       GLU  48   6.074  16.338  -5.886
  379    HG2  GLU  48          2HG       GLU  48   7.571  14.525  -5.823
  380    HG3  GLU  48          3HG       GLU  48   6.300  13.362  -6.196
  381    H    THR  49           HN       THR  49   5.035  12.517  -4.322
  382    HA   THR  49           HA       THR  49   2.909  11.592  -5.704
  383    HB   THR  49           HB       THR  49   3.514  10.570  -2.928
  384    HG1  THR  49          1HG       THR  49   4.893   9.162  -4.596
  385   HG21  THR  49          1HG2      THR  49   2.979   8.739  -5.173
  386   HG22  THR  49          2HG2      THR  49   1.615   9.742  -4.676
  387   HG23  THR  49          3HG2      THR  49   2.407   8.687  -3.506
  388    H    ALA  50           HN       ALA  50   2.777  13.487  -2.815
  389    HA   ALA  50           HA       ALA  50   1.062  14.273  -1.531
  390    HB1  ALA  50          1HB       ALA  50   0.557  15.390  -3.642
  391    HB2  ALA  50          2HB       ALA  50  -0.435  14.018  -4.137
  392    HB3  ALA  50          3HB       ALA  50  -0.918  15.004  -2.756
  393    H    ILE  51           HN       ILE  51   1.336  11.248  -2.036
  394    HA   ILE  51           HA       ILE  51   0.105   9.311  -1.719
  395    HB   ILE  51           HB       ILE  51  -0.602  10.985   0.692
  396   HG12  ILE  51          2HG1      ILE  51   1.266   9.822   1.757
  397   HG13  ILE  51          3HG1      ILE  51   1.559   8.905   0.284
  398   HG21  ILE  51          1HG2      ILE  51  -0.689   7.984   0.445
  399   HG22  ILE  51          2HG2      ILE  51  -1.183   8.963   1.825
  400   HG23  ILE  51          3HG2      ILE  51  -2.107   9.026   0.324
  401   HD11  ILE  51          1HD1      ILE  51   2.588  10.634  -0.747
  402   HD12  ILE  51          2HD1      ILE  51   1.608  11.852   0.069
  403   HD13  ILE  51          3HD1      ILE  51   2.941  11.075   0.924
  404    H    SER  52           HN       SER  52  -1.398   9.395  -3.432
  405    HA   SER  52           HA       SER  52  -4.035  10.513  -2.810
  406    HB2  SER  52          2HB       SER  52  -3.139  11.198  -4.956
  407    HB3  SER  52          3HB       SER  52  -2.853   9.520  -5.415
  408    HG   SER  52           HG       SER  52  -4.759   9.935  -6.332
  409    H    CYS  53           HN       CYS  53  -5.931   9.271  -3.027
  410    HA   CYS  53           HA       CYS  53  -6.160   6.917  -1.806
  411    HB2  CYS  53          2HB       CYS  53  -8.085   8.177  -2.676
  412    HB3  CYS  53          3HB       CYS  53  -7.698   7.643  -4.308
  413    HA   PRO  54           HA       PRO  54  -3.902   3.895  -4.103
  414    HB2  PRO  54          2HB       PRO  54  -4.915   1.685  -2.894
  415    HB3  PRO  54          3HB       PRO  54  -3.735   2.749  -2.119
  416    HG2  PRO  54          2HG       PRO  54  -6.707   2.648  -1.774
  417    HG3  PRO  54          3HG       PRO  54  -5.443   2.823  -0.543
  418    HD2  PRO  54          2HD       PRO  54  -6.872   4.925  -1.473
  419    HD3  PRO  54          3HD       PRO  54  -5.182   5.076  -0.950
  420    H    ASP  55           HN       ASP  55  -7.138   4.547  -4.424
  421    HA   ASP  55           HA       ASP  55  -7.606   2.323  -6.288
  422    HB2  ASP  55          2HB       ASP  55  -9.336   2.520  -4.617
  423    HB3  ASP  55          3HB       ASP  55  -9.530   4.238  -4.958
  424    H    ALA  56           HN       ALA  56  -6.288   3.252  -7.940
  425    HA   ALA  56           HA       ALA  56  -6.418   5.779  -9.007
  426    HB1  ALA  56          1HB       ALA  56  -4.829   4.755 -10.189
  427    HB2  ALA  56          2HB       ALA  56  -5.549   3.166  -9.931
  428    HB3  ALA  56          3HB       ALA  56  -6.127   4.192 -11.244
  429    H    ALA  57           HN       ALA  57  -8.832   3.344  -9.069
  430    HA   ALA  57           HA       ALA  57 -10.300   4.677 -11.228
  431    HB1  ALA  57          1HB       ALA  57 -10.095   1.964 -10.327
  432    HB2  ALA  57          2HB       ALA  57 -11.781   2.484 -10.287
  433    HB3  ALA  57          3HB       ALA  57 -10.858   2.603 -11.785
  434    H    CYS  58           HN       CYS  58  -9.935   5.738  -8.454
  435    HA   CYS  58           HA       CYS  58 -12.477   5.524  -7.150
  436    HB2  CYS  58          2HB       CYS  58 -10.253   6.034  -6.029
  437    HB3  CYS  58          3HB       CYS  58 -10.395   7.660  -6.690
  438    HA   PRO  59           HA       PRO  59 -14.645   8.518  -9.575
  439    HB2  PRO  59          2HB       PRO  59 -16.743   8.883  -7.892
  440    HB3  PRO  59          3HB       PRO  59 -16.557   7.441  -8.897
  441    HG2  PRO  59          2HG       PRO  59 -15.907   7.829  -6.001
  442    HG3  PRO  59          3HG       PRO  59 -16.699   6.455  -6.795
  443    HD2  PRO  59          2HD       PRO  59 -14.083   6.424  -6.097
  444    HD3  PRO  59          3HD       PRO  59 -14.702   5.560  -7.519
  445    H    LYS  60           HN       LYS  60 -13.340   9.061  -6.454
  446    HA   LYS  60           HA       LYS  60 -13.759  11.963  -6.762
  447    HB2  LYS  60          2HB       LYS  60 -14.057  10.191  -4.430
  448    HB3  LYS  60          3HB       LYS  60 -13.149  11.664  -4.116
  449    HG2  LYS  60          2HG       LYS  60 -15.706  11.930  -5.587
  450    HG3  LYS  60          3HG       LYS  60 -15.785  11.531  -3.870
  451    HD2  LYS  60          2HD       LYS  60 -14.192  13.488  -3.510
  452    HD3  LYS  60          3HD       LYS  60 -14.560  13.949  -5.174
  453    HE2  LYS  60          2HE       LYS  60 -16.750  13.439  -3.193
  454    HE3  LYS  60          3HE       LYS  60 -15.931  14.999  -3.254
  455    HZ1  LYS  60          1HZ       LYS  60 -16.523  14.519  -5.849
  456    HZ2  LYS  60          2HZ       LYS  60 -17.431  15.495  -4.807
  457    HZ3  LYS  60          3HZ       LYS  60 -17.873  13.880  -5.053
  458    H    GLN  61           HN       GLN  61 -11.524   9.372  -6.233
  459    HA   GLN  61           HA       GLN  61  -9.261   9.323  -5.835
  460    HB2  GLN  61          2HB       GLN  61  -9.740  11.246  -8.072
  461    HB3  GLN  61          3HB       GLN  61  -8.101  11.031  -7.475
  462    HG2  GLN  61          2HG       GLN  61  -8.899   8.453  -7.773
  463    HG3  GLN  61          3HG       GLN  61  -9.773   9.247  -9.083
  464   HE21  GLN  61          1HE2      GLN  61  -7.250   7.461  -8.711
  465   HE22  GLN  61          2HE2      GLN  61  -6.109   8.198  -9.779
  466    H    GLY  62           HN       GLY  62  -9.875  10.333  -3.642
  467    HA2  GLY  62          1HA       GLY  62  -9.028  13.089  -3.304
  468    HA3  GLY  62          2HA       GLY  62  -9.626  12.018  -2.046
  469    H    HIS  63           HN       HIS  63  -7.462  13.658  -1.591
  470    HA   HIS  63           HA       HIS  63  -5.112  11.915  -1.788
  471    HB2  HIS  63          2HB       HIS  63  -5.385  14.842  -1.083
  472    HB3  HIS  63          3HB       HIS  63  -3.865  13.955  -1.015
  473    HD1  HIS  63          1HD       HIS  63  -6.476  15.080  -3.509
  474    HD2  HIS  63          2HD       HIS  63  -2.546  13.734  -3.406
  475    HE1  HIS  63          1HE       HIS  63  -5.601  15.381  -5.847
  476    H    LEU  64           HN       LEU  64  -3.606  12.156   0.211
  477    HA   LEU  64           HA       LEU  64  -5.253  11.771   2.625
  478    HB2  LEU  64          2HB       LEU  64  -2.714  10.408   1.758
  479    HB3  LEU  64          3HB       LEU  64  -3.363  10.293   3.392
  480    HG   LEU  64           HG       LEU  64  -3.824   8.369   1.760
  481   HD11  LEU  64          1HD1      LEU  64  -6.451   8.788   2.598
  482   HD12  LEU  64          2HD1      LEU  64  -5.444   9.617   3.786
  483   HD13  LEU  64          3HD1      LEU  64  -5.183   7.905   3.450
  484   HD21  LEU  64          1HD2      LEU  64  -5.519   8.596   0.170
  485   HD22  LEU  64          2HD2      LEU  64  -4.529  10.039  -0.053
  486   HD23  LEU  64          3HD2      LEU  64  -6.056  10.143   0.825
  487    H    GLN  65           HN       GLN  65  -4.169  12.260   4.678
  488    HA   GLN  65           HA       GLN  65  -2.655  14.731   4.447
  489    HB2  GLN  65          2HB       GLN  65  -3.168  13.797   7.156
  490    HB3  GLN  65          3HB       GLN  65  -3.622  15.312   6.386
  491    HG2  GLN  65          2HG       GLN  65  -5.667  14.402   6.889
  492    HG3  GLN  65          3HG       GLN  65  -5.440  13.881   5.220
  493   HE21  GLN  65          1HE2      GLN  65  -3.343  11.959   6.247
  494   HE22  GLN  65          2HE2      GLN  65  -4.256  10.622   6.849
  495    H    GLU  66           HN       GLU  66  -0.687  15.117   5.556
  496    HA   GLU  66           HA       GLU  66   1.043  12.793   5.615
  497    HB2  GLU  66          2HB       GLU  66   1.438  15.748   5.631
  498    HB3  GLU  66          3HB       GLU  66   2.721  14.738   6.280
  499    HG2  GLU  66          2HG       GLU  66   2.465  13.435   4.049
  500    HG3  GLU  66          3HG       GLU  66   1.680  14.912   3.492
  501    H    ASN  67           HN       ASN  67  -0.638  14.807   7.843
  502    HA   ASN  67           HA       ASN  67   1.001  13.980  10.105
  503    HB2  ASN  67          2HB       ASN  67  -1.421  15.382  10.834
  504    HB3  ASN  67          3HB       ASN  67   0.258  15.857  11.077
  505   HD21  ASN  67          1HD2      ASN  67  -2.577  16.269   9.206
  506   HD22  ASN  67          2HD2      ASN  67  -1.973  17.497   8.151
  507    H    GLU  68           HN       GLU  68  -2.451  13.838   9.207
  508    HA   GLU  68           HA       GLU  68  -3.347  12.201  11.238
  509    HB2  GLU  68          2HB       GLU  68  -4.316  13.084   8.683
  510    HB3  GLU  68          3HB       GLU  68  -4.714  11.386   8.903
  511    HG2  GLU  68          2HG       GLU  68  -5.250  13.145  11.203
  512    HG3  GLU  68          3HG       GLU  68  -6.246  13.407   9.774
  513    H    ILE  69           HN       ILE  69  -2.351  11.124   7.985
  514    HA   ILE  69           HA       ILE  69  -2.510   8.392   8.423
  515    HB   ILE  69           HB       ILE  69  -0.650   9.948   6.629
  516   HG12  ILE  69          2HG1      ILE  69  -3.408   8.967   6.462
  517   HG13  ILE  69          3HG1      ILE  69  -2.605  10.230   5.535
  518   HG21  ILE  69          1HG2      ILE  69  -0.244   7.825   5.453
  519   HG22  ILE  69          2HG2      ILE  69   0.376   7.807   7.104
  520   HG23  ILE  69          3HG2      ILE  69  -1.129   6.973   6.717
  521   HD11  ILE  69          1HD1      ILE  69  -3.365   8.423   4.104
  522   HD12  ILE  69          2HD1      ILE  69  -1.605   8.537   4.095
  523   HD13  ILE  69          3HD1      ILE  69  -2.402   7.271   5.028
  524    H    GLU  70           HN       GLU  70   0.544  10.242   8.388
  525    HA   GLU  70           HA       GLU  70   2.196   8.312   9.431
  526    HB2  GLU  70          2HB       GLU  70   3.761   9.991   9.819
  527    HB3  GLU  70          3HB       GLU  70   2.735  10.697   8.580
  528    HG2  GLU  70          2HG       GLU  70   1.625  12.074  10.155
  529    HG3  GLU  70          3HG       GLU  70   2.353  11.217  11.513
  530    H    CYS  71           HN       CYS  71  -0.126  10.304  11.096
  531    HA   CYS  71           HA       CYS  71   0.828   9.875  13.731
  532    HB2  CYS  71          2HB       CYS  71  -1.600  10.993  12.478
  533    HB3  CYS  71          3HB       CYS  71  -1.831  10.323  14.088
  534    HG   CYS  71           HG       CYS  71   0.492  12.718  13.330
  535    H    MET  72           HN       MET  72  -1.238   8.054  11.584
  536    HA   MET  72           HA       MET  72  -2.099   6.239  13.672
  537    HB2  MET  72          2HB       MET  72  -3.643   5.480  12.190
  538    HB3  MET  72          3HB       MET  72  -3.294   7.009  11.395
  539    HG2  MET  72          2HG       MET  72  -1.414   5.467  10.261
  540    HG3  MET  72          3HG       MET  72  -2.651   4.254  10.579
  541    HE1  MET  72          1HE       MET  72  -2.299   5.124   6.978
  542    HE2  MET  72          2HE       MET  72  -2.210   3.908   8.251
  543    HE3  MET  72          3HE       MET  72  -3.712   4.139   7.354
  544    H    VAL  73           HN       VAL  73   0.767   6.632  12.346
  545    HA   VAL  73           HA       VAL  73   1.422   3.787  12.534
  546    HB   VAL  73           HB       VAL  73   3.117   4.457  10.549
  547   HG11  VAL  73          1HG1      VAL  73   1.838   2.451  10.522
  548   HG12  VAL  73          2HG1      VAL  73   0.327   3.343  10.332
  549   HG13  VAL  73          3HG1      VAL  73   1.500   3.302   9.015
  550   HG21  VAL  73          1HG2      VAL  73   2.360   6.002   9.083
  551   HG22  VAL  73          2HG2      VAL  73   0.664   5.640   9.407
  552   HG23  VAL  73          3HG2      VAL  73   1.577   6.659  10.520
  553    H    ALA  74           HN       ALA  74   3.088   6.820  11.661
  554    HA   ALA  74           HA       ALA  74   5.324   6.123  13.358
  555    HB1  ALA  74          1HB       ALA  74   5.089   7.564  11.038
  556    HB2  ALA  74          2HB       ALA  74   5.314   8.823  12.253
  557    HB3  ALA  74          3HB       ALA  74   6.505   7.533  12.089
  558    H    ALA  75           HN       ALA  75   2.828   6.527  14.716
  559    HA   ALA  75           HA       ALA  75   2.184   8.853  15.859
  560    HB1  ALA  75          1HB       ALA  75   1.835   7.631  18.013
  561    HB2  ALA  75          2HB       ALA  75   1.139   6.840  16.600
  562    HB3  ALA  75          3HB       ALA  75   2.647   6.242  17.289
  Start of MODEL    8
    1    H1   ALA   1           HN       ALA   1 -22.047  -2.442   4.600
    2    HA   ALA   1           HA       ALA   1 -20.787  -4.400   4.233
    3    HB1  ALA   1          1HB       ALA   1 -18.562  -3.102   5.792
    4    HB2  ALA   1          2HB       ALA   1 -18.483  -4.569   4.816
    5    HB3  ALA   1          3HB       ALA   1 -18.718  -3.004   4.037
    6    H    LEU   2           HN       LEU   2 -21.928  -5.779   5.436
    7    HA   LEU   2           HA       LEU   2 -21.207  -6.142   8.220
    8    HB2  LEU   2          2HB       LEU   2 -23.063  -4.460   8.181
    9    HB3  LEU   2          3HB       LEU   2 -24.090  -5.700   7.462
   10    HG   LEU   2           HG       LEU   2 -22.845  -6.593   9.934
   11   HD11  LEU   2          1HD1      LEU   2 -22.990  -4.635  11.029
   12   HD12  LEU   2          2HD1      LEU   2 -24.706  -5.031  11.109
   13   HD13  LEU   2          3HD1      LEU   2 -24.111  -3.939   9.859
   14   HD21  LEU   2          1HD2      LEU   2 -24.860  -7.477   8.556
   15   HD22  LEU   2          2HD2      LEU   2 -25.774  -6.249   9.431
   16   HD23  LEU   2          3HD2      LEU   2 -24.930  -7.519  10.318
   17    H    ASP   3           HN       ASP   3 -23.966  -7.126   6.188
   18    HA   ASP   3           HA       ASP   3 -23.900  -9.815   7.016
   19    HB2  ASP   3          2HB       ASP   3 -25.380  -8.209   5.073
   20    HB3  ASP   3          3HB       ASP   3 -25.121  -9.867   4.537
   21    HA   PRO   4           HA       PRO   4 -21.758 -10.890   2.844
   22    HB2  PRO   4          2HB       PRO   4 -21.027  -8.842   1.217
   23    HB3  PRO   4          3HB       PRO   4 -22.619  -9.608   1.142
   24    HG2  PRO   4          2HG       PRO   4 -21.806  -7.055   2.478
   25    HG3  PRO   4          3HG       PRO   4 -23.250  -7.399   1.505
   26    HD2  PRO   4          2HD       PRO   4 -23.296  -7.346   4.212
   27    HD3  PRO   4          3HD       PRO   4 -24.343  -8.418   3.260
   28    H    LEU   5           HN       LEU   5 -19.501 -10.204   1.686
   29    HA   LEU   5           HA       LEU   5 -17.744  -9.082   3.758
   30    HB2  LEU   5          2HB       LEU   5 -16.702 -11.320   2.128
   31    HB3  LEU   5          3HB       LEU   5 -16.345 -10.870   3.793
   32    HG   LEU   5           HG       LEU   5 -18.898 -11.730   4.048
   33   HD11  LEU   5          1HD1      LEU   5 -18.101 -12.611   1.478
   34   HD12  LEU   5          2HD1      LEU   5 -19.582 -12.987   2.359
   35   HD13  LEU   5          3HD1      LEU   5 -18.163 -14.021   2.536
   36   HD21  LEU   5          1HD2      LEU   5 -16.318 -13.275   4.193
   37   HD22  LEU   5          2HD2      LEU   5 -17.857 -13.899   4.787
   38   HD23  LEU   5          3HD2      LEU   5 -17.160 -12.443   5.500
   39    H    VAL   6           HN       VAL   6 -15.337  -9.464   2.397
   40    HA   VAL   6           HA       VAL   6 -13.983  -8.460   0.867
   41    HB   VAL   6           HB       VAL   6 -16.227  -8.296  -1.105
   42   HG11  VAL   6          1HG1      VAL   6 -13.675  -9.502  -1.858
   43   HG12  VAL   6          2HG1      VAL   6 -14.586  -8.200  -2.626
   44   HG13  VAL   6          3HG1      VAL   6 -13.530  -7.850  -1.257
   45   HG21  VAL   6          1HG2      VAL   6 -15.330 -10.713   0.269
   46   HG22  VAL   6          2HG2      VAL   6 -16.769 -10.434  -0.711
   47   HG23  VAL   6          3HG2      VAL   6 -15.235 -10.820  -1.489
   48    H    SER   7           HN       SER   7 -13.352  -6.426   1.071
   49    HA   SER   7           HA       SER   7 -15.225  -4.267   0.440
   50    HB2  SER   7          2HB       SER   7 -14.665  -4.923   3.063
   51    HB3  SER   7          3HB       SER   7 -13.518  -3.625   2.731
   52    HG   SER   7           HG       SER   7 -16.069  -3.388   3.288
   53    H    CYS   8           HN       CYS   8 -11.947  -4.466   1.821
   54    HA   CYS   8           HA       CYS   8 -10.814  -2.334   0.553
   55    HB2  CYS   8          2HB       CYS   8  -9.757  -3.869   2.281
   56    HB3  CYS   8          3HB       CYS   8  -9.343  -4.941   0.947
   57    H    LYS   9           HN       LYS   9  -9.401  -2.136  -1.291
   58    HA   LYS   9           HA       LYS   9 -10.006  -4.048  -3.448
   59    HB2  LYS   9          2HB       LYS   9  -9.753  -1.050  -3.745
   60    HB3  LYS   9          3HB       LYS   9 -10.103  -2.198  -5.031
   61    HG2  LYS   9          2HG       LYS   9 -12.262  -2.562  -4.301
   62    HG3  LYS   9          3HG       LYS   9 -11.906  -2.024  -2.658
   63    HD2  LYS   9          2HD       LYS   9 -11.439   0.079  -4.590
   64    HD3  LYS   9          3HD       LYS   9 -13.092  -0.532  -4.687
   65    HE2  LYS   9          2HE       LYS   9 -11.682   0.533  -2.245
   66    HE3  LYS   9          3HE       LYS   9 -13.018   1.287  -3.114
   67    HZ1  LYS   9          1HZ       LYS   9 -13.046  -1.004  -1.287
   68    HZ2  LYS   9          2HZ       LYS   9 -14.179  -0.971  -2.541
   69    HZ3  LYS   9          3HZ       LYS   9 -14.131   0.288  -1.412
   70    H    LEU  10           HN       LEU  10  -7.684  -3.699  -1.585
   71    HA   LEU  10           HA       LEU  10  -5.601  -3.343  -3.639
   72    HB2  LEU  10          2HB       LEU  10  -5.524  -2.673  -0.704
   73    HB3  LEU  10          3HB       LEU  10  -4.091  -2.730  -1.729
   74    HG   LEU  10           HG       LEU  10  -6.383  -0.934  -2.432
   75   HD11  LEU  10          1HD1      LEU  10  -5.653   0.779  -1.043
   76   HD12  LEU  10          2HD1      LEU  10  -4.110  -0.008  -0.715
   77   HD13  LEU  10          3HD1      LEU  10  -5.592  -0.642  -0.001
   78   HD21  LEU  10          1HD2      LEU  10  -3.841  -1.519  -3.515
   79   HD22  LEU  10          2HD2      LEU  10  -3.768   0.120  -2.866
   80   HD23  LEU  10          3HD2      LEU  10  -5.004  -0.305  -4.051
   81    H    CYS  11           HN       CYS  11  -7.085  -5.440  -1.452
   82    HA   CYS  11           HA       CYS  11  -5.011  -7.446  -1.929
   83    HB2  CYS  11          2HB       CYS  11  -5.076  -8.194   0.412
   84    HB3  CYS  11          3HB       CYS  11  -4.503  -6.534   0.284
   85    H    LEU  12           HN       LEU  12  -8.282  -6.666  -0.901
   86    HA   LEU  12           HA       LEU  12 -10.254  -7.782  -1.081
   87    HB2  LEU  12          2HB       LEU  12  -8.622  -9.174  -3.179
   88    HB3  LEU  12          3HB       LEU  12 -10.287  -9.645  -2.845
   89    HG   LEU  12           HG       LEU  12  -9.596  -6.814  -3.553
   90   HD11  LEU  12          1HD1      LEU  12 -10.384  -7.604  -5.902
   91   HD12  LEU  12          2HD1      LEU  12  -9.812  -9.181  -5.360
   92   HD13  LEU  12          3HD1      LEU  12  -8.699  -7.814  -5.424
   93   HD21  LEU  12          1HD2      LEU  12 -11.810  -7.241  -2.643
   94   HD22  LEU  12          2HD2      LEU  12 -12.083  -8.495  -3.852
   95   HD23  LEU  12          3HD2      LEU  12 -11.916  -6.811  -4.350
   96    H    GLY  13           HN       GLY  13  -9.142  -8.461   1.154
   97    HA2  GLY  13          1HA       GLY  13  -9.002 -11.404   1.250
   98    HA3  GLY  13          2HA       GLY  13  -8.333 -10.319   2.462
   99    H    GLU  14           HN       GLU  14 -11.004  -8.766   2.062
  100    HA   GLU  14           HA       GLU  14 -13.154  -8.815   2.885
  101    HB2  GLU  14          2HB       GLU  14 -12.739 -11.571   3.996
  102    HB3  GLU  14          3HB       GLU  14 -14.230 -10.807   3.461
  103    HG2  GLU  14          2HG       GLU  14 -14.008 -11.663   1.437
  104    HG3  GLU  14          3HG       GLU  14 -12.389 -10.984   1.274
  105    H    TYR  15           HN       TYR  15 -13.394  -7.537   4.584
  106    HA   TYR  15           HA       TYR  15 -12.704  -8.449   7.233
  107    HB2  TYR  15          2HB       TYR  15 -11.474  -5.846   6.349
  108    HB3  TYR  15          3HB       TYR  15 -11.131  -6.785   7.799
  109    HD1  TYR  15          1HD       TYR  15 -10.530  -6.491   4.192
  110    HD2  TYR  15          2HD       TYR  15  -9.637  -8.687   7.725
  111    HE1  TYR  15          1HE       TYR  15  -8.648  -7.574   3.036
  112    HE2  TYR  15          2HE       TYR  15  -7.752  -9.775   6.580
  113    HH   TYR  15           HH       TYR  15  -6.914  -8.949   3.230
  114    HA   PRO  16           HA       PRO  16 -16.194  -5.999   8.286
  115    HB2  PRO  16          2HB       PRO  16 -15.656  -5.457  10.891
  116    HB3  PRO  16          3HB       PRO  16 -16.155  -7.055  10.326
  117    HG2  PRO  16          2HG       PRO  16 -13.409  -6.039  10.947
  118    HG3  PRO  16          3HG       PRO  16 -14.144  -7.601  11.357
  119    HD2  PRO  16          2HD       PRO  16 -12.435  -7.294   9.279
  120    HD3  PRO  16          3HD       PRO  16 -13.763  -8.472   9.258
  121    H    VAL  17           HN       VAL  17 -16.879  -3.867   8.858
  122    HA   VAL  17           HA       VAL  17 -15.239  -1.808   7.872
  123    HB   VAL  17           HB       VAL  17 -17.902  -2.025   8.386
  124   HG11  VAL  17          1HG1      VAL  17 -18.604  -0.649  10.124
  125   HG12  VAL  17          2HG1      VAL  17 -17.251  -1.531  10.835
  126   HG13  VAL  17          3HG1      VAL  17 -17.029   0.128  10.276
  127   HG21  VAL  17          1HG2      VAL  17 -16.097   0.226   7.671
  128   HG22  VAL  17          2HG2      VAL  17 -17.361  -0.556   6.721
  129   HG23  VAL  17          3HG2      VAL  17 -17.794   0.589   7.990
  130    H    GLU  18           HN       GLU  18 -15.091  -3.388  10.799
  131    HA   GLU  18           HA       GLU  18 -14.115  -1.065  12.284
  132    HB2  GLU  18          2HB       GLU  18 -14.469  -2.249  14.227
  133    HB3  GLU  18          3HB       GLU  18 -15.708  -2.944  13.191
  134    HG2  GLU  18          2HG       GLU  18 -14.881  -4.923  13.743
  135    HG3  GLU  18          3HG       GLU  18 -13.509  -4.532  12.708
  136    H    GLN  19           HN       GLN  19 -12.864  -3.143  10.132
  137    HA   GLN  19           HA       GLN  19 -10.245  -3.245  11.479
  138    HB2  GLN  19          2HB       GLN  19 -11.706  -5.217   9.845
  139    HB3  GLN  19          3HB       GLN  19 -10.000  -5.046   9.456
  140    HG2  GLN  19          2HG       GLN  19  -9.523  -5.377  11.903
  141    HG3  GLN  19          3HG       GLN  19 -11.220  -5.817  12.088
  142   HE21  GLN  19          1HE2      GLN  19 -11.928  -7.780  11.370
  143   HE22  GLN  19          2HE2      GLN  19 -10.872  -9.019  10.792
  144    H    MET  20           HN       MET  20 -11.817  -1.398   9.424
  145    HA   MET  20           HA       MET  20  -9.514  -1.058   7.615
  146    HB2  MET  20          2HB       MET  20 -12.163   0.063   6.867
  147    HB3  MET  20          3HB       MET  20 -10.896  -0.603   5.845
  148    HG2  MET  20          2HG       MET  20 -11.712  -2.798   7.245
  149    HG3  MET  20          3HG       MET  20 -13.214  -1.897   7.053
  150    HE1  MET  20          1HE       MET  20 -10.627  -4.192   4.445
  151    HE2  MET  20          2HE       MET  20 -10.297  -2.596   3.769
  152    HE3  MET  20          3HE       MET  20 -10.052  -2.894   5.492
  153    H    THR  21           HN       THR  21  -9.565   1.296   6.671
  154    HA   THR  21           HA       THR  21 -10.186   3.214   8.808
  155    HB   THR  21           HB       THR  21  -7.522   2.666   7.590
  156    HG1  THR  21          1HG       THR  21  -8.536   3.419  10.136
  157   HG21  THR  21          1HG2      THR  21  -7.926   4.926   6.824
  158   HG22  THR  21          2HG2      THR  21  -6.777   4.962   8.162
  159   HG23  THR  21          3HG2      THR  21  -8.461   5.409   8.433
  160    H    THR  22           HN       THR  22 -10.943   5.153   8.128
  161    HA   THR  22           HA       THR  22 -11.844   5.408   5.451
  162    HB   THR  22           HB       THR  22 -11.840   7.272   7.809
  163    HG1  THR  22          1HG       THR  22 -13.429   5.635   7.732
  164   HG21  THR  22          1HG2      THR  22 -12.806   7.895   5.015
  165   HG22  THR  22          2HG2      THR  22 -11.491   8.698   5.874
  166   HG23  THR  22          3HG2      THR  22 -13.150   8.863   6.447
  167    H    ILE  23           HN       ILE  23 -11.251   6.930   3.865
  168    HA   ILE  23           HA       ILE  23  -8.460   7.322   3.576
  169    HB   ILE  23           HB       ILE  23 -10.820   8.351   2.017
  170   HG12  ILE  23          2HG1      ILE  23 -10.435   6.019   1.676
  171   HG13  ILE  23          3HG1      ILE  23  -9.786   6.848   0.266
  172   HG21  ILE  23          1HG2      ILE  23  -8.120   9.362   2.029
  173   HG22  ILE  23          2HG2      ILE  23  -8.540   8.693   0.453
  174   HG23  ILE  23          3HG2      ILE  23  -9.539   9.958   1.168
  175   HD11  ILE  23          1HD1      ILE  23  -8.341   5.482   2.488
  176   HD12  ILE  23          2HD1      ILE  23  -8.147   5.306   0.744
  177   HD13  ILE  23          3HD1      ILE  23  -7.545   6.750   1.557
  178    H    ALA  24           HN       ALA  24 -10.545  10.041   2.916
  179    HA   ALA  24           HA       ALA  24 -10.217  11.647   5.111
  180    HB1  ALA  24          1HB       ALA  24  -8.226  13.056   3.942
  181    HB2  ALA  24          2HB       ALA  24  -7.984  11.874   5.228
  182    HB3  ALA  24          3HB       ALA  24  -7.741  11.407   3.545
  183    H    GLN  25           HN       GLN  25  -9.683  11.804   1.595
  184    HA   GLN  25           HA       GLN  25 -11.327  14.223   1.476
  185    HB2  GLN  25          2HB       GLN  25  -9.101  13.180  -0.058
  186    HB3  GLN  25          3HB       GLN  25 -10.448  13.607  -1.105
  187    HG2  GLN  25          2HG       GLN  25 -10.495  15.845  -0.020
  188    HG3  GLN  25          3HG       GLN  25  -9.029  15.396   0.851
  189   HE21  GLN  25          1HE2      GLN  25  -7.403  16.469  -0.012
  190   HE22  GLN  25          2HE2      GLN  25  -7.070  16.626  -1.699
  191    H    CYS  26           HN       CYS  26 -11.056  11.047  -0.108
  192    HA   CYS  26           HA       CYS  26 -13.678  11.342  -1.306
  193    HB2  CYS  26          2HB       CYS  26 -13.234   9.163  -2.323
  194    HB3  CYS  26          3HB       CYS  26 -11.867  10.247  -2.560
  195    H    GLN  27           HN       GLN  27 -12.152   9.496   1.279
  196    HA   GLN  27           HA       GLN  27 -13.120   8.621   3.176
  197    HB2  GLN  27          2HB       GLN  27 -15.861   8.895   1.989
  198    HB3  GLN  27          3HB       GLN  27 -15.379   8.924   3.681
  199    HG2  GLN  27          2HG       GLN  27 -14.123  11.086   2.296
  200    HG3  GLN  27          3HG       GLN  27 -15.857  11.102   1.975
  201   HE21  GLN  27          1HE2      GLN  27 -13.385  11.688   4.253
  202   HE22  GLN  27          2HE2      GLN  27 -14.393  12.197   5.561
  203    H    CYS  28           HN       CYS  28 -12.116   7.056   1.172
  204    HA   CYS  28           HA       CYS  28 -14.033   4.978   0.530
  205    HB2  CYS  28          2HB       CYS  28 -11.118   5.402  -0.099
  206    HB3  CYS  28          3HB       CYS  28 -11.929   3.882  -0.464
  207    H    ILE  29           HN       ILE  29 -12.910   2.640   0.771
  208    HA   ILE  29           HA       ILE  29 -12.176   2.394   3.616
  209    HB   ILE  29           HB       ILE  29 -14.469   1.444   2.593
  210   HG12  ILE  29          2HG1      ILE  29 -12.757   0.064   4.672
  211   HG13  ILE  29          3HG1      ILE  29 -13.831   1.430   4.956
  212   HG21  ILE  29          1HG2      ILE  29 -12.534  -0.854   2.328
  213   HG22  ILE  29          2HG2      ILE  29 -14.283  -0.924   2.115
  214   HG23  ILE  29          3HG2      ILE  29 -13.295   0.000   0.984
  215   HD11  ILE  29          1HD1      ILE  29 -15.747   0.038   4.355
  216   HD12  ILE  29          2HD1      ILE  29 -14.663  -1.330   4.098
  217   HD13  ILE  29          3HD1      ILE  29 -14.839  -0.635   5.709
  218    H    PHE  30           HN       PHE  30 -10.292   1.451   4.041
  219    HA   PHE  30           HA       PHE  30  -9.207  -0.587   2.294
  220    HB2  PHE  30          2HB       PHE  30  -7.764   2.031   2.751
  221    HB3  PHE  30          3HB       PHE  30  -7.024   0.595   2.050
  222    HD1  PHE  30          1HD       PHE  30  -8.871   3.563   1.407
  223    HD2  PHE  30          2HD       PHE  30  -8.066  -0.339  -0.091
  224    HE1  PHE  30          1HE       PHE  30  -9.639   4.264  -0.824
  225    HE2  PHE  30          2HE       PHE  30  -8.831   0.357  -2.323
  226    HZ   PHE  30           HZ       PHE  30  -9.618   2.660  -2.692
  227    H    CYS  31           HN       CYS  31  -8.125  -2.078   3.428
  228    HA   CYS  31           HA       CYS  31  -8.054  -1.993   6.239
  229    HB2  CYS  31          2HB       CYS  31  -7.010  -4.121   6.142
  230    HB3  CYS  31          3HB       CYS  31  -8.092  -4.055   4.755
  231    H    THR  32           HN       THR  32  -6.596  -1.245   7.642
  232    HA   THR  32           HA       THR  32  -4.713   0.589   7.234
  233    HB   THR  32           HB       THR  32  -4.107  -1.665   9.141
  234    HG1  THR  32          1HG       THR  32  -6.290  -0.013   9.056
  235   HG21  THR  32          1HG2      THR  32  -3.649   1.318   9.276
  236   HG22  THR  32          2HG2      THR  32  -2.420   0.092   8.966
  237   HG23  THR  32          3HG2      THR  32  -3.226   0.156  10.532
  238    H    LEU  33           HN       LEU  33  -4.012  -2.901   7.112
  239    HA   LEU  33           HA       LEU  33  -1.362  -2.986   6.645
  240    HB2  LEU  33          2HB       LEU  33  -3.647  -4.556   5.633
  241    HB3  LEU  33          3HB       LEU  33  -2.126  -4.755   4.766
  242    HG   LEU  33           HG       LEU  33  -1.984  -4.995   7.706
  243   HD11  LEU  33          1HD1      LEU  33  -2.899  -7.190   7.802
  244   HD12  LEU  33          2HD1      LEU  33  -3.183  -7.213   6.062
  245   HD13  LEU  33          3HD1      LEU  33  -4.124  -6.137   7.094
  246   HD21  LEU  33          1HD2      LEU  33  -0.917  -6.794   5.545
  247   HD22  LEU  33          2HD2      LEU  33  -0.347  -6.624   7.205
  248   HD23  LEU  33          3HD2      LEU  33  -0.101  -5.314   6.049
  249    H    CYS  34           HN       CYS  34  -3.609  -2.891   3.876
  250    HA   CYS  34           HA       CYS  34  -1.660  -2.150   2.001
  251    HB2  CYS  34          2HB       CYS  34  -4.621  -1.563   1.828
  252    HB3  CYS  34          3HB       CYS  34  -3.491  -1.728   0.488
  253    H    LEU  35           HN       LEU  35  -4.301  -0.106   3.265
  254    HA   LEU  35           HA       LEU  35  -3.502   2.312   2.264
  255    HB2  LEU  35          2HB       LEU  35  -5.570   1.726   3.636
  256    HB3  LEU  35          3HB       LEU  35  -4.571   2.026   5.057
  257    HG   LEU  35           HG       LEU  35  -4.294   4.339   4.429
  258   HD11  LEU  35          1HD1      LEU  35  -5.706   3.488   1.924
  259   HD12  LEU  35          2HD1      LEU  35  -4.179   4.353   2.099
  260   HD13  LEU  35          3HD1      LEU  35  -5.700   5.170   2.457
  261   HD21  LEU  35          1HD2      LEU  35  -6.320   3.644   5.686
  262   HD22  LEU  35          2HD2      LEU  35  -7.199   3.574   4.158
  263   HD23  LEU  35          3HD2      LEU  35  -6.548   5.110   4.733
  264    H    LYS  36           HN       LYS  36  -1.938   0.438   4.661
  265    HA   LYS  36           HA       LYS  36  -0.401   2.682   5.703
  266    HB2  LYS  36          2HB       LYS  36  -1.099   1.025   7.314
  267    HB3  LYS  36          3HB       LYS  36  -0.383  -0.267   6.360
  268    HG2  LYS  36          2HG       LYS  36   1.680   1.565   6.862
  269    HG3  LYS  36          3HG       LYS  36   0.808   1.365   8.384
  270    HD2  LYS  36          2HD       LYS  36   0.949  -1.169   7.832
  271    HD3  LYS  36          3HD       LYS  36   2.247  -0.682   6.740
  272    HE2  LYS  36          2HE       LYS  36   3.673  -0.282   8.427
  273    HE3  LYS  36          3HE       LYS  36   2.434   0.491   9.415
  274    HZ1  LYS  36          1HZ       LYS  36   3.526  -1.993   9.808
  275    HZ2  LYS  36          2HZ       LYS  36   1.988  -2.311   9.181
  276    HZ3  LYS  36          3HZ       LYS  36   2.154  -1.365  10.573
  277    H    GLN  37           HN       GLN  37   0.598  -0.553   4.592
  278    HA   GLN  37           HA       GLN  37   3.207  -0.042   4.022
  279    HB2  GLN  37          2HB       GLN  37   1.357  -2.087   3.407
  280    HB3  GLN  37          3HB       GLN  37   2.166  -1.673   1.901
  281    HG2  GLN  37          2HG       GLN  37   3.814  -3.005   2.534
  282    HG3  GLN  37          3HG       GLN  37   4.214  -1.804   3.762
  283   HE21  GLN  37          1HE2      GLN  37   1.971  -4.499   3.220
  284   HE22  GLN  37          2HE2      GLN  37   2.073  -5.132   4.825
  285    H    TYR  38           HN       TYR  38   0.463   1.164   2.346
  286    HA   TYR  38           HA       TYR  38   1.886   1.821  -0.079
  287    HB2  TYR  38          2HB       TYR  38  -0.265   1.639  -0.736
  288    HB3  TYR  38          3HB       TYR  38  -0.885   1.953   0.882
  289    HD1  TYR  38          1HD       TYR  38  -2.394   3.692   0.863
  290    HD2  TYR  38          2HD       TYR  38   1.077   3.978  -1.579
  291    HE1  TYR  38          1HE       TYR  38  -3.078   5.949   0.166
  292    HE2  TYR  38          2HE       TYR  38   0.404   6.236  -2.283
  293    HH   TYR  38           HH       TYR  38  -2.672   7.644  -1.242
  294    H    VAL  39           HN       VAL  39   0.316   3.744   2.485
  295    HA   VAL  39           HA       VAL  39   1.552   6.178   1.634
  296    HB   VAL  39           HB       VAL  39   0.579   7.182   3.620
  297   HG11  VAL  39          1HG1      VAL  39  -1.587   5.332   2.793
  298   HG12  VAL  39          2HG1      VAL  39  -1.576   7.094   2.891
  299   HG13  VAL  39          3HG1      VAL  39  -0.799   6.279   1.533
  300   HG21  VAL  39          1HG2      VAL  39   0.110   4.328   4.438
  301   HG22  VAL  39          2HG2      VAL  39   0.949   5.602   5.324
  302   HG23  VAL  39          3HG2      VAL  39  -0.804   5.668   5.133
  303    H    GLU  40           HN       GLU  40   1.992   4.073   4.477
  304    HA   GLU  40           HA       GLU  40   3.878   5.285   5.924
  305    HB2  GLU  40          2HB       GLU  40   2.987   2.761   5.869
  306    HB3  GLU  40          3HB       GLU  40   4.586   2.494   5.190
  307    HG2  GLU  40          2HG       GLU  40   4.606   4.177   7.568
  308    HG3  GLU  40          3HG       GLU  40   3.964   2.561   7.852
  309    H    LEU  41           HN       LEU  41   4.360   3.998   2.712
  310    HA   LEU  41           HA       LEU  41   7.221   4.363   2.765
  311    HB2  LEU  41          2HB       LEU  41   5.303   3.072   1.080
  312    HB3  LEU  41          3HB       LEU  41   6.304   4.147   0.105
  313    HG   LEU  41           HG       LEU  41   8.282   2.976   0.679
  314   HD11  LEU  41          1HD1      LEU  41   6.590   1.679   2.791
  315   HD12  LEU  41          2HD1      LEU  41   8.096   2.578   2.978
  316   HD13  LEU  41          3HD1      LEU  41   8.113   0.972   2.248
  317   HD21  LEU  41          1HD2      LEU  41   7.811   0.722  -0.101
  318   HD22  LEU  41          2HD2      LEU  41   6.881   1.904  -1.023
  319   HD23  LEU  41          3HD2      LEU  41   6.094   0.947   0.234
  320    H    LEU  42           HN       LEU  42   4.445   5.976   1.254
  321    HA   LEU  42           HA       LEU  42   6.090   8.046   0.109
  322    HB2  LEU  42          2HB       LEU  42   3.116   7.649   0.313
  323    HB3  LEU  42          3HB       LEU  42   3.841   9.080  -0.418
  324    HG   LEU  42           HG       LEU  42   4.513   6.338  -1.425
  325   HD11  LEU  42          1HD1      LEU  42   2.638   7.287  -3.176
  326   HD12  LEU  42          2HD1      LEU  42   1.947   7.713  -1.611
  327   HD13  LEU  42          3HD1      LEU  42   2.367   6.035  -1.962
  328   HD21  LEU  42          1HD2      LEU  42   5.670   7.463  -2.948
  329   HD22  LEU  42          2HD2      LEU  42   5.327   8.944  -2.053
  330   HD23  LEU  42          3HD2      LEU  42   4.261   8.439  -3.366
  331    H    ILE  43           HN       ILE  43   3.361   8.187   2.406
  332    HA   ILE  43           HA       ILE  43   3.511  10.712   3.307
  333    HB   ILE  43           HB       ILE  43   2.416   8.338   4.317
  334   HG12  ILE  43          2HG1      ILE  43   1.336  10.156   5.931
  335   HG13  ILE  43          3HG1      ILE  43   2.146  11.265   4.830
  336   HG21  ILE  43          1HG2      ILE  43   3.918   9.806   6.482
  337   HG22  ILE  43          2HG2      ILE  43   2.808   8.454   6.705
  338   HG23  ILE  43          3HG2      ILE  43   4.334   8.211   5.855
  339   HD11  ILE  43          1HD1      ILE  43   0.630   9.168   3.484
  340   HD12  ILE  43          2HD1      ILE  43  -0.349  10.240   4.485
  341   HD13  ILE  43          3HD1      ILE  43   0.664  10.910   3.206
  342    H    LYS  44           HN       LYS  44   5.888   8.246   3.845
  343    HA   LYS  44           HA       LYS  44   7.255   9.574   5.980
  344    HB2  LYS  44          2HB       LYS  44   7.447   7.076   4.595
  345    HB3  LYS  44          3HB       LYS  44   9.032   7.840   4.608
  346    HG2  LYS  44          2HG       LYS  44   8.649   6.327   6.520
  347    HG3  LYS  44          3HG       LYS  44   9.008   7.987   7.002
  348    HD2  LYS  44          2HD       LYS  44   7.197   7.775   8.313
  349    HD3  LYS  44          3HD       LYS  44   6.288   8.039   6.823
  350    HE2  LYS  44          2HE       LYS  44   5.387   6.020   7.009
  351    HE3  LYS  44          3HE       LYS  44   6.992   5.293   6.945
  352    HZ1  LYS  44          1HZ       LYS  44   6.932   6.102   9.471
  353    HZ2  LYS  44          2HZ       LYS  44   6.405   4.572   8.981
  354    HZ3  LYS  44          3HZ       LYS  44   5.281   5.811   9.236
  355    H    GLU  45           HN       GLU  45   7.738   9.310   2.479
  356    HA   GLU  45           HA       GLU  45  10.055  11.037   2.548
  357    HB2  GLU  45          2HB       GLU  45  10.073   9.290   0.910
  358    HB3  GLU  45          3HB       GLU  45   8.502   9.777   0.289
  359    HG2  GLU  45          2HG       GLU  45  10.129  10.508  -1.264
  360    HG3  GLU  45          3HG       GLU  45   9.540  11.937  -0.416
  361    H    GLY  46           HN       GLY  46   6.808  11.224   1.076
  362    HA2  GLY  46          1HA       GLY  46   5.478  13.028   0.580
  363    HA3  GLY  46          2HA       GLY  46   6.330  13.877   1.861
  364    H    LEU  47           HN       LEU  47   7.380  12.611  -1.297
  365    HA   LEU  47           HA       LEU  47   8.945  14.954  -1.807
  366    HB2  LEU  47          2HB       LEU  47   9.431  13.902  -3.959
  367    HB3  LEU  47          3HB       LEU  47   9.676  12.795  -2.610
  368    HG   LEU  47           HG       LEU  47   7.085  12.721  -4.088
  369   HD11  LEU  47          1HD1      LEU  47   9.741  11.903  -5.147
  370   HD12  LEU  47          2HD1      LEU  47   8.337  12.551  -5.992
  371   HD13  LEU  47          3HD1      LEU  47   8.348  10.869  -5.464
  372   HD21  LEU  47          1HD2      LEU  47   8.432  11.192  -2.090
  373   HD22  LEU  47          2HD2      LEU  47   8.175  10.182  -3.514
  374   HD23  LEU  47          3HD2      LEU  47   6.806  10.983  -2.740
  375    H    GLU  48           HN       GLU  48   5.768  13.820  -2.701
  376    HA   GLU  48           HA       GLU  48   4.588  16.184  -3.241
  377    HB2  GLU  48          2HB       GLU  48   4.694  16.159  -5.846
  378    HB3  GLU  48          3HB       GLU  48   5.993  16.911  -4.931
  379    HG2  GLU  48          2HG       GLU  48   7.513  15.440  -5.642
  380    HG3  GLU  48          3HG       GLU  48   6.415  14.072  -5.463
  381    H    THR  49           HN       THR  49   4.950  12.851  -3.976
  382    HA   THR  49           HA       THR  49   2.920  12.083  -5.549
  383    HB   THR  49           HB       THR  49   3.471  10.844  -2.846
  384    HG1  THR  49          1HG       THR  49   4.525   9.954  -5.313
  385   HG21  THR  49          1HG2      THR  49   2.767   8.975  -4.892
  386   HG22  THR  49          2HG2      THR  49   1.523  10.222  -4.798
  387   HG23  THR  49          3HG2      THR  49   1.955   9.297  -3.360
  388    H    ALA  50           HN       ALA  50   2.578  13.612  -2.445
  389    HA   ALA  50           HA       ALA  50   0.778  14.427  -1.316
  390    HB1  ALA  50          1HB       ALA  50  -0.643  14.081  -3.953
  391    HB2  ALA  50          2HB       ALA  50  -1.184  15.072  -2.598
  392    HB3  ALA  50          3HB       ALA  50   0.290  15.497  -3.467
  393    H    ILE  51           HN       ILE  51   1.133  11.367  -2.071
  394    HA   ILE  51           HA       ILE  51  -0.036   9.400  -1.777
  395    HB   ILE  51           HB       ILE  51  -0.692  10.918   0.749
  396   HG12  ILE  51          2HG1      ILE  51   1.250   9.762   1.679
  397   HG13  ILE  51          3HG1      ILE  51   1.517   8.938   0.146
  398   HG21  ILE  51          1HG2      ILE  51  -2.116   8.880   0.242
  399   HG22  ILE  51          2HG2      ILE  51  -0.641   7.932   0.419
  400   HG23  ILE  51          3HG2      ILE  51  -1.251   8.874   1.779
  401   HD11  ILE  51          1HD1      ILE  51   1.467  11.896   0.109
  402   HD12  ILE  51          2HD1      ILE  51   2.859  11.106   0.849
  403   HD13  ILE  51          3HD1      ILE  51   2.438  10.762  -0.828
  404    H    SER  52           HN       SER  52  -1.596   9.617  -3.452
  405    HA   SER  52           HA       SER  52  -4.218  10.661  -2.693
  406    HB2  SER  52          2HB       SER  52  -4.056  11.388  -4.825
  407    HB3  SER  52          3HB       SER  52  -2.782  10.233  -5.215
  408    HG   SER  52           HG       SER  52  -4.338   8.677  -5.588
  409    H    CYS  53           HN       CYS  53  -6.145   9.407  -3.039
  410    HA   CYS  53           HA       CYS  53  -6.404   7.086  -1.761
  411    HB2  CYS  53          2HB       CYS  53  -8.310   8.279  -2.731
  412    HB3  CYS  53          3HB       CYS  53  -7.833   7.757  -4.343
  413    HA   PRO  54           HA       PRO  54  -4.022   4.021  -3.863
  414    HB2  PRO  54          2HB       PRO  54  -5.082   1.834  -2.652
  415    HB3  PRO  54          3HB       PRO  54  -3.950   2.925  -1.845
  416    HG2  PRO  54          2HG       PRO  54  -6.935   2.811  -1.650
  417    HG3  PRO  54          3HG       PRO  54  -5.737   3.027  -0.361
  418    HD2  PRO  54          2HD       PRO  54  -7.128   5.095  -1.416
  419    HD3  PRO  54          3HD       PRO  54  -5.469   5.270  -0.811
  420    H    ASP  55           HN       ASP  55  -7.191   4.697  -4.434
  421    HA   ASP  55           HA       ASP  55  -7.516   2.440  -6.299
  422    HB2  ASP  55          2HB       ASP  55  -9.299   2.490  -4.665
  423    HB3  ASP  55          3HB       ASP  55  -9.601   4.196  -4.989
  424    H    ALA  56           HN       ALA  56  -6.416   3.303  -8.043
  425    HA   ALA  56           HA       ALA  56  -6.592   5.914  -9.003
  426    HB1  ALA  56          1HB       ALA  56  -4.902   4.932 -10.103
  427    HB2  ALA  56          2HB       ALA  56  -5.653   3.337 -10.037
  428    HB3  ALA  56          3HB       ALA  56  -6.147   4.492 -11.274
  429    H    ALA  57           HN       ALA  57  -8.973   3.535  -8.927
  430    HA   ALA  57           HA       ALA  57 -10.448   4.740 -11.168
  431    HB1  ALA  57          1HB       ALA  57 -11.959   2.698 -10.805
  432    HB2  ALA  57          2HB       ALA  57 -10.368   2.436 -11.520
  433    HB3  ALA  57          3HB       ALA  57 -10.641   2.071  -9.816
  434    H    CYS  58           HN       CYS  58 -10.109   5.797  -8.366
  435    HA   CYS  58           HA       CYS  58 -12.666   5.541  -7.100
  436    HB2  CYS  58          2HB       CYS  58 -10.496   6.048  -5.913
  437    HB3  CYS  58          3HB       CYS  58 -10.578   7.667  -6.601
  438    HA   PRO  59           HA       PRO  59 -14.834   8.536  -9.519
  439    HB2  PRO  59          2HB       PRO  59 -16.957   8.865  -7.859
  440    HB3  PRO  59          3HB       PRO  59 -16.744   7.434  -8.875
  441    HG2  PRO  59          2HG       PRO  59 -16.132   7.802  -5.968
  442    HG3  PRO  59          3HG       PRO  59 -16.900   6.428  -6.784
  443    HD2  PRO  59          2HD       PRO  59 -14.294   6.416  -6.054
  444    HD3  PRO  59          3HD       PRO  59 -14.887   5.560  -7.491
  445    H    LYS  60           HN       LYS  60 -13.450   9.078  -6.468
  446    HA   LYS  60           HA       LYS  60 -13.930  11.974  -6.729
  447    HB2  LYS  60          2HB       LYS  60 -13.951  10.230  -4.288
  448    HB3  LYS  60          3HB       LYS  60 -13.523  11.931  -4.154
  449    HG2  LYS  60          2HG       LYS  60 -16.003  11.313  -5.632
  450    HG3  LYS  60          3HG       LYS  60 -16.020  11.016  -3.892
  451    HD2  LYS  60          2HD       LYS  60 -14.819  13.477  -4.067
  452    HD3  LYS  60          3HD       LYS  60 -16.009  13.538  -5.369
  453    HE2  LYS  60          2HE       LYS  60 -17.769  13.482  -3.944
  454    HE3  LYS  60          3HE       LYS  60 -16.940  12.437  -2.791
  455    HZ1  LYS  60          1HZ       LYS  60 -16.966  15.348  -2.976
  456    HZ2  LYS  60          2HZ       LYS  60 -15.515  14.628  -2.488
  457    HZ3  LYS  60          3HZ       LYS  60 -16.934  14.350  -1.609
  458    H    GLN  61           HN       GLN  61 -11.692   9.392  -6.238
  459    HA   GLN  61           HA       GLN  61  -9.431   9.334  -5.840
  460    HB2  GLN  61          2HB       GLN  61  -9.853  11.425  -7.950
  461    HB3  GLN  61          3HB       GLN  61  -8.229  11.042  -7.393
  462    HG2  GLN  61          2HG       GLN  61  -9.295   8.566  -7.889
  463    HG3  GLN  61          3HG       GLN  61 -10.003   9.561  -9.161
  464   HE21  GLN  61          1HE2      GLN  61  -7.987  11.350  -9.632
  465   HE22  GLN  61          2HE2      GLN  61  -6.614  10.523 -10.277
  466    H    GLY  62           HN       GLY  62 -10.240  10.342  -3.630
  467    HA2  GLY  62          1HA       GLY  62  -9.420  13.045  -3.126
  468    HA3  GLY  62          2HA       GLY  62  -9.909  11.863  -1.923
  469    H    HIS  63           HN       HIS  63  -7.821  13.621  -1.465
  470    HA   HIS  63           HA       HIS  63  -5.411  11.964  -1.762
  471    HB2  HIS  63          2HB       HIS  63  -5.895  14.884  -1.587
  472    HB3  HIS  63          3HB       HIS  63  -4.443  14.282  -0.792
  473    HD1  HIS  63          1HD       HIS  63  -5.353  15.710  -3.839
  474    HD2  HIS  63          2HD       HIS  63  -3.069  12.387  -2.836
  475    HE1  HIS  63          1HE       HIS  63  -3.909  15.255  -5.848
  476    H    LEU  64           HN       LEU  64  -3.849  12.181   0.139
  477    HA   LEU  64           HA       LEU  64  -5.369  11.974   2.655
  478    HB2  LEU  64          2HB       LEU  64  -3.024  10.397   1.638
  479    HB3  LEU  64          3HB       LEU  64  -3.449  10.441   3.348
  480    HG   LEU  64           HG       LEU  64  -5.533   9.639   1.373
  481   HD11  LEU  64          1HD1      LEU  64  -3.079   8.107   2.049
  482   HD12  LEU  64          2HD1      LEU  64  -4.018   8.142   0.557
  483   HD13  LEU  64          3HD1      LEU  64  -4.609   7.236   1.949
  484   HD21  LEU  64          1HD2      LEU  64  -5.097   9.570   4.237
  485   HD22  LEU  64          2HD2      LEU  64  -5.549   7.990   3.598
  486   HD23  LEU  64          3HD2      LEU  64  -6.590   9.386   3.316
  487    H    GLN  65           HN       GLN  65  -4.180  12.517   4.613
  488    HA   GLN  65           HA       GLN  65  -2.523  14.863   4.191
  489    HB2  GLN  65          2HB       GLN  65  -2.881  14.155   6.966
  490    HB3  GLN  65          3HB       GLN  65  -3.426  15.588   6.102
  491    HG2  GLN  65          2HG       GLN  65  -5.404  14.700   6.855
  492    HG3  GLN  65          3HG       GLN  65  -5.305  14.037   5.224
  493   HE21  GLN  65          1HE2      GLN  65  -3.090  12.241   6.239
  494   HE22  GLN  65          2HE2      GLN  65  -3.925  10.950   7.026
  495    H    GLU  66           HN       GLU  66  -0.626  15.174   5.706
  496    HA   GLU  66           HA       GLU  66   1.094  12.833   5.476
  497    HB2  GLU  66          2HB       GLU  66   1.494  15.752   5.645
  498    HB3  GLU  66          3HB       GLU  66   2.708  14.781   6.467
  499    HG2  GLU  66          2HG       GLU  66   2.744  13.456   4.215
  500    HG3  GLU  66          3HG       GLU  66   2.056  14.945   3.568
  501    H    ASN  67           HN       ASN  67   0.154  15.201   7.960
  502    HA   ASN  67           HA       ASN  67   1.469  13.866  10.087
  503    HB2  ASN  67          2HB       ASN  67   1.066  15.977  10.803
  504    HB3  ASN  67          3HB       ASN  67  -0.364  16.152   9.789
  505   HD21  ASN  67          1HD2      ASN  67  -1.870  16.848  11.154
  506   HD22  ASN  67          2HD2      ASN  67  -2.338  16.051  12.614
  507    H    GLU  68           HN       GLU  68  -2.015  14.147   9.359
  508    HA   GLU  68           HA       GLU  68  -3.028  12.447  11.243
  509    HB2  GLU  68          2HB       GLU  68  -3.906  13.483   8.685
  510    HB3  GLU  68          3HB       GLU  68  -4.505  11.850   8.942
  511    HG2  GLU  68          2HG       GLU  68  -4.773  13.775  11.176
  512    HG3  GLU  68          3HG       GLU  68  -5.817  13.992   9.773
  513    H    ILE  69           HN       ILE  69  -1.916  11.514   7.991
  514    HA   ILE  69           HA       ILE  69  -2.347   8.752   8.307
  515    HB   ILE  69           HB       ILE  69  -0.582  10.337   6.466
  516   HG12  ILE  69          2HG1      ILE  69  -3.278   9.229   6.425
  517   HG13  ILE  69          3HG1      ILE  69  -2.558  10.469   5.402
  518   HG21  ILE  69          1HG2      ILE  69  -0.844   7.336   6.578
  519   HG22  ILE  69          2HG2      ILE  69  -0.090   8.240   5.266
  520   HG23  ILE  69          3HG2      ILE  69   0.615   8.278   6.880
  521   HD11  ILE  69          1HD1      ILE  69  -2.188   7.508   5.023
  522   HD12  ILE  69          2HD1      ILE  69  -3.350   8.506   4.149
  523   HD13  ILE  69          3HD1      ILE  69  -1.621   8.793   3.957
  524    H    GLU  70           HN       GLU  70   0.840  10.338   8.112
  525    HA   GLU  70           HA       GLU  70   2.376   8.286   9.073
  526    HB2  GLU  70          2HB       GLU  70   4.093   9.810   9.307
  527    HB3  GLU  70          3HB       GLU  70   3.014  10.681   8.227
  528    HG2  GLU  70          2HG       GLU  70   2.087  11.872  10.191
  529    HG3  GLU  70          3HG       GLU  70   3.292  11.069  11.197
  530    H    CYS  71           HN       CYS  71   0.125  10.200  10.812
  531    HA   CYS  71           HA       CYS  71   1.227   9.819  13.419
  532    HB2  CYS  71          2HB       CYS  71  -0.197  11.603  13.486
  533    HB3  CYS  71          3HB       CYS  71  -1.284  10.918  12.284
  534    HG   CYS  71           HG       CYS  71  -2.334  11.347  15.022
  535    H    MET  72           HN       MET  72  -1.180   8.144  11.460
  536    HA   MET  72           HA       MET  72  -1.928   6.322  13.542
  537    HB2  MET  72          2HB       MET  72  -3.489   5.524  12.079
  538    HB3  MET  72          3HB       MET  72  -3.182   7.080  11.319
  539    HG2  MET  72          2HG       MET  72  -1.315   5.610  10.087
  540    HG3  MET  72          3HG       MET  72  -2.510   4.358  10.413
  541    HE1  MET  72          1HE       MET  72  -1.628   4.850   7.642
  542    HE2  MET  72          2HE       MET  72  -3.113   3.902   7.726
  543    HE3  MET  72          3HE       MET  72  -3.003   5.272   6.620
  544    H    VAL  73           HN       VAL  73   0.911   6.631  12.092
  545    HA   VAL  73           HA       VAL  73   1.482   3.755  12.265
  546    HB   VAL  73           HB       VAL  73   3.251   4.420  10.364
  547   HG11  VAL  73          1HG1      VAL  73   0.458   3.735   9.526
  548   HG12  VAL  73          2HG1      VAL  73   1.991   3.124   8.900
  549   HG13  VAL  73          3HG1      VAL  73   1.417   2.611  10.487
  550   HG21  VAL  73          1HG2      VAL  73   1.805   6.708  10.412
  551   HG22  VAL  73          2HG2      VAL  73   2.676   6.116   8.998
  552   HG23  VAL  73          3HG2      VAL  73   0.949   5.801   9.166
  553    H    ALA  74           HN       ALA  74   3.402   6.635  11.441
  554    HA   ALA  74           HA       ALA  74   5.413   5.841  13.382
  555    HB1  ALA  74          1HB       ALA  74   5.324   7.962  11.255
  556    HB2  ALA  74          2HB       ALA  74   6.641   7.846  12.423
  557    HB3  ALA  74          3HB       ALA  74   6.323   6.510  11.316
  558    H    ALA  75           HN       ALA  75   3.068   6.539  14.645
  559    HA   ALA  75           HA       ALA  75   2.536   9.084  15.407
  560    HB1  ALA  75          1HB       ALA  75   1.435   8.216  17.197
  561    HB2  ALA  75          2HB       ALA  75   1.688   6.726  16.287
  562    HB3  ALA  75          3HB       ALA  75   2.758   7.134  17.629
  Start of MODEL    9
    1    H1   ALA   1           HN       ALA   1 -29.412 -12.382   3.136
    2    HA   ALA   1           HA       ALA   1 -27.718 -10.110   2.449
    3    HB1  ALA   1          1HB       ALA   1 -29.118  -8.861   3.665
    4    HB2  ALA   1          2HB       ALA   1 -30.181 -10.269   3.629
    5    HB3  ALA   1          3HB       ALA   1 -29.117 -10.003   5.010
    6    H    LEU   2           HN       LEU   2 -27.242  -9.266   5.141
    7    HA   LEU   2           HA       LEU   2 -25.616  -9.382   6.726
    8    HB2  LEU   2          2HB       LEU   2 -27.098 -11.608   7.013
    9    HB3  LEU   2          3HB       LEU   2 -25.525 -12.334   6.690
   10    HG   LEU   2           HG       LEU   2 -24.679 -10.814   8.597
   11   HD11  LEU   2          1HD1      LEU   2 -26.429  -9.352   9.022
   12   HD12  LEU   2          2HD1      LEU   2 -26.591 -10.548  10.310
   13   HD13  LEU   2          3HD1      LEU   2 -27.651 -10.619   8.902
   14   HD21  LEU   2          1HD2      LEU   2 -26.294 -13.309   8.791
   15   HD22  LEU   2          2HD2      LEU   2 -25.771 -12.519  10.279
   16   HD23  LEU   2          3HD2      LEU   2 -24.576 -13.047   9.093
   17    H    ASP   3           HN       ASP   3 -24.438  -8.778   4.531
   18    HA   ASP   3           HA       ASP   3 -22.043 -10.474   4.450
   19    HB2  ASP   3          2HB       ASP   3 -22.905  -9.185   1.907
   20    HB3  ASP   3          3HB       ASP   3 -22.007 -10.678   2.163
   21    HA   PRO   4           HA       PRO   4 -21.269  -5.855   4.986
   22    HB2  PRO   4          2HB       PRO   4 -20.086  -6.025   7.423
   23    HB3  PRO   4          3HB       PRO   4 -21.828  -5.817   7.215
   24    HG2  PRO   4          2HG       PRO   4 -20.274  -8.311   7.782
   25    HG3  PRO   4          3HG       PRO   4 -21.803  -7.760   8.491
   26    HD2  PRO   4          2HD       PRO   4 -21.695  -9.626   6.533
   27    HD3  PRO   4          3HD       PRO   4 -23.045  -8.485   6.690
   28    H    LEU   5           HN       LEU   5 -19.600  -8.742   4.699
   29    HA   LEU   5           HA       LEU   5 -16.932  -7.702   5.030
   30    HB2  LEU   5          2HB       LEU   5 -17.967 -10.292   3.893
   31    HB3  LEU   5          3HB       LEU   5 -16.257  -9.905   4.072
   32    HG   LEU   5           HG       LEU   5 -16.255 -10.342   6.286
   33   HD11  LEU   5          1HD1      LEU   5 -19.137  -9.486   6.503
   34   HD12  LEU   5          2HD1      LEU   5 -17.749  -8.432   6.770
   35   HD13  LEU   5          3HD1      LEU   5 -18.022  -9.813   7.831
   36   HD21  LEU   5          1HD2      LEU   5 -17.420 -12.278   6.751
   37   HD22  LEU   5          2HD2      LEU   5 -17.457 -12.250   4.987
   38   HD23  LEU   5          3HD2      LEU   5 -18.871 -11.735   5.909
   39    H    VAL   6           HN       VAL   6 -15.380  -8.301   3.082
   40    HA   VAL   6           HA       VAL   6 -14.654  -7.809   0.980
   41    HB   VAL   6           HB       VAL   6 -17.526  -7.711   0.081
   42   HG11  VAL   6          1HG1      VAL   6 -16.304  -7.101  -1.746
   43   HG12  VAL   6          2HG1      VAL   6 -14.871  -7.990  -1.224
   44   HG13  VAL   6          3HG1      VAL   6 -16.239  -8.854  -1.930
   45   HG21  VAL   6          1HG2      VAL   6 -17.797  -9.854   0.589
   46   HG22  VAL   6          2HG2      VAL   6 -16.410 -10.265  -0.419
   47   HG23  VAL   6          3HG2      VAL   6 -16.180  -9.909   1.292
   48    H    SER   7           HN       SER   7 -13.791  -5.822   1.065
   49    HA   SER   7           HA       SER   7 -15.397  -3.588   0.163
   50    HB2  SER   7          2HB       SER   7 -13.843  -2.836   2.542
   51    HB3  SER   7          3HB       SER   7 -15.477  -2.372   2.068
   52    HG   SER   7           HG       SER   7 -14.681  -4.796   3.311
   53    H    CYS   8           HN       CYS   8 -12.251  -4.508   1.550
   54    HA   CYS   8           HA       CYS   8 -10.765  -2.479   0.276
   55    HB2  CYS   8          2HB       CYS   8 -10.054  -3.925   2.250
   56    HB3  CYS   8          3HB       CYS   8  -9.688  -5.183   1.074
   57    H    LYS   9           HN       LYS   9  -9.322  -2.614  -1.503
   58    HA   LYS   9           HA       LYS   9  -9.792  -4.826  -3.373
   59    HB2  LYS   9          2HB       LYS   9  -9.707  -1.978  -4.336
   60    HB3  LYS   9          3HB       LYS   9 -10.256  -3.410  -5.198
   61    HG2  LYS   9          2HG       LYS   9 -12.228  -3.541  -3.838
   62    HG3  LYS   9          3HG       LYS   9 -11.654  -2.227  -2.808
   63    HD2  LYS   9          2HD       LYS   9 -11.554  -1.114  -5.316
   64    HD3  LYS   9          3HD       LYS   9 -12.992  -2.134  -5.404
   65    HE2  LYS   9          2HE       LYS   9 -12.478  -0.192  -3.161
   66    HE3  LYS   9          3HE       LYS   9 -13.363   0.239  -4.624
   67    HZ1  LYS   9          1HZ       LYS   9 -14.491  -2.109  -3.709
   68    HZ2  LYS   9          2HZ       LYS   9 -15.167  -0.560  -3.648
   69    HZ3  LYS   9          3HZ       LYS   9 -14.281  -1.148  -2.332
   70    H    LEU  10           HN       LEU  10  -7.594  -3.450  -1.581
   71    HA   LEU  10           HA       LEU  10  -5.518  -3.065  -3.590
   72    HB2  LEU  10          2HB       LEU  10  -5.670  -2.655  -0.625
   73    HB3  LEU  10          3HB       LEU  10  -4.119  -2.662  -1.462
   74    HG   LEU  10           HG       LEU  10  -6.315  -0.816  -2.327
   75   HD11  LEU  10          1HD1      LEU  10  -5.673   0.838  -0.797
   76   HD12  LEU  10          2HD1      LEU  10  -4.237  -0.057  -0.299
   77   HD13  LEU  10          3HD1      LEU  10  -5.838  -0.629   0.170
   78   HD21  LEU  10          1HD2      LEU  10  -3.740   0.313  -2.470
   79   HD22  LEU  10          2HD2      LEU  10  -4.768  -0.219  -3.799
   80   HD23  LEU  10          3HD2      LEU  10  -3.607  -1.336  -3.080
   81    H    CYS  11           HN       CYS  11  -6.586  -5.408  -1.253
   82    HA   CYS  11           HA       CYS  11  -4.360  -7.160  -2.057
   83    HB2  CYS  11          2HB       CYS  11  -4.457  -8.183   0.198
   84    HB3  CYS  11          3HB       CYS  11  -4.003  -6.483   0.247
   85    H    LEU  12           HN       LEU  12  -7.542  -6.652  -2.382
   86    HA   LEU  12           HA       LEU  12  -9.348  -7.918  -2.938
   87    HB2  LEU  12          2HB       LEU  12  -7.143  -9.862  -3.591
   88    HB3  LEU  12          3HB       LEU  12  -8.838 -10.132  -3.997
   89    HG   LEU  12           HG       LEU  12  -7.001  -8.007  -5.091
   90   HD11  LEU  12          1HD1      LEU  12  -7.429  -9.089  -7.212
   91   HD12  LEU  12          2HD1      LEU  12  -8.514 -10.242  -6.435
   92   HD13  LEU  12          3HD1      LEU  12  -6.792 -10.259  -6.056
   93   HD21  LEU  12          1HD2      LEU  12  -9.983  -8.324  -5.334
   94   HD22  LEU  12          2HD2      LEU  12  -9.018  -7.416  -6.498
   95   HD23  LEU  12          3HD2      LEU  12  -9.072  -6.907  -4.809
   96    H    GLY  13           HN       GLY  13  -9.333  -7.809  -0.366
   97    HA2  GLY  13          1HA       GLY  13  -9.651 -10.597   0.566
   98    HA3  GLY  13          2HA       GLY  13  -9.038  -9.316   1.601
   99    H    GLU  14           HN       GLU  14 -10.454  -8.359   2.901
  100    HA   GLU  14           HA       GLU  14 -13.065  -7.611   2.178
  101    HB2  GLU  14          2HB       GLU  14 -13.949  -9.343   4.100
  102    HB3  GLU  14          3HB       GLU  14 -14.109  -9.593   2.367
  103    HG2  GLU  14          2HG       GLU  14 -12.360 -11.100   2.286
  104    HG3  GLU  14          3HG       GLU  14 -11.657 -10.519   3.794
  105    H    TYR  15           HN       TYR  15 -12.003  -9.075   5.233
  106    HA   TYR  15           HA       TYR  15 -11.766  -8.221   7.327
  107    HB2  TYR  15          2HB       TYR  15 -11.084  -5.573   6.068
  108    HB3  TYR  15          3HB       TYR  15 -10.479  -6.259   7.571
  109    HD1  TYR  15          1HD       TYR  15 -10.210  -6.329   3.910
  110    HD2  TYR  15          2HD       TYR  15  -8.663  -7.848   7.571
  111    HE1  TYR  15          1HE       TYR  15  -8.250  -7.208   2.710
  112    HE2  TYR  15          2HE       TYR  15  -6.699  -8.730   6.381
  113    HH   TYR  15           HH       TYR  15  -6.035  -9.382   4.155
  114    HA   PRO  16           HA       PRO  16 -15.551  -6.288   8.432
  115    HB2  PRO  16          2HB       PRO  16 -14.933  -5.351  10.904
  116    HB3  PRO  16          3HB       PRO  16 -15.178  -7.067  10.560
  117    HG2  PRO  16          2HG       PRO  16 -12.620  -5.533  10.815
  118    HG3  PRO  16          3HG       PRO  16 -13.032  -7.135  11.454
  119    HD2  PRO  16          2HD       PRO  16 -11.559  -6.797   9.207
  120    HD3  PRO  16          3HD       PRO  16 -12.653  -8.177   9.433
  121    H    VAL  17           HN       VAL  17 -16.043  -4.096   9.943
  122    HA   VAL  17           HA       VAL  17 -14.975  -1.929   8.272
  123    HB   VAL  17           HB       VAL  17 -16.939  -0.765   8.547
  124   HG11  VAL  17          1HG1      VAL  17 -18.608  -2.169   7.852
  125   HG12  VAL  17          2HG1      VAL  17 -17.207  -3.217   7.620
  126   HG13  VAL  17          3HG1      VAL  17 -18.221  -3.402   9.052
  127   HG21  VAL  17          1HG2      VAL  17 -17.087  -0.497  10.863
  128   HG22  VAL  17          2HG2      VAL  17 -18.567  -1.355  10.439
  129   HG23  VAL  17          3HG2      VAL  17 -17.213  -2.233  11.150
  130    H    GLU  18           HN       GLU  18 -14.365  -3.293  11.177
  131    HA   GLU  18           HA       GLU  18 -13.852  -0.754  12.558
  132    HB2  GLU  18          2HB       GLU  18 -13.785  -3.590  13.604
  133    HB3  GLU  18          3HB       GLU  18 -13.493  -2.147  14.565
  134    HG2  GLU  18          2HG       GLU  18 -15.675  -1.655  14.734
  135    HG3  GLU  18          3HG       GLU  18 -16.028  -2.165  13.085
  136    H    GLN  19           HN       GLN  19 -12.302  -3.193  10.781
  137    HA   GLN  19           HA       GLN  19  -9.684  -2.625  11.962
  138    HB2  GLN  19          2HB       GLN  19 -10.817  -4.822  10.323
  139    HB3  GLN  19          3HB       GLN  19  -9.123  -4.433  10.054
  140    HG2  GLN  19          2HG       GLN  19  -8.527  -5.513  11.886
  141    HG3  GLN  19          3HG       GLN  19  -9.651  -4.569  12.864
  142   HE21  GLN  19          1HE2      GLN  19  -9.211  -7.485  11.007
  143   HE22  GLN  19          2HE2      GLN  19 -10.576  -8.331  11.641
  144    H    MET  20           HN       MET  20 -11.636  -1.441   9.563
  145    HA   MET  20           HA       MET  20  -9.459  -0.820   7.716
  146    HB2  MET  20          2HB       MET  20 -12.203   0.230   7.270
  147    HB3  MET  20          3HB       MET  20 -11.045  -0.416   6.115
  148    HG2  MET  20          2HG       MET  20 -11.546  -2.670   7.360
  149    HG3  MET  20          3HG       MET  20 -13.031  -1.836   7.811
  150    HE1  MET  20          1HE       MET  20 -11.514  -3.663   4.167
  151    HE2  MET  20          2HE       MET  20 -11.385  -1.967   3.700
  152    HE3  MET  20          3HE       MET  20 -10.596  -2.539   5.170
  153    H    THR  21           HN       THR  21  -9.594   1.506   6.794
  154    HA   THR  21           HA       THR  21 -10.156   3.467   8.895
  155    HB   THR  21           HB       THR  21  -7.480   3.031   7.590
  156    HG1  THR  21          1HG       THR  21  -8.491   3.171  10.228
  157   HG21  THR  21          1HG2      THR  21  -6.761   5.197   8.443
  158   HG22  THR  21          2HG2      THR  21  -8.390   5.523   9.033
  159   HG23  THR  21          3HG2      THR  21  -8.088   5.400   7.299
  160    H    THR  22           HN       THR  22 -11.175   5.191   8.110
  161    HA   THR  22           HA       THR  22 -11.874   5.438   5.403
  162    HB   THR  22           HB       THR  22 -11.945   7.572   7.546
  163    HG1  THR  22          1HG       THR  22 -13.235   5.891   8.198
  164   HG21  THR  22          1HG2      THR  22 -13.896   8.357   6.041
  165   HG22  THR  22          2HG2      THR  22 -13.113   7.393   4.790
  166   HG23  THR  22          3HG2      THR  22 -12.246   8.730   5.545
  167    H    ILE  23           HN       ILE  23 -11.269   6.966   3.828
  168    HA   ILE  23           HA       ILE  23  -8.490   7.473   3.660
  169    HB   ILE  23           HB       ILE  23 -10.796   8.477   1.998
  170   HG12  ILE  23          2HG1      ILE  23 -10.376   6.078   1.833
  171   HG13  ILE  23          3HG1      ILE  23  -9.904   6.879   0.339
  172   HG21  ILE  23          1HG2      ILE  23  -8.352   8.669   0.584
  173   HG22  ILE  23          2HG2      ILE  23  -9.455   9.964   1.045
  174   HG23  ILE  23          3HG2      ILE  23  -8.145   9.498   2.128
  175   HD11  ILE  23          1HD1      ILE  23  -8.274   5.447   2.319
  176   HD12  ILE  23          2HD1      ILE  23  -8.067   5.614   0.574
  177   HD13  ILE  23          3HD1      ILE  23  -7.561   6.916   1.652
  178    H    ALA  24           HN       ALA  24 -10.802  10.056   3.053
  179    HA   ALA  24           HA       ALA  24 -10.598  11.690   5.191
  180    HB1  ALA  24          1HB       ALA  24  -8.027  11.586   3.748
  181    HB2  ALA  24          2HB       ALA  24  -8.601  13.191   4.205
  182    HB3  ALA  24          3HB       ALA  24  -8.368  11.953   5.439
  183    H    GLN  25           HN       GLN  25 -10.200  11.585   1.697
  184    HA   GLN  25           HA       GLN  25 -11.748  14.076   1.467
  185    HB2  GLN  25          2HB       GLN  25  -9.536  12.927  -0.050
  186    HB3  GLN  25          3HB       GLN  25 -10.871  13.427  -1.079
  187    HG2  GLN  25          2HG       GLN  25  -9.292  15.224  -0.873
  188    HG3  GLN  25          3HG       GLN  25 -10.796  15.662  -0.062
  189   HE21  GLN  25          1HE2      GLN  25  -8.611  17.076   0.544
  190   HE22  GLN  25          2HE2      GLN  25  -8.032  16.680   2.123
  191    H    CYS  26           HN       CYS  26 -11.403  10.942  -0.208
  192    HA   CYS  26           HA       CYS  26 -14.054  11.156  -1.323
  193    HB2  CYS  26          2HB       CYS  26 -13.562   8.912  -2.271
  194    HB3  CYS  26          3HB       CYS  26 -12.325  10.105  -2.653
  195    H    GLN  27           HN       GLN  27 -12.508   9.522   1.353
  196    HA   GLN  27           HA       GLN  27 -13.447   8.604   3.233
  197    HB2  GLN  27          2HB       GLN  27 -16.175   8.742   1.984
  198    HB3  GLN  27          3HB       GLN  27 -15.742   8.781   3.687
  199    HG2  GLN  27          2HG       GLN  27 -15.537  10.962   1.650
  200    HG3  GLN  27          3HG       GLN  27 -16.385  10.962   3.195
  201   HE21  GLN  27          1HE2      GLN  27 -14.451  10.008   4.878
  202   HE22  GLN  27          2HE2      GLN  27 -13.143  11.134   4.962
  203    H    CYS  28           HN       CYS  28 -12.320   7.018   1.352
  204    HA   CYS  28           HA       CYS  28 -14.127   4.845   0.698
  205    HB2  CYS  28          2HB       CYS  28 -11.211   5.375   0.155
  206    HB3  CYS  28          3HB       CYS  28 -11.945   3.811  -0.191
  207    H    ILE  29           HN       ILE  29 -12.869   2.570   1.039
  208    HA   ILE  29           HA       ILE  29 -12.048   2.441   3.861
  209    HB   ILE  29           HB       ILE  29 -14.509   1.649   3.147
  210   HG12  ILE  29          2HG1      ILE  29 -14.255  -0.061   5.088
  211   HG13  ILE  29          3HG1      ILE  29 -12.603   0.537   5.187
  212   HG21  ILE  29          1HG2      ILE  29 -13.690   0.009   1.531
  213   HG22  ILE  29          2HG2      ILE  29 -12.802  -0.814   2.813
  214   HG23  ILE  29          3HG2      ILE  29 -14.565  -0.772   2.848
  215   HD11  ILE  29          1HD1      ILE  29 -13.948   2.863   5.190
  216   HD12  ILE  29          2HD1      ILE  29 -15.128   1.812   5.973
  217   HD13  ILE  29          3HD1      ILE  29 -13.507   1.976   6.649
  218    H    PHE  30           HN       PHE  30 -10.218   1.360   4.172
  219    HA   PHE  30           HA       PHE  30  -9.500  -0.885   2.489
  220    HB2  PHE  30          2HB       PHE  30  -7.763   1.589   2.618
  221    HB3  PHE  30          3HB       PHE  30  -7.281   0.052   1.907
  222    HD1  PHE  30          1HD       PHE  30  -8.993   3.160   1.394
  223    HD2  PHE  30          2HD       PHE  30  -8.544  -0.803  -0.094
  224    HE1  PHE  30          1HE       PHE  30  -9.954   3.863  -0.759
  225    HE2  PHE  30          2HE       PHE  30  -9.504  -0.106  -2.248
  226    HZ   PHE  30           HZ       PHE  30 -10.210   2.230  -2.584
  227    H    CYS  31           HN       CYS  31  -8.287  -2.358   3.552
  228    HA   CYS  31           HA       CYS  31  -8.058  -2.276   6.325
  229    HB2  CYS  31          2HB       CYS  31  -6.864  -4.321   6.169
  230    HB3  CYS  31          3HB       CYS  31  -7.991  -4.318   4.816
  231    H    THR  32           HN       THR  32  -6.646  -1.391   7.685
  232    HA   THR  32           HA       THR  32  -4.868   0.548   7.169
  233    HB   THR  32           HB       THR  32  -4.187  -1.544   9.229
  234    HG1  THR  32          1HG       THR  32  -6.210   0.461   9.296
  235   HG21  THR  32          1HG2      THR  32  -2.550   0.179   9.114
  236   HG22  THR  32          2HG2      THR  32  -3.557   0.536  10.517
  237   HG23  THR  32          3HG2      THR  32  -3.784   1.435   9.017
  238    H    LEU  33           HN       LEU  33  -3.946  -2.890   7.379
  239    HA   LEU  33           HA       LEU  33  -1.283  -2.771   6.863
  240    HB2  LEU  33          2HB       LEU  33  -3.358  -4.715   5.909
  241    HB3  LEU  33          3HB       LEU  33  -1.650  -4.936   5.533
  242    HG   LEU  33           HG       LEU  33  -2.104  -4.510   8.372
  243   HD11  LEU  33          1HD1      LEU  33  -3.354  -6.951   7.122
  244   HD12  LEU  33          2HD1      LEU  33  -4.246  -5.602   7.825
  245   HD13  LEU  33          3HD1      LEU  33  -3.210  -6.601   8.845
  246   HD21  LEU  33          1HD2      LEU  33  -0.071  -5.419   7.119
  247   HD22  LEU  33          2HD2      LEU  33  -0.972  -6.931   7.006
  248   HD23  LEU  33          3HD2      LEU  33  -0.567  -6.262   8.587
  249    H    CYS  34           HN       CYS  34  -3.887  -2.521   4.485
  250    HA   CYS  34           HA       CYS  34  -2.074  -2.298   2.262
  251    HB2  CYS  34          2HB       CYS  34  -5.045  -2.116   2.613
  252    HB3  CYS  34          3HB       CYS  34  -4.311  -1.527   1.126
  253    H    LEU  35           HN       LEU  35  -4.479  -0.042   3.629
  254    HA   LEU  35           HA       LEU  35  -3.602   2.224   2.263
  255    HB2  LEU  35          2HB       LEU  35  -5.684   1.730   3.830
  256    HB3  LEU  35          3HB       LEU  35  -4.662   2.529   5.022
  257    HG   LEU  35           HG       LEU  35  -4.576   4.526   3.613
  258   HD11  LEU  35          1HD1      LEU  35  -6.282   2.873   1.771
  259   HD12  LEU  35          2HD1      LEU  35  -4.748   3.669   1.420
  260   HD13  LEU  35          3HD1      LEU  35  -6.201   4.633   1.684
  261   HD21  LEU  35          1HD2      LEU  35  -6.526   5.320   4.414
  262   HD22  LEU  35          2HD2      LEU  35  -6.612   3.743   5.200
  263   HD23  LEU  35          3HD2      LEU  35  -7.476   4.023   3.688
  264    H    LYS  36           HN       LYS  36  -2.044   0.487   4.686
  265    HA   LYS  36           HA       LYS  36  -0.540   2.767   5.706
  266    HB2  LYS  36          2HB       LYS  36  -1.221   1.109   7.332
  267    HB3  LYS  36          3HB       LYS  36  -0.464  -0.174   6.398
  268    HG2  LYS  36          2HG       LYS  36   1.419   1.921   7.053
  269    HG3  LYS  36          3HG       LYS  36   0.660   1.240   8.494
  270    HD2  LYS  36          2HD       LYS  36   1.196  -1.023   7.149
  271    HD3  LYS  36          3HD       LYS  36   2.502  -0.002   6.543
  272    HE2  LYS  36          2HE       LYS  36   2.982   0.562   8.973
  273    HE3  LYS  36          3HE       LYS  36   1.899  -0.765   9.389
  274    HZ1  LYS  36          1HZ       LYS  36   4.336  -1.314   9.268
  275    HZ2  LYS  36          2HZ       LYS  36   4.225  -1.118   7.592
  276    HZ3  LYS  36          3HZ       LYS  36   3.314  -2.315   8.364
  277    H    GLN  37           HN       GLN  37   0.496  -0.468   4.633
  278    HA   GLN  37           HA       GLN  37   3.096   0.065   4.046
  279    HB2  GLN  37          2HB       GLN  37   1.262  -2.004   3.454
  280    HB3  GLN  37          3HB       GLN  37   2.071  -1.599   1.946
  281    HG2  GLN  37          2HG       GLN  37   3.744  -2.890   2.590
  282    HG3  GLN  37          3HG       GLN  37   4.107  -1.695   3.833
  283   HE21  GLN  37          1HE2      GLN  37   2.610  -4.750   3.140
  284   HE22  GLN  37          2HE2      GLN  37   2.430  -5.265   4.779
  285    H    TYR  38           HN       TYR  38   0.332   1.224   2.367
  286    HA   TYR  38           HA       TYR  38   1.738   1.869  -0.070
  287    HB2  TYR  38          2HB       TYR  38  -0.409   1.682  -0.728
  288    HB3  TYR  38          3HB       TYR  38  -1.026   1.965   0.895
  289    HD1  TYR  38          1HD       TYR  38  -2.586   3.661   0.874
  290    HD2  TYR  38          2HD       TYR  38   0.910   4.071  -1.516
  291    HE1  TYR  38          1HE       TYR  38  -3.312   5.915   0.209
  292    HE2  TYR  38          2HE       TYR  38   0.195   6.327  -2.186
  293    HH   TYR  38           HH       TYR  38  -1.485   7.810  -2.156
  294    H    VAL  39           HN       VAL  39   0.203   3.784   2.518
  295    HA   VAL  39           HA       VAL  39   1.430   6.221   1.625
  296    HB   VAL  39           HB       VAL  39   0.422   7.255   3.578
  297   HG11  VAL  39          1HG1      VAL  39  -1.741   5.410   2.740
  298   HG12  VAL  39          2HG1      VAL  39  -1.710   7.174   2.795
  299   HG13  VAL  39          3HG1      VAL  39  -0.916   6.318   1.473
  300   HG21  VAL  39          1HG2      VAL  39   0.746   5.700   5.310
  301   HG22  VAL  39          2HG2      VAL  39  -1.001   5.763   5.079
  302   HG23  VAL  39          3HG2      VAL  39  -0.073   4.413   4.423
  303    H    GLU  40           HN       GLU  40   1.807   4.163   4.510
  304    HA   GLU  40           HA       GLU  40   3.659   5.380   5.984
  305    HB2  GLU  40          2HB       GLU  40   2.791   2.840   5.896
  306    HB3  GLU  40          3HB       GLU  40   4.421   2.599   5.282
  307    HG2  GLU  40          2HG       GLU  40   4.316   4.285   7.658
  308    HG3  GLU  40          3HG       GLU  40   3.694   2.655   7.916
  309    H    LEU  41           HN       LEU  41   4.263   3.977   2.823
  310    HA   LEU  41           HA       LEU  41   7.101   4.363   2.915
  311    HB2  LEU  41          2HB       LEU  41   5.114   3.523   0.869
  312    HB3  LEU  41          3HB       LEU  41   6.686   4.099   0.314
  313    HG   LEU  41           HG       LEU  41   6.462   1.610   0.530
  314   HD11  LEU  41          1HD1      LEU  41   8.600   1.990   2.384
  315   HD12  LEU  41          2HD1      LEU  41   8.584   3.324   1.232
  316   HD13  LEU  41          3HD1      LEU  41   8.673   1.661   0.652
  317   HD21  LEU  41          1HD2      LEU  41   5.987   0.583   2.471
  318   HD22  LEU  41          2HD2      LEU  41   5.268   2.134   2.907
  319   HD23  LEU  41          3HD2      LEU  41   6.907   1.742   3.430
  320    H    LEU  42           HN       LEU  42   4.400   6.047   1.336
  321    HA   LEU  42           HA       LEU  42   6.070   8.096   0.241
  322    HB2  LEU  42          2HB       LEU  42   3.083   7.918   0.594
  323    HB3  LEU  42          3HB       LEU  42   3.905   9.220  -0.262
  324    HG   LEU  42           HG       LEU  42   4.459   6.466  -1.195
  325   HD11  LEU  42          1HD1      LEU  42   1.995   6.531  -0.694
  326   HD12  LEU  42          2HD1      LEU  42   2.421   6.213  -2.376
  327   HD13  LEU  42          3HD1      LEU  42   1.862   7.815  -1.896
  328   HD21  LEU  42          1HD2      LEU  42   4.242   9.219  -2.301
  329   HD22  LEU  42          2HD2      LEU  42   3.961   7.854  -3.382
  330   HD23  LEU  42          3HD2      LEU  42   5.499   8.002  -2.530
  331    H    ILE  43           HN       ILE  43   3.514   8.207   2.731
  332    HA   ILE  43           HA       ILE  43   3.713  10.716   3.665
  333    HB   ILE  43           HB       ILE  43   2.889   8.221   4.801
  334   HG12  ILE  43          2HG1      ILE  43   1.435   9.823   6.157
  335   HG13  ILE  43          3HG1      ILE  43   2.264  11.128   5.315
  336   HG21  ILE  43          1HG2      ILE  43   3.248   8.801   7.198
  337   HG22  ILE  43          2HG2      ILE  43   4.720   8.361   6.334
  338   HG23  ILE  43          3HG2      ILE  43   4.371  10.055   6.675
  339   HD11  ILE  43          1HD1      ILE  43   1.051  10.845   3.472
  340   HD12  ILE  43          2HD1      ILE  43   1.214   9.090   3.525
  341   HD13  ILE  43          3HD1      ILE  43  -0.026   9.890   4.489
  342    H    LYS  44           HN       LYS  44   6.001   8.117   4.364
  343    HA   LYS  44           HA       LYS  44   7.574   9.509   6.238
  344    HB2  LYS  44          2HB       LYS  44   7.696   7.008   4.797
  345    HB3  LYS  44          3HB       LYS  44   9.283   7.763   4.858
  346    HG2  LYS  44          2HG       LYS  44   8.836   6.194   6.724
  347    HG3  LYS  44          3HG       LYS  44   9.237   7.832   7.246
  348    HD2  LYS  44          2HD       LYS  44   7.416   7.586   8.553
  349    HD3  LYS  44          3HD       LYS  44   6.544   8.012   7.077
  350    HE2  LYS  44          2HE       LYS  44   5.485   6.064   7.212
  351    HE3  LYS  44          3HE       LYS  44   7.023   5.256   6.917
  352    HZ1  LYS  44          1HZ       LYS  44   6.652   4.340   8.906
  353    HZ2  LYS  44          2HZ       LYS  44   5.516   5.507   9.362
  354    HZ3  LYS  44          3HZ       LYS  44   7.169   5.821   9.542
  355    H    GLU  45           HN       GLU  45   7.786   9.233   2.716
  356    HA   GLU  45           HA       GLU  45  10.197  10.737   2.497
  357    HB2  GLU  45          2HB       GLU  45   8.368   9.376   0.718
  358    HB3  GLU  45          3HB       GLU  45   8.824  10.942   0.062
  359    HG2  GLU  45          2HG       GLU  45  10.735   8.796   0.954
  360    HG3  GLU  45          3HG       GLU  45  10.292   9.153  -0.714
  361    H    GLY  46           HN       GLY  46   7.193  11.672   0.880
  362    HA2  GLY  46          1HA       GLY  46   5.935  13.652   1.360
  363    HA3  GLY  46          2HA       GLY  46   7.349  14.310   2.170
  364    H    LEU  47           HN       LEU  47   8.805  13.098  -0.347
  365    HA   LEU  47           HA       LEU  47   9.413  15.417  -1.648
  366    HB2  LEU  47          2HB       LEU  47  10.443  14.147  -3.257
  367    HB3  LEU  47          3HB       LEU  47  10.324  13.000  -1.924
  368    HG   LEU  47           HG       LEU  47   8.324  13.085  -4.171
  369   HD11  LEU  47          1HD1      LEU  47   9.556  11.625  -5.438
  370   HD12  LEU  47          2HD1      LEU  47  10.513  11.068  -4.067
  371   HD13  LEU  47          3HD1      LEU  47  10.833  12.648  -4.779
  372   HD21  LEU  47          1HD2      LEU  47   7.391  11.282  -3.214
  373   HD22  LEU  47          2HD2      LEU  47   8.206  11.847  -1.756
  374   HD23  LEU  47          3HD2      LEU  47   8.948  10.595  -2.752
  375    H    GLU  48           HN       GLU  48   6.783  13.175  -2.458
  376    HA   GLU  48           HA       GLU  48   5.063  15.201  -3.372
  377    HB2  GLU  48          2HB       GLU  48   5.105  14.966  -5.726
  378    HB3  GLU  48          3HB       GLU  48   6.782  15.167  -5.236
  379    HG2  GLU  48          2HG       GLU  48   6.583  12.480  -5.186
  380    HG3  GLU  48          3HG       GLU  48   5.432  12.866  -6.464
  381    H    THR  49           HN       THR  49   3.855  13.530  -5.478
  382    HA   THR  49           HA       THR  49   2.556  11.643  -5.756
  383    HB   THR  49           HB       THR  49   3.121  10.748  -2.945
  384    HG1  THR  49          1HG       THR  49   4.812  10.548  -5.221
  385   HG21  THR  49          1HG2      THR  49   2.200   8.809  -3.598
  386   HG22  THR  49          2HG2      THR  49   3.084   8.804  -5.124
  387   HG23  THR  49          3HG2      THR  49   1.581   9.714  -4.978
  388    H    ALA  50           HN       ALA  50   2.455  13.574  -2.854
  389    HA   ALA  50           HA       ALA  50   0.747  14.359  -1.565
  390    HB1  ALA  50          1HB       ALA  50  -0.665  14.122  -4.218
  391    HB2  ALA  50          2HB       ALA  50  -1.325  14.961  -2.813
  392    HB3  ALA  50          3HB       ALA  50   0.161  15.538  -3.566
  393    H    ILE  51           HN       ILE  51   1.032  11.328  -2.104
  394    HA   ILE  51           HA       ILE  51  -0.172   9.383  -1.761
  395    HB   ILE  51           HB       ILE  51  -0.883  11.041   0.661
  396   HG12  ILE  51          2HG1      ILE  51   1.023   9.903   1.704
  397   HG13  ILE  51          3HG1      ILE  51   1.336   9.033   0.205
  398   HG21  ILE  51          1HG2      ILE  51  -2.319   9.008   0.253
  399   HG22  ILE  51          2HG2      ILE  51  -0.860   8.040   0.462
  400   HG23  ILE  51          3HG2      ILE  51  -1.453   9.038   1.789
  401   HD11  ILE  51          1HD1      ILE  51   2.629  11.254   0.906
  402   HD12  ILE  51          2HD1      ILE  51   2.321  10.810  -0.773
  403   HD13  ILE  51          3HD1      ILE  51   1.276  11.978   0.037
  404    H    SER  52           HN       SER  52  -1.685   9.522  -3.486
  405    HA   SER  52           HA       SER  52  -4.320  10.615  -2.844
  406    HB2  SER  52          2HB       SER  52  -4.050   9.352  -5.461
  407    HB3  SER  52          3HB       SER  52  -4.552  10.992  -5.051
  408    HG   SER  52           HG       SER  52  -2.631  11.081  -6.204
  409    H    CYS  53           HN       CYS  53  -6.237   9.364  -3.121
  410    HA   CYS  53           HA       CYS  53  -6.506   7.073  -1.793
  411    HB2  CYS  53          2HB       CYS  53  -8.409   8.259  -2.775
  412    HB3  CYS  53          3HB       CYS  53  -7.945   7.700  -4.380
  413    HA   PRO  54           HA       PRO  54  -4.162   3.944  -3.844
  414    HB2  PRO  54          2HB       PRO  54  -5.231   1.792  -2.580
  415    HB3  PRO  54          3HB       PRO  54  -4.085   2.891  -1.803
  416    HG2  PRO  54          2HG       PRO  54  -7.070   2.806  -1.588
  417    HG3  PRO  54          3HG       PRO  54  -5.863   3.038  -0.310
  418    HD2  PRO  54          2HD       PRO  54  -7.244   5.096  -1.400
  419    HD3  PRO  54          3HD       PRO  54  -5.580   5.270  -0.810
  420    H    ASP  55           HN       ASP  55  -7.327   4.635  -4.412
  421    HA   ASP  55           HA       ASP  55  -7.656   2.362  -6.258
  422    HB2  ASP  55          2HB       ASP  55  -9.421   3.378  -4.290
  423    HB3  ASP  55          3HB       ASP  55 -10.112   3.790  -5.857
  424    H    ALA  56           HN       ALA  56  -6.608   3.269  -8.013
  425    HA   ALA  56           HA       ALA  56  -6.878   5.881  -8.951
  426    HB1  ALA  56          1HB       ALA  56  -6.249   4.797 -11.204
  427    HB2  ALA  56          2HB       ALA  56  -5.107   4.687  -9.864
  428    HB3  ALA  56          3HB       ALA  56  -6.121   3.304 -10.274
  429    H    ALA  57           HN       ALA  57  -9.185   3.432  -8.851
  430    HA   ALA  57           HA       ALA  57 -10.700   4.494 -11.122
  431    HB1  ALA  57          1HB       ALA  57 -10.989   2.006  -9.461
  432    HB2  ALA  57          2HB       ALA  57 -12.234   2.542 -10.590
  433    HB3  ALA  57          3HB       ALA  57 -10.621   2.143 -11.181
  434    H    CYS  58           HN       CYS  58 -10.287   5.507  -8.160
  435    HA   CYS  58           HA       CYS  58 -12.882   5.561  -7.017
  436    HB2  CYS  58          2HB       CYS  58 -10.663   5.978  -5.835
  437    HB3  CYS  58          3HB       CYS  58 -10.705   7.595  -6.534
  438    HA   PRO  59           HA       PRO  59 -14.783   8.605  -9.598
  439    HB2  PRO  59          2HB       PRO  59 -16.916   9.136  -8.005
  440    HB3  PRO  59          3HB       PRO  59 -16.778   7.658  -8.965
  441    HG2  PRO  59          2HG       PRO  59 -16.210   8.089  -6.057
  442    HG3  PRO  59          3HG       PRO  59 -17.052   6.741  -6.846
  443    HD2  PRO  59          2HD       PRO  59 -14.469   6.580  -6.048
  444    HD3  PRO  59          3HD       PRO  59 -15.085   5.714  -7.471
  445    H    LYS  60           HN       LYS  60 -13.654   9.161  -6.390
  446    HA   LYS  60           HA       LYS  60 -13.850  12.072  -6.813
  447    HB2  LYS  60          2HB       LYS  60 -15.161  11.640  -4.915
  448    HB3  LYS  60          3HB       LYS  60 -14.047  10.422  -4.310
  449    HG2  LYS  60          2HG       LYS  60 -12.681  11.948  -3.340
  450    HG3  LYS  60          3HG       LYS  60 -13.018  13.186  -4.552
  451    HD2  LYS  60          2HD       LYS  60 -15.237  12.363  -2.754
  452    HD3  LYS  60          3HD       LYS  60 -13.946  13.353  -2.070
  453    HE2  LYS  60          2HE       LYS  60 -14.323  14.839  -4.161
  454    HE3  LYS  60          3HE       LYS  60 -15.873  14.005  -4.265
  455    HZ1  LYS  60          1HZ       LYS  60 -15.000  15.275  -1.748
  456    HZ2  LYS  60          2HZ       LYS  60 -16.567  14.877  -2.246
  457    HZ3  LYS  60          3HZ       LYS  60 -15.759  16.181  -2.959
  458    H    GLN  61           HN       GLN  61 -11.804   9.372  -6.161
  459    HA   GLN  61           HA       GLN  61  -9.562   9.157  -5.774
  460    HB2  GLN  61          2HB       GLN  61  -9.538  11.593  -7.565
  461    HB3  GLN  61          3HB       GLN  61  -8.145  10.575  -7.221
  462    HG2  GLN  61          2HG       GLN  61  -9.697   8.671  -8.122
  463    HG3  GLN  61          3HG       GLN  61 -10.540  10.013  -8.896
  464   HE21  GLN  61          1HE2      GLN  61  -9.688   8.482 -10.697
  465   HE22  GLN  61          2HE2      GLN  61  -8.188   8.962 -11.406
  466    H    GLY  62           HN       GLY  62 -10.698  10.312  -3.610
  467    HA2  GLY  62          1HA       GLY  62  -9.727  12.819  -2.825
  468    HA3  GLY  62          2HA       GLY  62 -10.202  11.529  -1.729
  469    H    HIS  63           HN       HIS  63  -7.953  13.497  -1.667
  470    HA   HIS  63           HA       HIS  63  -5.632  11.724  -1.823
  471    HB2  HIS  63          2HB       HIS  63  -5.963  14.701  -1.541
  472    HB3  HIS  63          3HB       HIS  63  -4.422  13.923  -1.187
  473    HD1  HIS  63          1HD       HIS  63  -6.648  14.911  -3.993
  474    HD2  HIS  63          2HD       HIS  63  -3.082  12.856  -3.436
  475    HE1  HIS  63          1HE       HIS  63  -5.630  14.703  -6.282
  476    H    LEU  64           HN       LEU  64  -3.999  12.024   0.012
  477    HA   LEU  64           HA       LEU  64  -5.430  12.023   2.588
  478    HB2  LEU  64          2HB       LEU  64  -3.233  10.251   1.568
  479    HB3  LEU  64          3HB       LEU  64  -3.541  10.440   3.293
  480    HG   LEU  64           HG       LEU  64  -5.820   9.651   1.556
  481   HD11  LEU  64          1HD1      LEU  64  -4.407   8.084   0.643
  482   HD12  LEU  64          2HD1      LEU  64  -5.007   7.226   2.061
  483   HD13  LEU  64          3HD1      LEU  64  -3.411   7.976   2.095
  484   HD21  LEU  64          1HD2      LEU  64  -6.718   9.386   3.566
  485   HD22  LEU  64          2HD2      LEU  64  -5.178   9.763   4.338
  486   HD23  LEU  64          3HD2      LEU  64  -5.557   8.098   3.893
  487    H    GLN  65           HN       GLN  65  -4.122  12.602   4.465
  488    HA   GLN  65           HA       GLN  65  -2.429  14.868   3.863
  489    HB2  GLN  65          2HB       GLN  65  -2.624  14.117   6.675
  490    HB3  GLN  65          3HB       GLN  65  -3.039  15.633   5.885
  491    HG2  GLN  65          2HG       GLN  65  -5.072  14.962   6.698
  492    HG3  GLN  65          3HG       GLN  65  -5.122  14.323   5.056
  493   HE21  GLN  65          1HE2      GLN  65  -3.087  12.267   5.937
  494   HE22  GLN  65          2HE2      GLN  65  -4.027  11.065   6.747
  495    H    GLU  66           HN       GLU  66  -0.401  15.165   5.209
  496    HA   GLU  66           HA       GLU  66   1.252  12.791   4.859
  497    HB2  GLU  66          2HB       GLU  66   1.673  15.662   4.768
  498    HB3  GLU  66          3HB       GLU  66   2.873  14.868   5.778
  499    HG2  GLU  66          2HG       GLU  66   2.734  13.260   3.537
  500    HG3  GLU  66          3HG       GLU  66   2.597  14.897   2.897
  501    H    ASN  67           HN       ASN  67   0.076  14.913   7.387
  502    HA   ASN  67           HA       ASN  67   1.674  13.579   9.417
  503    HB2  ASN  67          2HB       ASN  67   1.490  15.901   9.799
  504    HB3  ASN  67          3HB       ASN  67  -0.238  15.906   9.458
  505   HD21  ASN  67          1HD2      ASN  67  -0.385  17.059  11.484
  506   HD22  ASN  67          2HD2      ASN  67  -0.426  16.169  12.965
  507    H    GLU  68           HN       GLU  68  -1.806  14.317   9.107
  508    HA   GLU  68           HA       GLU  68  -2.883  12.750  11.002
  509    HB2  GLU  68          2HB       GLU  68  -3.778  13.752   8.438
  510    HB3  GLU  68          3HB       GLU  68  -4.516  12.197   8.798
  511    HG2  GLU  68          2HG       GLU  68  -4.494  14.306  10.897
  512    HG3  GLU  68          3HG       GLU  68  -5.639  14.429   9.563
  513    H    ILE  69           HN       ILE  69  -1.546  11.618   7.953
  514    HA   ILE  69           HA       ILE  69  -2.382   8.901   8.319
  515    HB   ILE  69           HB       ILE  69  -0.501  10.247   6.401
  516   HG12  ILE  69          2HG1      ILE  69  -3.277   9.295   6.406
  517   HG13  ILE  69          3HG1      ILE  69  -2.507  10.517   5.400
  518   HG21  ILE  69          1HG2      ILE  69   0.515   8.109   6.920
  519   HG22  ILE  69          2HG2      ILE  69  -1.018   7.286   6.638
  520   HG23  ILE  69          3HG2      ILE  69  -0.180   8.070   5.299
  521   HD11  ILE  69          1HD1      ILE  69  -2.282   7.547   4.978
  522   HD12  ILE  69          2HD1      ILE  69  -3.378   8.622   4.108
  523   HD13  ILE  69          3HD1      ILE  69  -1.633   8.814   3.936
  524    H    GLU  70           HN       GLU  70   0.866  10.388   8.255
  525    HA   GLU  70           HA       GLU  70   2.325   8.244   9.165
  526    HB2  GLU  70          2HB       GLU  70   4.069   9.709   9.484
  527    HB3  GLU  70          3HB       GLU  70   3.031  10.672   8.443
  528    HG2  GLU  70          2HG       GLU  70   2.177  11.882  10.347
  529    HG3  GLU  70          3HG       GLU  70   3.106  10.863  11.445
  530    H    CYS  71           HN       CYS  71   0.072  10.164  10.902
  531    HA   CYS  71           HA       CYS  71   1.078   9.599  13.524
  532    HB2  CYS  71          2HB       CYS  71  -1.080  11.143  12.360
  533    HB3  CYS  71          3HB       CYS  71  -1.637  10.231  13.757
  534    HG   CYS  71           HG       CYS  71  -0.851  12.003  15.424
  535    H    MET  72           HN       MET  72  -1.207   8.116  11.329
  536    HA   MET  72           HA       MET  72  -2.220   6.283  13.320
  537    HB2  MET  72          2HB       MET  72  -3.805   5.718  11.789
  538    HB3  MET  72          3HB       MET  72  -3.323   7.253  11.080
  539    HG2  MET  72          2HG       MET  72  -1.622   5.818   9.753
  540    HG3  MET  72          3HG       MET  72  -2.678   4.479  10.194
  541    HE1  MET  72          1HE       MET  72  -2.958   6.152   6.428
  542    HE2  MET  72          2HE       MET  72  -1.691   5.585   7.516
  543    HE3  MET  72          3HE       MET  72  -2.959   4.478   6.986
  544    H    VAL  73           HN       VAL  73   0.689   6.462  12.069
  545    HA   VAL  73           HA       VAL  73   1.038   3.548  12.025
  546    HB   VAL  73           HB       VAL  73   2.841   3.937  10.246
  547   HG11  VAL  73          1HG1      VAL  73   1.364   3.357   8.563
  548   HG12  VAL  73          2HG1      VAL  73   0.455   2.932  10.015
  549   HG13  VAL  73          3HG1      VAL  73   0.101   4.433   9.159
  550   HG21  VAL  73          1HG2      VAL  73   1.529   6.581  10.340
  551   HG22  VAL  73          2HG2      VAL  73   3.182   6.149   9.903
  552   HG23  VAL  73          3HG2      VAL  73   1.876   5.934   8.737
  553    H    ALA  74           HN       ALA  74   2.935   6.567  11.831
  554    HA   ALA  74           HA       ALA  74   4.914   5.396  13.641
  555    HB1  ALA  74          1HB       ALA  74   5.053   7.989  12.107
  556    HB2  ALA  74          2HB       ALA  74   6.371   7.199  12.974
  557    HB3  ALA  74          3HB       ALA  74   5.683   6.442  11.538
  558    H    ALA  75           HN       ALA  75   2.332   6.179  14.663
  559    HA   ALA  75           HA       ALA  75   1.913   8.542  15.820
  560    HB1  ALA  75          1HB       ALA  75   0.390   7.293  16.843
  561    HB2  ALA  75          2HB       ALA  75   1.327   5.828  16.545
  562    HB3  ALA  75          3HB       ALA  75   1.631   6.790  17.991
  Start of MODEL   10
    1    H1   ALA   1           HN       ALA   1 -25.495 -14.071   4.461
    2    HA   ALA   1           HA       ALA   1 -24.107 -12.237   4.053
    3    HB1  ALA   1          1HB       ALA   1 -26.096 -11.745   1.867
    4    HB2  ALA   1          2HB       ALA   1 -24.335 -11.661   1.809
    5    HB3  ALA   1          3HB       ALA   1 -25.140 -13.227   1.913
    6    H    LEU   2           HN       LEU   2 -24.153 -10.641   5.552
    7    HA   LEU   2           HA       LEU   2 -25.956  -8.394   5.018
    8    HB2  LEU   2          2HB       LEU   2 -27.028  -9.520   6.819
    9    HB3  LEU   2          3HB       LEU   2 -25.504  -9.721   7.680
   10    HG   LEU   2           HG       LEU   2 -25.729  -6.988   7.467
   11   HD11  LEU   2          1HD1      LEU   2 -28.073  -7.400   6.620
   12   HD12  LEU   2          2HD1      LEU   2 -27.927  -6.338   8.019
   13   HD13  LEU   2          3HD1      LEU   2 -28.450  -8.009   8.232
   14   HD21  LEU   2          1HD2      LEU   2 -26.144  -9.031   9.564
   15   HD22  LEU   2          2HD2      LEU   2 -26.718  -7.401   9.916
   16   HD23  LEU   2          3HD2      LEU   2 -25.023  -7.671   9.508
   17    H    ASP   3           HN       ASP   3 -23.398  -9.293   7.339
   18    HA   ASP   3           HA       ASP   3 -21.953  -6.853   6.532
   19    HB2  ASP   3          2HB       ASP   3 -21.167  -6.596   8.810
   20    HB3  ASP   3          3HB       ASP   3 -22.927  -6.682   8.810
   21    HA   PRO   4           HA       PRO   4 -19.328 -10.636   5.781
   22    HB2  PRO   4          2HB       PRO   4 -18.633  -9.957   3.246
   23    HB3  PRO   4          3HB       PRO   4 -20.095 -10.875   3.629
   24    HG2  PRO   4          2HG       PRO   4 -19.788  -7.953   3.055
   25    HG3  PRO   4          3HG       PRO   4 -21.030  -9.080   2.482
   26    HD2  PRO   4          2HD       PRO   4 -21.456  -7.363   4.532
   27    HD3  PRO   4          3HD       PRO   4 -22.225  -8.961   4.450
   28    H    LEU   5           HN       LEU   5 -17.035 -10.713   5.476
   29    HA   LEU   5           HA       LEU   5 -15.705  -8.329   6.421
   30    HB2  LEU   5          2HB       LEU   5 -14.707 -11.103   5.806
   31    HB3  LEU   5          3HB       LEU   5 -13.687  -9.805   6.423
   32    HG   LEU   5           HG       LEU   5 -15.815  -9.957   8.219
   33   HD11  LEU   5          1HD1      LEU   5 -14.794 -12.714   8.181
   34   HD12  LEU   5          2HD1      LEU   5 -15.937 -12.312   6.899
   35   HD13  LEU   5          3HD1      LEU   5 -16.396 -12.096   8.588
   36   HD21  LEU   5          1HD2      LEU   5 -13.622  -9.434   8.923
   37   HD22  LEU   5          2HD2      LEU   5 -12.974 -10.946   8.285
   38   HD23  LEU   5          3HD2      LEU   5 -14.031 -10.965   9.698
   39    H    VAL   6           HN       VAL   6 -15.504 -10.434   3.565
   40    HA   VAL   6           HA       VAL   6 -13.494  -9.484   2.103
   41    HB   VAL   6           HB       VAL   6 -14.960 -11.083   1.113
   42   HG11  VAL   6          1HG1      VAL   6 -17.169 -10.935   1.256
   43   HG12  VAL   6          2HG1      VAL   6 -16.999  -9.343   1.997
   44   HG13  VAL   6          3HG1      VAL   6 -17.163  -9.490   0.246
   45   HG21  VAL   6          1HG2      VAL   6 -13.852  -9.040  -0.276
   46   HG22  VAL   6          2HG2      VAL   6 -14.650 -10.426  -1.019
   47   HG23  VAL   6          3HG2      VAL   6 -15.535  -8.918  -0.792
   48    H    SER   7           HN       SER   7 -12.860  -7.384   2.498
   49    HA   SER   7           HA       SER   7 -14.489  -5.326   1.184
   50    HB2  SER   7          2HB       SER   7 -14.555  -5.396   3.827
   51    HB3  SER   7          3HB       SER   7 -12.995  -4.588   3.669
   52    HG   SER   7           HG       SER   7 -15.370  -3.494   3.516
   53    H    CYS   8           HN       CYS   8 -12.611  -3.250   2.055
   54    HA   CYS   8           HA       CYS   8 -10.777  -2.187   1.227
   55    HB2  CYS   8          2HB       CYS   8  -9.453  -3.576   2.600
   56    HB3  CYS   8          3HB       CYS   8  -9.741  -4.991   1.591
   57    H    LYS   9           HN       LYS   9  -9.333  -1.955  -0.657
   58    HA   LYS   9           HA       LYS   9 -10.117  -3.543  -2.988
   59    HB2  LYS   9          2HB       LYS   9  -9.892  -0.672  -3.559
   60    HB3  LYS   9          3HB       LYS   9 -11.059  -1.850  -4.145
   61    HG2  LYS   9          2HG       LYS   9 -12.366  -1.638  -2.144
   62    HG3  LYS   9          3HG       LYS   9 -11.144  -0.597  -1.410
   63    HD2  LYS   9          2HD       LYS   9 -11.792   1.223  -2.598
   64    HD3  LYS   9          3HD       LYS   9 -12.203   0.274  -4.029
   65    HE2  LYS   9          2HE       LYS   9 -13.860   0.169  -1.526
   66    HE3  LYS   9          3HE       LYS   9 -14.113   1.408  -2.754
   67    HZ1  LYS   9          1HZ       LYS   9 -14.949  -0.081  -4.221
   68    HZ2  LYS   9          2HZ       LYS   9 -15.387  -0.885  -2.799
   69    HZ3  LYS   9          3HZ       LYS   9 -14.009  -1.368  -3.652
   70    H    LEU  10           HN       LEU  10  -7.775  -3.973  -1.829
   71    HA   LEU  10           HA       LEU  10  -5.884  -2.882  -3.761
   72    HB2  LEU  10          2HB       LEU  10  -5.683  -2.592  -0.790
   73    HB3  LEU  10          3HB       LEU  10  -4.225  -2.697  -1.774
   74    HG   LEU  10           HG       LEU  10  -6.364  -0.612  -2.174
   75   HD11  LEU  10          1HD1      LEU  10  -3.720  -0.183  -0.820
   76   HD12  LEU  10          2HD1      LEU  10  -5.189  -0.557   0.080
   77   HD13  LEU  10          3HD1      LEU  10  -5.105   0.905  -0.902
   78   HD21  LEU  10          1HD2      LEU  10  -4.260  -1.444  -3.795
   79   HD22  LEU  10          2HD2      LEU  10  -3.678   0.027  -3.017
   80   HD23  LEU  10          3HD2      LEU  10  -5.183   0.052  -3.937
   81    H    CYS  11           HN       CYS  11  -6.610  -5.198  -1.214
   82    HA   CYS  11           HA       CYS  11  -4.726  -7.078  -2.482
   83    HB2  CYS  11          2HB       CYS  11  -4.313  -8.084  -0.318
   84    HB3  CYS  11          3HB       CYS  11  -3.989  -6.357  -0.221
   85    H    LEU  12           HN       LEU  12  -7.926  -6.398  -1.705
   86    HA   LEU  12           HA       LEU  12  -9.875  -7.560  -1.854
   87    HB2  LEU  12          2HB       LEU  12  -8.081  -9.330  -3.498
   88    HB3  LEU  12          3HB       LEU  12  -9.811  -9.613  -3.327
   89    HG   LEU  12           HG       LEU  12  -8.740  -8.271  -5.376
   90   HD11  LEU  12          1HD1      LEU  12 -11.046  -8.937  -5.245
   91   HD12  LEU  12          2HD1      LEU  12 -10.964  -7.229  -5.676
   92   HD13  LEU  12          3HD1      LEU  12 -11.375  -7.703  -4.029
   93   HD21  LEU  12          1HD2      LEU  12  -9.178  -5.843  -4.984
   94   HD22  LEU  12          2HD2      LEU  12  -7.782  -6.482  -4.117
   95   HD23  LEU  12          3HD2      LEU  12  -9.297  -6.199  -3.261
   96    H    GLY  13           HN       GLY  13  -8.984  -7.864   0.557
   97    HA2  GLY  13          1HA       GLY  13  -8.824 -10.745   1.136
   98    HA3  GLY  13          2HA       GLY  13  -8.331  -9.460   2.228
   99    H    GLU  14           HN       GLU  14  -9.604  -9.437   3.951
  100    HA   GLU  14           HA       GLU  14 -12.410  -9.012   3.716
  101    HB2  GLU  14          2HB       GLU  14 -12.783 -11.156   5.258
  102    HB3  GLU  14          3HB       GLU  14 -12.901 -11.227   3.504
  103    HG2  GLU  14          2HG       GLU  14 -10.512 -11.940   3.449
  104    HG3  GLU  14          3HG       GLU  14 -10.563 -12.043   5.208
  105    H    TYR  15           HN       TYR  15 -12.847  -7.632   5.291
  106    HA   TYR  15           HA       TYR  15 -12.008  -8.125   8.001
  107    HB2  TYR  15          2HB       TYR  15 -11.193  -5.426   7.084
  108    HB3  TYR  15          3HB       TYR  15 -10.462  -6.473   8.296
  109    HD1  TYR  15          1HD       TYR  15 -10.473  -5.480   4.799
  110    HD2  TYR  15          2HD       TYR  15  -8.902  -8.260   7.611
  111    HE1  TYR  15          1HE       TYR  15  -8.720  -6.105   3.191
  112    HE2  TYR  15          2HE       TYR  15  -7.144  -8.892   6.011
  113    HH   TYR  15           HH       TYR  15  -6.279  -8.561   3.999
  114    HA   PRO  16           HA       PRO  16 -15.709  -5.956   8.923
  115    HB2  PRO  16          2HB       PRO  16 -15.117  -4.857  11.334
  116    HB3  PRO  16          3HB       PRO  16 -15.403  -6.587  11.111
  117    HG2  PRO  16          2HG       PRO  16 -12.809  -5.107  11.312
  118    HG3  PRO  16          3HG       PRO  16 -13.279  -6.647  12.056
  119    HD2  PRO  16          2HD       PRO  16 -11.751  -6.514   9.825
  120    HD3  PRO  16          3HD       PRO  16 -12.888  -7.844  10.126
  121    H    VAL  17           HN       VAL  17 -16.139  -3.640  10.293
  122    HA   VAL  17           HA       VAL  17 -15.023  -1.638   8.461
  123    HB   VAL  17           HB       VAL  17 -17.602  -1.905   9.899
  124   HG11  VAL  17          1HG1      VAL  17 -16.317   0.768   9.352
  125   HG12  VAL  17          2HG1      VAL  17 -18.022   0.530   9.740
  126   HG13  VAL  17          3HG1      VAL  17 -16.781   0.118  10.924
  127   HG21  VAL  17          1HG2      VAL  17 -16.872  -2.030   7.310
  128   HG22  VAL  17          2HG2      VAL  17 -18.490  -1.579   7.848
  129   HG23  VAL  17          3HG2      VAL  17 -17.321  -0.329   7.423
  130    H    GLU  18           HN       GLU  18 -14.780  -2.726  11.649
  131    HA   GLU  18           HA       GLU  18 -13.946  -0.129  12.697
  132    HB2  GLU  18          2HB       GLU  18 -15.043  -2.539  13.833
  133    HB3  GLU  18          3HB       GLU  18 -13.536  -2.129  14.639
  134    HG2  GLU  18          2HG       GLU  18 -14.577   0.259  14.755
  135    HG3  GLU  18          3HG       GLU  18 -16.094  -0.608  14.520
  136    H    GLN  19           HN       GLN  19 -12.529  -2.318  10.844
  137    HA   GLN  19           HA       GLN  19  -9.935  -2.150  12.231
  138    HB2  GLN  19          2HB       GLN  19 -11.166  -4.275  10.533
  139    HB3  GLN  19          3HB       GLN  19  -9.419  -4.079  10.496
  140    HG2  GLN  19          2HG       GLN  19  -9.324  -4.399  12.910
  141    HG3  GLN  19          3HG       GLN  19 -11.077  -4.580  12.957
  142   HE21  GLN  19          1HE2      GLN  19 -11.579  -6.617  13.289
  143   HE22  GLN  19          2HE2      GLN  19 -10.833  -7.987  12.546
  144    H    MET  20           HN       MET  20 -11.657  -1.676   9.220
  145    HA   MET  20           HA       MET  20  -9.357  -1.029   7.661
  146    HB2  MET  20          2HB       MET  20 -11.949   0.111   6.837
  147    HB3  MET  20          3HB       MET  20 -10.799  -0.852   5.920
  148    HG2  MET  20          2HG       MET  20 -11.692  -2.739   7.580
  149    HG3  MET  20          3HG       MET  20 -13.112  -1.695   7.549
  150    HE1  MET  20          1HE       MET  20 -11.217  -3.695   3.862
  151    HE2  MET  20          2HE       MET  20 -10.673  -2.089   4.351
  152    HE3  MET  20          3HE       MET  20 -10.454  -3.463   5.436
  153    H    THR  21           HN       THR  21  -9.398   1.208   6.483
  154    HA   THR  21           HA       THR  21  -9.887   3.348   8.440
  155    HB   THR  21           HB       THR  21  -7.339   2.900   6.883
  156    HG1  THR  21          1HG       THR  21  -7.574   3.403   9.654
  157   HG21  THR  21          1HG2      THR  21  -6.569   5.038   7.829
  158   HG22  THR  21          2HG2      THR  21  -8.180   5.316   8.489
  159   HG23  THR  21          3HG2      THR  21  -7.941   5.258   6.743
  160    H    THR  22           HN       THR  22 -10.782   5.148   7.618
  161    HA   THR  22           HA       THR  22 -11.526   5.155   4.825
  162    HB   THR  22           HB       THR  22 -12.115   7.293   6.874
  163    HG1  THR  22          1HG       THR  22 -13.223   5.726   7.790
  164   HG21  THR  22          1HG2      THR  22 -13.975   6.589   4.676
  165   HG22  THR  22          2HG2      THR  22 -12.494   7.435   4.228
  166   HG23  THR  22          3HG2      THR  22 -13.606   8.159   5.390
  167    H    ILE  23           HN       ILE  23 -10.521   6.216   3.248
  168    HA   ILE  23           HA       ILE  23  -8.068   7.327   3.315
  169    HB   ILE  23           HB       ILE  23 -10.350   8.296   1.589
  170   HG12  ILE  23          2HG1      ILE  23  -9.831   5.852   1.474
  171   HG13  ILE  23          3HG1      ILE  23  -9.567   6.703  -0.044
  172   HG21  ILE  23          1HG2      ILE  23  -7.432   8.488   0.920
  173   HG22  ILE  23          2HG2      ILE  23  -8.796   9.312   0.168
  174   HG23  ILE  23          3HG2      ILE  23  -8.270   9.775   1.786
  175   HD11  ILE  23          1HD1      ILE  23  -7.372   6.269  -0.043
  176   HD12  ILE  23          2HD1      ILE  23  -7.215   6.521   1.695
  177   HD13  ILE  23          3HD1      ILE  23  -7.818   4.983   1.078
  178    H    ALA  24           HN       ALA  24 -11.075   8.963   4.131
  179    HA   ALA  24           HA       ALA  24 -11.377  10.773   5.528
  180    HB1  ALA  24          1HB       ALA  24  -8.494  11.532   5.379
  181    HB2  ALA  24          2HB       ALA  24  -9.642  11.727   6.705
  182    HB3  ALA  24          3HB       ALA  24  -8.982  10.133   6.337
  183    H    GLN  25           HN       GLN  25 -11.252  10.686   2.549
  184    HA   GLN  25           HA       GLN  25 -11.492  13.534   2.127
  185    HB2  GLN  25          2HB       GLN  25  -9.175  12.006   1.171
  186    HB3  GLN  25          3HB       GLN  25  -9.988  12.931  -0.083
  187    HG2  GLN  25          2HG       GLN  25  -8.816  13.981   2.478
  188    HG3  GLN  25          3HG       GLN  25  -8.230  14.258   0.839
  189   HE21  GLN  25          1HE2      GLN  25 -10.432  15.218   3.277
  190   HE22  GLN  25          2HE2      GLN  25 -11.155  16.534   2.423
  191    H    CYS  26           HN       CYS  26 -11.113  10.555   0.195
  192    HA   CYS  26           HA       CYS  26 -13.346  11.342  -1.486
  193    HB2  CYS  26          2HB       CYS  26 -12.783   9.140  -2.650
  194    HB3  CYS  26          3HB       CYS  26 -11.551  10.396  -2.698
  195    H    GLN  27           HN       GLN  27 -12.773   9.382   1.262
  196    HA   GLN  27           HA       GLN  27 -14.253   8.271   2.610
  197    HB2  GLN  27          2HB       GLN  27 -16.402   8.588   0.532
  198    HB3  GLN  27          3HB       GLN  27 -16.577   8.414   2.273
  199    HG2  GLN  27          2HG       GLN  27 -15.109  10.788   1.299
  200    HG3  GLN  27          3HG       GLN  27 -16.849  10.740   1.018
  201   HE21  GLN  27          1HE2      GLN  27 -14.384  11.357   3.243
  202   HE22  GLN  27          2HE2      GLN  27 -15.368  11.593   4.643
  203    H    CYS  28           HN       CYS  28 -12.590   6.704   1.480
  204    HA   CYS  28           HA       CYS  28 -14.122   4.582   0.126
  205    HB2  CYS  28          2HB       CYS  28 -11.221   5.372  -0.055
  206    HB3  CYS  28          3HB       CYS  28 -11.780   3.785  -0.575
  207    H    ILE  29           HN       ILE  29 -12.601   2.420   0.460
  208    HA   ILE  29           HA       ILE  29 -12.131   2.153   3.348
  209    HB   ILE  29           HB       ILE  29 -14.372   1.117   2.132
  210   HG12  ILE  29          2HG1      ILE  29 -13.202  -0.331   4.467
  211   HG13  ILE  29          3HG1      ILE  29 -13.518   1.394   4.628
  212   HG21  ILE  29          1HG2      ILE  29 -12.343  -1.098   2.393
  213   HG22  ILE  29          2HG2      ILE  29 -14.063  -1.306   2.067
  214   HG23  ILE  29          3HG2      ILE  29 -13.034  -0.496   0.885
  215   HD11  ILE  29          1HD1      ILE  29 -15.316  -0.342   5.330
  216   HD12  ILE  29          2HD1      ILE  29 -15.793   1.124   4.473
  217   HD13  ILE  29          3HD1      ILE  29 -15.661  -0.404   3.603
  218    H    PHE  30           HN       PHE  30 -10.258   1.203   3.813
  219    HA   PHE  30           HA       PHE  30  -9.136  -0.827   2.079
  220    HB2  PHE  30          2HB       PHE  30  -7.665   1.766   2.599
  221    HB3  PHE  30          3HB       PHE  30  -6.967   0.340   1.837
  222    HD1  PHE  30          1HD       PHE  30  -7.757  -0.380  -0.390
  223    HD2  PHE  30          2HD       PHE  30  -9.042   3.266   1.389
  224    HE1  PHE  30          1HE       PHE  30  -8.526   0.417  -2.587
  225    HE2  PHE  30          2HE       PHE  30  -9.815   4.069  -0.805
  226    HZ   PHE  30           HZ       PHE  30  -9.558   2.643  -2.797
  227    H    CYS  31           HN       CYS  31  -8.169  -2.345   3.263
  228    HA   CYS  31           HA       CYS  31  -8.130  -2.266   6.061
  229    HB2  CYS  31          2HB       CYS  31  -7.077  -4.390   5.977
  230    HB3  CYS  31          3HB       CYS  31  -8.116  -4.318   4.558
  231    H    THR  32           HN       THR  32  -6.690  -1.577   7.521
  232    HA   THR  32           HA       THR  32  -4.830   0.294   7.212
  233    HB   THR  32           HB       THR  32  -4.116  -2.000   9.018
  234    HG1  THR  32          1HG       THR  32  -6.282  -0.175   9.259
  235   HG21  THR  32          1HG2      THR  32  -3.371   0.774   8.738
  236   HG22  THR  32          2HG2      THR  32  -2.659  -0.479   9.755
  237   HG23  THR  32          3HG2      THR  32  -4.029   0.462  10.344
  238    H    LEU  33           HN       LEU  33  -4.007  -3.173   7.048
  239    HA   LEU  33           HA       LEU  33  -1.365  -3.153   6.555
  240    HB2  LEU  33          2HB       LEU  33  -3.515  -4.756   5.202
  241    HB3  LEU  33          3HB       LEU  33  -1.804  -5.039   4.893
  242    HG   LEU  33           HG       LEU  33  -2.093  -5.089   7.682
  243   HD11  LEU  33          1HD1      LEU  33  -4.221  -6.753   6.344
  244   HD12  LEU  33          2HD1      LEU  33  -4.516  -5.324   7.334
  245   HD13  LEU  33          3HD1      LEU  33  -3.798  -6.764   8.056
  246   HD21  LEU  33          1HD2      LEU  33  -0.533  -6.549   6.949
  247   HD22  LEU  33          2HD2      LEU  33  -1.435  -6.950   5.486
  248   HD23  LEU  33          3HD2      LEU  33  -1.881  -7.683   7.028
  249    H    CYS  34           HN       CYS  34  -3.631  -3.139   3.800
  250    HA   CYS  34           HA       CYS  34  -1.721  -2.301   1.922
  251    HB2  CYS  34          2HB       CYS  34  -4.710  -1.877   1.757
  252    HB3  CYS  34          3HB       CYS  34  -3.576  -1.962   0.412
  253    H    LEU  35           HN       LEU  35  -4.468  -0.399   3.177
  254    HA   LEU  35           HA       LEU  35  -3.803   2.058   2.186
  255    HB2  LEU  35          2HB       LEU  35  -5.698   1.130   3.886
  256    HB3  LEU  35          3HB       LEU  35  -4.722   2.105   4.982
  257    HG   LEU  35           HG       LEU  35  -5.998   3.117   2.442
  258   HD11  LEU  35          1HD1      LEU  35  -7.236   2.499   4.852
  259   HD12  LEU  35          2HD1      LEU  35  -7.865   3.533   3.569
  260   HD13  LEU  35          3HD1      LEU  35  -6.972   4.242   4.915
  261   HD21  LEU  35          1HD2      LEU  35  -5.472   5.279   3.981
  262   HD22  LEU  35          2HD2      LEU  35  -4.409   4.686   2.705
  263   HD23  LEU  35          3HD2      LEU  35  -4.102   4.243   4.385
  264    H    LYS  36           HN       LYS  36  -2.127   0.268   4.576
  265    HA   LYS  36           HA       LYS  36  -0.690   2.596   5.585
  266    HB2  LYS  36          2HB       LYS  36  -1.314   0.948   7.231
  267    HB3  LYS  36          3HB       LYS  36  -0.557  -0.337   6.297
  268    HG2  LYS  36          2HG       LYS  36   1.531   1.364   6.661
  269    HG3  LYS  36          3HG       LYS  36   0.622   1.590   8.157
  270    HD2  LYS  36          2HD       LYS  36   0.638  -1.170   7.701
  271    HD3  LYS  36          3HD       LYS  36   2.276  -0.622   7.332
  272    HE2  LYS  36          2HE       LYS  36   2.559  -0.866   9.558
  273    HE3  LYS  36          3HE       LYS  36   1.831   0.738   9.609
  274    HZ1  LYS  36          1HZ       LYS  36   0.507  -0.333  11.087
  275    HZ2  LYS  36          2HZ       LYS  36   0.690  -1.846  10.357
  276    HZ3  LYS  36          3HZ       LYS  36  -0.357  -0.701   9.681
  277    H    GLN  37           HN       GLN  37   0.439  -0.617   4.533
  278    HA   GLN  37           HA       GLN  37   3.021  -0.066   3.965
  279    HB2  GLN  37          2HB       GLN  37   1.313  -2.163   3.420
  280    HB3  GLN  37          3HB       GLN  37   1.823  -1.649   1.818
  281    HG2  GLN  37          2HG       GLN  37   4.164  -1.879   2.498
  282    HG3  GLN  37          3HG       GLN  37   3.638  -2.424   4.090
  283   HE21  GLN  37          1HE2      GLN  37   1.910  -4.258   3.869
  284   HE22  GLN  37          2HE2      GLN  37   2.373  -5.551   2.822
  285    H    TYR  38           HN       TYR  38   0.270   1.101   2.241
  286    HA   TYR  38           HA       TYR  38   1.757   1.882  -0.108
  287    HB2  TYR  38          2HB       TYR  38  -0.327   1.703  -0.918
  288    HB3  TYR  38          3HB       TYR  38  -1.036   1.758   0.691
  289    HD1  TYR  38          1HD       TYR  38  -2.742   3.311   0.717
  290    HD2  TYR  38          2HD       TYR  38   0.873   4.273  -1.310
  291    HE1  TYR  38          1HE       TYR  38  -3.603   5.571   0.266
  292    HE2  TYR  38          2HE       TYR  38   0.023   6.535  -1.767
  293    HH   TYR  38           HH       TYR  38  -3.252   7.496  -0.803
  294    H    VAL  39           HN       VAL  39  -0.165   3.761   2.239
  295    HA   VAL  39           HA       VAL  39   1.004   6.237   1.559
  296    HB   VAL  39           HB       VAL  39  -0.103   7.153   3.482
  297   HG11  VAL  39          1HG1      VAL  39  -2.390   6.410   3.100
  298   HG12  VAL  39          2HG1      VAL  39  -1.513   6.537   1.573
  299   HG13  VAL  39          3HG1      VAL  39  -1.798   4.955   2.301
  300   HG21  VAL  39          1HG2      VAL  39  -1.274   5.608   5.093
  301   HG22  VAL  39          2HG2      VAL  39  -0.326   4.294   4.398
  302   HG23  VAL  39          3HG2      VAL  39   0.486   5.632   5.208
  303    H    GLU  40           HN       GLU  40   1.549   4.079   4.341
  304    HA   GLU  40           HA       GLU  40   3.305   5.359   5.878
  305    HB2  GLU  40          2HB       GLU  40   2.629   2.802   5.741
  306    HB3  GLU  40          3HB       GLU  40   4.206   2.662   4.978
  307    HG2  GLU  40          2HG       GLU  40   4.424   4.249   7.347
  308    HG3  GLU  40          3HG       GLU  40   3.612   2.729   7.716
  309    H    LEU  41           HN       LEU  41   4.317   3.675   2.903
  310    HA   LEU  41           HA       LEU  41   6.995   4.492   2.966
  311    HB2  LEU  41          2HB       LEU  41   5.145   3.482   0.866
  312    HB3  LEU  41          3HB       LEU  41   6.684   4.178   0.362
  313    HG   LEU  41           HG       LEU  41   6.689   1.696   0.564
  314   HD11  LEU  41          1HD1      LEU  41   8.590   3.579   1.503
  315   HD12  LEU  41          2HD1      LEU  41   8.870   1.978   0.818
  316   HD13  LEU  41          3HD1      LEU  41   8.651   2.167   2.558
  317   HD21  LEU  41          1HD2      LEU  41   6.624   0.642   2.701
  318   HD22  LEU  41          2HD2      LEU  41   5.179   1.645   2.560
  319   HD23  LEU  41          3HD2      LEU  41   6.546   2.196   3.531
  320    H    LEU  42           HN       LEU  42   4.450   5.741   0.795
  321    HA   LEU  42           HA       LEU  42   5.861   7.956  -0.117
  322    HB2  LEU  42          2HB       LEU  42   2.907   7.485   0.191
  323    HB3  LEU  42          3HB       LEU  42   3.573   8.916  -0.594
  324    HG   LEU  42           HG       LEU  42   4.342   6.201  -1.579
  325   HD11  LEU  42          1HD1      LEU  42   2.408   6.397  -3.180
  326   HD12  LEU  42          2HD1      LEU  42   1.740   7.619  -2.099
  327   HD13  LEU  42          3HD1      LEU  42   1.986   5.971  -1.521
  328   HD21  LEU  42          1HD2      LEU  42   4.009   7.791  -3.727
  329   HD22  LEU  42          2HD2      LEU  42   5.523   7.659  -2.831
  330   HD23  LEU  42          3HD2      LEU  42   4.419   8.997  -2.507
  331    H    ILE  43           HN       ILE  43   3.176   8.084   2.230
  332    HA   ILE  43           HA       ILE  43   3.312  10.619   3.100
  333    HB   ILE  43           HB       ILE  43   2.224   8.272   4.133
  334   HG12  ILE  43          2HG1      ILE  43   1.282  10.129   5.835
  335   HG13  ILE  43          3HG1      ILE  43   2.010  11.192   4.635
  336   HG21  ILE  43          1HG2      ILE  43   4.167   8.057   5.612
  337   HG22  ILE  43          2HG2      ILE  43   3.841   9.663   6.263
  338   HG23  ILE  43          3HG2      ILE  43   2.685   8.357   6.519
  339   HD11  ILE  43          1HD1      ILE  43   0.401   9.086   3.447
  340   HD12  ILE  43          2HD1      ILE  43  -0.514  10.130   4.535
  341   HD13  ILE  43          3HD1      ILE  43   0.373  10.829   3.180
  342    H    LYS  44           HN       LYS  44   5.721   8.183   3.638
  343    HA   LYS  44           HA       LYS  44   7.108   9.599   5.715
  344    HB2  LYS  44          2HB       LYS  44   7.323   7.039   4.375
  345    HB3  LYS  44          3HB       LYS  44   8.900   7.804   4.531
  346    HG2  LYS  44          2HG       LYS  44   8.286   6.288   6.408
  347    HG3  LYS  44          3HG       LYS  44   8.691   7.934   6.898
  348    HD2  LYS  44          2HD       LYS  44   6.766   7.901   8.037
  349    HD3  LYS  44          3HD       LYS  44   5.974   8.063   6.468
  350    HE2  LYS  44          2HE       LYS  44   4.923   6.163   7.007
  351    HE3  LYS  44          3HE       LYS  44   6.447   5.372   6.604
  352    HZ1  LYS  44          1HZ       LYS  44   6.818   4.860   8.727
  353    HZ2  LYS  44          2HZ       LYS  44   5.185   5.212   8.990
  354    HZ3  LYS  44          3HZ       LYS  44   6.362   6.388   9.291
  355    H    GLU  45           HN       GLU  45   7.572   9.115   2.233
  356    HA   GLU  45           HA       GLU  45   9.947  10.711   2.128
  357    HB2  GLU  45          2HB       GLU  45   8.855   8.857   0.469
  358    HB3  GLU  45          3HB       GLU  45   8.398  10.341  -0.356
  359    HG2  GLU  45          2HG       GLU  45  11.053   9.119   0.023
  360    HG3  GLU  45          3HG       GLU  45  10.401  10.025  -1.341
  361    H    GLY  46           HN       GLY  46   6.683  11.212   0.765
  362    HA2  GLY  46          1HA       GLY  46   5.500  13.135   0.351
  363    HA3  GLY  46          2HA       GLY  46   6.392  13.842   1.689
  364    H    LEU  47           HN       LEU  47   7.134  12.794  -1.641
  365    HA   LEU  47           HA       LEU  47   8.815  15.162  -1.958
  366    HB2  LEU  47          2HB       LEU  47   9.570  14.079  -4.032
  367    HB3  LEU  47          3HB       LEU  47   9.815  13.074  -2.605
  368    HG   LEU  47           HG       LEU  47   7.352  12.638  -4.215
  369   HD11  LEU  47          1HD1      LEU  47   9.418  12.863  -5.748
  370   HD12  LEU  47          2HD1      LEU  47   8.384  11.444  -5.911
  371   HD13  LEU  47          3HD1      LEU  47   9.912  11.326  -5.038
  372   HD21  LEU  47          1HD2      LEU  47   7.238  10.914  -2.825
  373   HD22  LEU  47          2HD2      LEU  47   8.795  11.345  -2.120
  374   HD23  LEU  47          3HD2      LEU  47   8.727  10.274  -3.520
  375    H    GLU  48           HN       GLU  48   5.822  13.779  -3.070
  376    HA   GLU  48           HA       GLU  48   4.667  16.122  -3.912
  377    HB2  GLU  48          2HB       GLU  48   4.810  15.653  -6.478
  378    HB3  GLU  48          3HB       GLU  48   6.099  16.539  -5.678
  379    HG2  GLU  48          2HG       GLU  48   7.598  14.833  -5.887
  380    HG3  GLU  48          3HG       GLU  48   6.350  13.589  -5.894
  381    H    THR  49           HN       THR  49   4.997  12.692  -4.248
  382    HA   THR  49           HA       THR  49   2.863  11.837  -5.663
  383    HB   THR  49           HB       THR  49   3.479  10.710  -2.929
  384    HG1  THR  49          1HG       THR  49   4.804   9.348  -4.697
  385   HG21  THR  49          1HG2      THR  49   1.564   9.969  -4.732
  386   HG22  THR  49          2HG2      THR  49   2.291   8.898  -3.534
  387   HG23  THR  49          3HG2      THR  49   2.912   8.927  -5.185
  388    H    ALA  50           HN       ALA  50   2.751  13.632  -2.711
  389    HA   ALA  50           HA       ALA  50   1.047  14.403  -1.408
  390    HB1  ALA  50          1HB       ALA  50   0.423  15.669  -3.294
  391    HB2  ALA  50          2HB       ALA  50  -0.269  14.264  -4.107
  392    HB3  ALA  50          3HB       ALA  50  -1.069  14.947  -2.693
  393    H    ILE  51           HN       ILE  51   1.315  11.380  -1.997
  394    HA   ILE  51           HA       ILE  51   0.087   9.438  -1.703
  395    HB   ILE  51           HB       ILE  51  -0.544  11.051   0.770
  396   HG12  ILE  51          2HG1      ILE  51   1.323   9.750   1.747
  397   HG13  ILE  51          3HG1      ILE  51   1.605   9.003   0.179
  398   HG21  ILE  51          1HG2      ILE  51  -2.094   9.146   0.428
  399   HG22  ILE  51          2HG2      ILE  51  -0.702   8.064   0.406
  400   HG23  ILE  51          3HG2      ILE  51  -1.086   8.979   1.865
  401   HD11  ILE  51          1HD1      ILE  51   1.620  11.956   0.279
  402   HD12  ILE  51          2HD1      ILE  51   2.971  11.110   1.035
  403   HD13  ILE  51          3HD1      ILE  51   2.606  10.843  -0.669
  404    H    SER  52           HN       SER  52  -1.463   9.542  -3.361
  405    HA   SER  52           HA       SER  52  -4.085  10.642  -2.634
  406    HB2  SER  52          2HB       SER  52  -3.982   9.615  -5.322
  407    HB3  SER  52          3HB       SER  52  -4.248  11.271  -4.778
  408    HG   SER  52           HG       SER  52  -1.980  10.089  -5.763
  409    H    CYS  53           HN       CYS  53  -5.989   9.398  -2.919
  410    HA   CYS  53           HA       CYS  53  -6.206   7.007  -1.776
  411    HB2  CYS  53          2HB       CYS  53  -8.144   8.248  -2.607
  412    HB3  CYS  53          3HB       CYS  53  -7.723   7.823  -4.264
  413    HA   PRO  54           HA       PRO  54  -3.901   4.068  -4.132
  414    HB2  PRO  54          2HB       PRO  54  -4.920   1.816  -3.010
  415    HB3  PRO  54          3HB       PRO  54  -3.759   2.861  -2.182
  416    HG2  PRO  54          2HG       PRO  54  -6.735   2.732  -1.890
  417    HG3  PRO  54          3HG       PRO  54  -5.493   2.875  -0.633
  418    HD2  PRO  54          2HD       PRO  54  -6.919   5.000  -1.520
  419    HD3  PRO  54          3HD       PRO  54  -5.238   5.141  -0.964
  420    H    ASP  55           HN       ASP  55  -7.083   4.776  -4.557
  421    HA   ASP  55           HA       ASP  55  -7.573   2.560  -6.420
  422    HB2  ASP  55          2HB       ASP  55  -9.236   3.857  -4.557
  423    HB3  ASP  55          3HB       ASP  55  -9.806   4.365  -6.144
  424    H    ALA  56           HN       ALA  56  -6.114   3.422  -8.005
  425    HA   ALA  56           HA       ALA  56  -6.009   5.895  -9.123
  426    HB1  ALA  56          1HB       ALA  56  -5.235   4.880 -11.154
  427    HB2  ALA  56          2HB       ALA  56  -4.633   3.935  -9.791
  428    HB3  ALA  56          3HB       ALA  56  -6.002   3.348 -10.735
  429    H    ALA  57           HN       ALA  57  -8.663   3.701  -9.238
  430    HA   ALA  57           HA       ALA  57 -10.007   5.365 -11.261
  431    HB1  ALA  57          1HB       ALA  57  -9.912   3.079 -11.954
  432    HB2  ALA  57          2HB       ALA  57 -10.534   2.527 -10.398
  433    HB3  ALA  57          3HB       ALA  57 -11.575   3.439 -11.491
  434    H    CYS  58           HN       CYS  58  -9.823   6.416  -8.719
  435    HA   CYS  58           HA       CYS  58 -12.268   5.818  -7.282
  436    HB2  CYS  58          2HB       CYS  58 -10.135   6.358  -6.100
  437    HB3  CYS  58          3HB       CYS  58 -10.232   7.991  -6.753
  438    HA   PRO  59           HA       PRO  59 -14.707   8.812  -9.428
  439    HB2  PRO  59          2HB       PRO  59 -16.765   8.931  -7.661
  440    HB3  PRO  59          3HB       PRO  59 -16.522   7.571  -8.762
  441    HG2  PRO  59          2HG       PRO  59 -15.796   7.818  -5.868
  442    HG3  PRO  59          3HG       PRO  59 -16.526   6.448  -6.726
  443    HD2  PRO  59          2HD       PRO  59 -13.891   6.546  -6.111
  444    HD3  PRO  59          3HD       PRO  59 -14.503   5.735  -7.567
  445    H    LYS  60           HN       LYS  60 -13.259   9.259  -6.377
  446    HA   LYS  60           HA       LYS  60 -13.878  12.139  -6.477
  447    HB2  LYS  60          2HB       LYS  60 -13.473  10.418  -4.024
  448    HB3  LYS  60          3HB       LYS  60 -13.647  12.168  -4.006
  449    HG2  LYS  60          2HG       LYS  60 -15.793  10.696  -5.377
  450    HG3  LYS  60          3HG       LYS  60 -15.679  10.444  -3.633
  451    HD2  LYS  60          2HD       LYS  60 -15.362  13.210  -4.080
  452    HD3  LYS  60          3HD       LYS  60 -16.727  12.688  -5.070
  453    HE2  LYS  60          2HE       LYS  60 -18.013  12.211  -3.273
  454    HE3  LYS  60          3HE       LYS  60 -16.651  11.622  -2.323
  455    HZ1  LYS  60          1HZ       LYS  60 -15.977  13.954  -1.999
  456    HZ2  LYS  60          2HZ       LYS  60 -17.499  13.620  -1.342
  457    HZ3  LYS  60          3HZ       LYS  60 -17.376  14.460  -2.805
  458    H    GLN  61           HN       GLN  61 -11.509   9.691  -6.406
  459    HA   GLN  61           HA       GLN  61  -9.232   9.713  -6.004
  460    HB2  GLN  61          2HB       GLN  61  -9.786  11.951  -7.939
  461    HB3  GLN  61          3HB       GLN  61  -8.146  11.474  -7.521
  462    HG2  GLN  61          2HG       GLN  61  -9.822   9.221  -8.275
  463    HG3  GLN  61          3HG       GLN  61  -9.672  10.431  -9.548
  464   HE21  GLN  61          1HE2      GLN  61  -7.400  11.181  -9.956
  465   HE22  GLN  61          2HE2      GLN  61  -6.162   9.975  -9.944
  466    H    GLY  62           HN       GLY  62  -9.927  10.518  -3.707
  467    HA2  GLY  62          1HA       GLY  62  -9.154  13.249  -3.125
  468    HA3  GLY  62          2HA       GLY  62  -9.694  12.045  -1.964
  469    H    HIS  63           HN       HIS  63  -7.561  13.758  -1.453
  470    HA   HIS  63           HA       HIS  63  -5.188  12.053  -1.747
  471    HB2  HIS  63          2HB       HIS  63  -5.542  14.988  -1.181
  472    HB3  HIS  63          3HB       HIS  63  -4.015  14.172  -0.862
  473    HD1  HIS  63          1HD       HIS  63  -5.945  15.754  -3.524
  474    HD2  HIS  63          2HD       HIS  63  -2.803  13.048  -3.261
  475    HE1  HIS  63          1HE       HIS  63  -4.903  15.710  -5.812
  476    H    LEU  64           HN       LEU  64  -3.637  12.310   0.220
  477    HA   LEU  64           HA       LEU  64  -5.220  11.938   2.677
  478    HB2  LEU  64          2HB       LEU  64  -2.747  10.507   1.735
  479    HB3  LEU  64          3HB       LEU  64  -3.348  10.410   3.388
  480    HG   LEU  64           HG       LEU  64  -3.914   8.489   1.814
  481   HD11  LEU  64          1HD1      LEU  64  -5.302   8.106   3.499
  482   HD12  LEU  64          2HD1      LEU  64  -6.525   9.047   2.647
  483   HD13  LEU  64          3HD1      LEU  64  -5.469   9.832   3.820
  484   HD21  LEU  64          1HD2      LEU  64  -6.106  10.283   0.844
  485   HD22  LEU  64          2HD2      LEU  64  -5.563   8.735   0.197
  486   HD23  LEU  64          3HD2      LEU  64  -4.573  10.178  -0.022
  487    H    GLN  65           HN       GLN  65  -3.974  12.322   4.700
  488    HA   GLN  65           HA       GLN  65  -2.409  14.768   4.408
  489    HB2  GLN  65          2HB       GLN  65  -2.910  13.894   7.137
  490    HB3  GLN  65          3HB       GLN  65  -3.318  15.414   6.353
  491    HG2  GLN  65          2HG       GLN  65  -5.388  14.598   6.905
  492    HG3  GLN  65          3HG       GLN  65  -5.213  14.035   5.242
  493   HE21  GLN  65          1HE2      GLN  65  -3.170  12.055   6.286
  494   HE22  GLN  65          2HE2      GLN  65  -4.127  10.766   6.925
  495    H    GLU  66           HN       GLU  66  -0.496  15.087   5.779
  496    HA   GLU  66           HA       GLU  66   1.191  12.712   5.698
  497    HB2  GLU  66          2HB       GLU  66   1.638  15.637   5.700
  498    HB3  GLU  66          3HB       GLU  66   2.860  14.672   6.517
  499    HG2  GLU  66          2HG       GLU  66   3.726  13.971   4.599
  500    HG3  GLU  66          3HG       GLU  66   2.143  13.557   3.944
  501    H    ASN  67           HN       ASN  67  -0.184  14.969   7.999
  502    HA   ASN  67           HA       ASN  67   1.305  13.902  10.230
  503    HB2  ASN  67          2HB       ASN  67  -1.115  15.505  10.776
  504    HB3  ASN  67          3HB       ASN  67   0.522  15.682  11.402
  505   HD21  ASN  67          1HD2      ASN  67  -1.691  16.529   8.878
  506   HD22  ASN  67          2HD2      ASN  67  -0.727  17.774   8.167
  507    H    GLU  68           HN       GLU  68  -2.089  13.854   9.164
  508    HA   GLU  68           HA       GLU  68  -3.096  12.255  11.221
  509    HB2  GLU  68          2HB       GLU  68  -4.015  13.256   8.678
  510    HB3  GLU  68          3HB       GLU  68  -4.537  11.592   8.898
  511    HG2  GLU  68          2HG       GLU  68  -4.912  13.371  11.213
  512    HG3  GLU  68          3HG       GLU  68  -5.897  13.725   9.795
  513    H    ILE  69           HN       ILE  69  -2.227  11.231   7.914
  514    HA   ILE  69           HA       ILE  69  -2.529   8.513   8.220
  515    HB   ILE  69           HB       ILE  69  -0.594  10.079   6.532
  516   HG12  ILE  69          2HG1      ILE  69  -3.335   9.157   6.294
  517   HG13  ILE  69          3HG1      ILE  69  -2.456  10.315   5.301
  518   HG21  ILE  69          1HG2      ILE  69  -1.011   7.092   6.542
  519   HG22  ILE  69          2HG2      ILE  69  -0.112   7.991   5.320
  520   HG23  ILE  69          3HG2      ILE  69   0.466   7.949   6.986
  521   HD11  ILE  69          1HD1      ILE  69  -1.525   8.496   3.988
  522   HD12  ILE  69          2HD1      ILE  69  -2.371   7.322   4.998
  523   HD13  ILE  69          3HD1      ILE  69  -3.287   8.442   3.989
  524    H    GLU  70           HN       GLU  70   0.568  10.265   8.519
  525    HA   GLU  70           HA       GLU  70   2.094   8.144   9.450
  526    HB2  GLU  70          2HB       GLU  70   3.740   9.696   9.949
  527    HB3  GLU  70          3HB       GLU  70   2.774  10.563   8.763
  528    HG2  GLU  70          2HG       GLU  70   1.713  11.854  10.456
  529    HG3  GLU  70          3HG       GLU  70   2.419  10.866  11.733
  530    H    CYS  71           HN       CYS  71  -0.347   9.941  11.057
  531    HA   CYS  71           HA       CYS  71   0.522   9.413  13.733
  532    HB2  CYS  71          2HB       CYS  71  -0.995  10.999  14.148
  533    HB3  CYS  71          3HB       CYS  71  -1.532  10.938  12.474
  534    HG   CYS  71           HG       CYS  71  -2.732   8.744  14.792
  535    H    MET  72           HN       MET  72  -1.279   7.692  11.343
  536    HA   MET  72           HA       MET  72  -2.359   5.813  13.293
  537    HB2  MET  72          2HB       MET  72  -3.883   5.240  11.725
  538    HB3  MET  72          3HB       MET  72  -3.401   6.757  10.978
  539    HG2  MET  72          2HG       MET  72  -1.666   5.385   9.713
  540    HG3  MET  72          3HG       MET  72  -2.570   3.972  10.253
  541    HE1  MET  72          1HE       MET  72  -1.856   5.017   7.288
  542    HE2  MET  72          2HE       MET  72  -2.748   3.501   7.412
  543    HE3  MET  72          3HE       MET  72  -3.339   4.789   6.361
  544    H    VAL  73           HN       VAL  73   0.567   6.223  12.111
  545    HA   VAL  73           HA       VAL  73   1.136   3.347  12.085
  546    HB   VAL  73           HB       VAL  73   2.868   3.783  10.284
  547   HG11  VAL  73          1HG1      VAL  73   0.759   2.573   9.894
  548   HG12  VAL  73          2HG1      VAL  73  -0.026   4.102   9.493
  549   HG13  VAL  73          3HG1      VAL  73   1.279   3.487   8.478
  550   HG21  VAL  73          1HG2      VAL  73   1.550   6.412  10.416
  551   HG22  VAL  73          2HG2      VAL  73   3.181   5.983   9.901
  552   HG23  VAL  73          3HG2      VAL  73   1.824   5.779   8.793
  553    H    ALA  74           HN       ALA  74   2.740   6.529  11.893
  554    HA   ALA  74           HA       ALA  74   4.801   5.538  13.731
  555    HB1  ALA  74          1HB       ALA  74   6.104   7.500  13.020
  556    HB2  ALA  74          2HB       ALA  74   5.645   6.470  11.664
  557    HB3  ALA  74          3HB       ALA  74   4.778   7.977  11.960
  558    H    ALA  75           HN       ALA  75   2.226   6.154  14.763
  559    HA   ALA  75           HA       ALA  75   1.737   8.630  15.779
  560    HB1  ALA  75          1HB       ALA  75   0.427   6.481  16.134
  561    HB2  ALA  75          2HB       ALA  75   1.495   6.185  17.506
  562    HB3  ALA  75          3HB       ALA  75   0.471   7.620  17.480
  Start of MODEL   11
    1    H1   ALA   1           HN       ALA   1 -24.121  -8.805   7.939
    2    HA   ALA   1           HA       ALA   1 -22.429  -7.408   8.545
    3    HB1  ALA   1          1HB       ALA   1 -23.851  -7.962  10.860
    4    HB2  ALA   1          2HB       ALA   1 -22.162  -8.192  11.319
    5    HB3  ALA   1          3HB       ALA   1 -22.687  -6.658  10.624
    6    H    LEU   2           HN       LEU   2 -22.119 -10.638   9.969
    7    HA   LEU   2           HA       LEU   2 -19.208 -10.485   9.608
    8    HB2  LEU   2          2HB       LEU   2 -20.736 -11.403  11.717
    9    HB3  LEU   2          3HB       LEU   2 -20.236 -12.881  10.898
   10    HG   LEU   2           HG       LEU   2 -18.461 -10.762  12.101
   11   HD11  LEU   2          1HD1      LEU   2 -17.687 -12.639  13.489
   12   HD12  LEU   2          2HD1      LEU   2 -18.896 -13.677  12.735
   13   HD13  LEU   2          3HD1      LEU   2 -19.403 -12.300  13.714
   14   HD21  LEU   2          1HD2      LEU   2 -17.746 -11.844   9.843
   15   HD22  LEU   2          2HD2      LEU   2 -17.435 -13.267  10.837
   16   HD23  LEU   2          3HD2      LEU   2 -16.595 -11.753  11.177
   17    H    ASP   3           HN       ASP   3 -22.077 -12.114   8.530
   18    HA   ASP   3           HA       ASP   3 -20.965 -14.397   7.364
   19    HB2  ASP   3          2HB       ASP   3 -23.492 -12.996   7.289
   20    HB3  ASP   3          3HB       ASP   3 -23.069 -13.592   5.686
   21    HA   PRO   4           HA       PRO   4 -20.551 -11.965   3.225
   22    HB2  PRO   4          2HB       PRO   4 -21.031  -9.294   3.272
   23    HB3  PRO   4          3HB       PRO   4 -22.296 -10.492   2.972
   24    HG2  PRO   4          2HG       PRO   4 -21.615  -9.048   5.505
   25    HG3  PRO   4          3HG       PRO   4 -23.207  -9.388   4.805
   26    HD2  PRO   4          2HD       PRO   4 -22.162 -10.856   6.826
   27    HD3  PRO   4          3HD       PRO   4 -23.232 -11.554   5.593
   28    H    LEU   5           HN       LEU   5 -18.456 -11.769   2.772
   29    HA   LEU   5           HA       LEU   5 -16.813  -9.982   4.442
   30    HB2  LEU   5          2HB       LEU   5 -14.924 -11.533   3.563
   31    HB3  LEU   5          3HB       LEU   5 -15.939 -12.052   4.908
   32    HG   LEU   5           HG       LEU   5 -17.320 -13.293   3.137
   33   HD11  LEU   5          1HD1      LEU   5 -16.721 -12.835   1.035
   34   HD12  LEU   5          2HD1      LEU   5 -15.375 -13.935   1.326
   35   HD13  LEU   5          3HD1      LEU   5 -15.150 -12.198   1.520
   36   HD21  LEU   5          1HD2      LEU   5 -15.971 -14.462   4.748
   37   HD22  LEU   5          2HD2      LEU   5 -14.504 -14.124   3.828
   38   HD23  LEU   5          3HD2      LEU   5 -15.735 -15.202   3.164
   39    H    VAL   6           HN       VAL   6 -15.925  -8.304   3.443
   40    HA   VAL   6           HA       VAL   6 -14.509  -8.157   1.156
   41    HB   VAL   6           HB       VAL   6 -17.343  -8.466   0.506
   42   HG11  VAL   6          1HG1      VAL   6 -17.434  -6.143   0.165
   43   HG12  VAL   6          2HG1      VAL   6 -15.813  -6.097  -0.531
   44   HG13  VAL   6          3HG1      VAL   6 -17.140  -6.828  -1.433
   45   HG21  VAL   6          1HG2      VAL   6 -14.876  -9.395  -0.384
   46   HG22  VAL   6          2HG2      VAL   6 -16.454  -9.739  -1.091
   47   HG23  VAL   6          3HG2      VAL   6 -15.486  -8.400  -1.706
   48    H    SER   7           HN       SER   7 -13.818  -6.091   0.726
   49    HA   SER   7           HA       SER   7 -15.226  -3.730   1.264
   50    HB2  SER   7          2HB       SER   7 -14.198  -4.969   3.608
   51    HB3  SER   7          3HB       SER   7 -13.225  -3.532   3.298
   52    HG   SER   7           HG       SER   7 -15.476  -2.561   2.948
   53    H    CYS   8           HN       CYS   8 -11.873  -4.574   2.105
   54    HA   CYS   8           HA       CYS   8 -10.733  -2.407   0.740
   55    HB2  CYS   8          2HB       CYS   8  -9.672  -3.844   2.552
   56    HB3  CYS   8          3HB       CYS   8  -9.334  -5.023   1.290
   57    H    LYS   9           HN       LYS   9  -9.319  -2.462  -1.141
   58    HA   LYS   9           HA       LYS   9 -10.187  -4.444  -3.143
   59    HB2  LYS   9          2HB       LYS   9  -9.294  -2.009  -4.375
   60    HB3  LYS   9          3HB       LYS   9 -10.856  -2.805  -4.503
   61    HG2  LYS   9          2HG       LYS   9 -10.186  -1.096  -2.139
   62    HG3  LYS   9          3HG       LYS   9 -10.775  -0.390  -3.645
   63    HD2  LYS   9          2HD       LYS   9 -12.373  -2.663  -2.820
   64    HD3  LYS   9          3HD       LYS   9 -12.318  -1.413  -1.575
   65    HE2  LYS   9          2HE       LYS   9 -13.013   0.254  -3.234
   66    HE3  LYS   9          3HE       LYS   9 -13.076  -1.004  -4.467
   67    HZ1  LYS   9          1HZ       LYS   9 -15.208  -0.275  -3.157
   68    HZ2  LYS   9          2HZ       LYS   9 -14.636  -1.390  -2.020
   69    HZ3  LYS   9          3HZ       LYS   9 -14.969  -1.890  -3.602
   70    H    LEU  10           HN       LEU  10  -7.578  -2.447  -1.908
   71    HA   LEU  10           HA       LEU  10  -5.585  -2.936  -3.749
   72    HB2  LEU  10          2HB       LEU  10  -5.530  -2.547  -0.779
   73    HB3  LEU  10          3HB       LEU  10  -4.043  -2.828  -1.683
   74    HG   LEU  10           HG       LEU  10  -5.905  -0.592  -2.418
   75   HD11  LEU  10          1HD1      LEU  10  -5.135  -0.615   0.064
   76   HD12  LEU  10          2HD1      LEU  10  -4.977   0.861  -0.887
   77   HD13  LEU  10          3HD1      LEU  10  -3.569  -0.161  -0.609
   78   HD21  LEU  10          1HD2      LEU  10  -3.326   0.197  -2.842
   79   HD22  LEU  10          2HD2      LEU  10  -4.385  -0.512  -4.061
   80   HD23  LEU  10          3HD2      LEU  10  -3.243  -1.531  -3.184
   81    H    CYS  11           HN       CYS  11  -6.399  -4.887  -0.885
   82    HA   CYS  11           HA       CYS  11  -4.672  -7.031  -1.877
   83    HB2  CYS  11          2HB       CYS  11  -4.950  -8.038   0.328
   84    HB3  CYS  11          3HB       CYS  11  -4.437  -6.362   0.484
   85    H    LEU  12           HN       LEU  12  -7.874  -6.080  -2.015
   86    HA   LEU  12           HA       LEU  12  -9.797  -7.084  -2.697
   87    HB2  LEU  12          2HB       LEU  12  -7.852  -9.196  -3.612
   88    HB3  LEU  12          3HB       LEU  12  -9.564  -9.176  -4.026
   89    HG   LEU  12           HG       LEU  12  -7.669  -6.951  -4.758
   90   HD11  LEU  12          1HD1      LEU  12  -8.590  -8.987  -6.726
   91   HD12  LEU  12          2HD1      LEU  12  -7.207  -9.352  -5.696
   92   HD13  LEU  12          3HD1      LEU  12  -7.167  -7.945  -6.759
   93   HD21  LEU  12          1HD2      LEU  12  -9.736  -7.114  -6.585
   94   HD22  LEU  12          2HD2      LEU  12  -9.594  -5.950  -5.267
   95   HD23  LEU  12          3HD2      LEU  12 -10.518  -7.436  -5.037
   96    H    GLY  13           HN       GLY  13  -8.681  -7.611   0.003
   97    HA2  GLY  13          1HA       GLY  13  -9.473 -10.321   0.634
   98    HA3  GLY  13          2HA       GLY  13  -8.920  -9.101   1.772
   99    H    GLU  14           HN       GLU  14 -10.384  -8.116   3.026
  100    HA   GLU  14           HA       GLU  14 -13.017  -7.494   2.319
  101    HB2  GLU  14          2HB       GLU  14 -14.027  -9.237   4.024
  102    HB3  GLU  14          3HB       GLU  14 -13.793  -9.653   2.333
  103    HG2  GLU  14          2HG       GLU  14 -12.418 -11.301   2.860
  104    HG3  GLU  14          3HG       GLU  14 -11.417 -10.229   3.837
  105    H    TYR  15           HN       TYR  15 -12.247  -9.045   5.382
  106    HA   TYR  15           HA       TYR  15 -12.095  -8.249   7.507
  107    HB2  TYR  15          2HB       TYR  15 -11.127  -5.644   6.343
  108    HB3  TYR  15          3HB       TYR  15 -10.724  -6.357   7.900
  109    HD1  TYR  15          1HD       TYR  15 -10.174  -6.606   4.257
  110    HD2  TYR  15          2HD       TYR  15  -8.949  -7.935   8.110
  111    HE1  TYR  15          1HE       TYR  15  -8.170  -7.627   3.262
  112    HE2  TYR  15          2HE       TYR  15  -6.941  -8.957   7.125
  113    HH   TYR  15           HH       TYR  15  -6.170  -9.791   4.968
  114    HA   PRO  16           HA       PRO  16 -15.836  -6.098   8.330
  115    HB2  PRO  16          2HB       PRO  16 -15.391  -5.314  10.892
  116    HB3  PRO  16          3HB       PRO  16 -15.725  -6.991  10.445
  117    HG2  PRO  16          2HG       PRO  16 -13.100  -5.668  11.008
  118    HG3  PRO  16          3HG       PRO  16 -13.685  -7.258  11.529
  119    HD2  PRO  16          2HD       PRO  16 -11.983  -6.941   9.447
  120    HD3  PRO  16          3HD       PRO  16 -13.190  -8.242   9.503
  121    H    VAL  17           HN       VAL  17 -16.368  -3.940   9.817
  122    HA   VAL  17           HA       VAL  17 -15.096  -1.794   8.308
  123    HB   VAL  17           HB       VAL  17 -17.720  -2.237   9.208
  124   HG11  VAL  17          1HG1      VAL  17 -16.625   0.268  10.471
  125   HG12  VAL  17          2HG1      VAL  17 -18.264  -0.375  10.588
  126   HG13  VAL  17          3HG1      VAL  17 -16.925  -1.224  11.363
  127   HG21  VAL  17          1HG2      VAL  17 -17.224  -1.196   7.124
  128   HG22  VAL  17          2HG2      VAL  17 -18.122  -0.027   8.090
  129   HG23  VAL  17          3HG2      VAL  17 -16.374   0.129   7.918
  130    H    GLU  18           HN       GLU  18 -14.942  -3.219  11.393
  131    HA   GLU  18           HA       GLU  18 -13.913  -0.809  12.678
  132    HB2  GLU  18          2HB       GLU  18 -14.263  -3.584  13.825
  133    HB3  GLU  18          3HB       GLU  18 -13.902  -2.118  14.726
  134    HG2  GLU  18          2HG       GLU  18 -16.402  -2.426  13.096
  135    HG3  GLU  18          3HG       GLU  18 -16.295  -2.945  14.777
  136    H    GLN  19           HN       GLN  19 -12.635  -2.811  10.573
  137    HA   GLN  19           HA       GLN  19  -9.998  -2.803  11.880
  138    HB2  GLN  19          2HB       GLN  19 -11.334  -4.996  10.329
  139    HB3  GLN  19          3HB       GLN  19  -9.580  -4.881  10.371
  140    HG2  GLN  19          2HG       GLN  19 -10.395  -4.643  13.027
  141    HG3  GLN  19          3HG       GLN  19 -11.398  -5.920  12.339
  142   HE21  GLN  19          1HE2      GLN  19 -10.460  -7.826  11.686
  143   HE22  GLN  19          2HE2      GLN  19  -8.829  -8.248  12.064
  144    H    MET  20           HN       MET  20 -11.396  -0.972   9.960
  145    HA   MET  20           HA       MET  20  -9.273  -0.953   7.929
  146    HB2  MET  20          2HB       MET  20 -11.881   0.078   7.030
  147    HB3  MET  20          3HB       MET  20 -10.692  -0.889   6.167
  148    HG2  MET  20          2HG       MET  20 -11.544  -2.770   7.805
  149    HG3  MET  20          3HG       MET  20 -12.979  -1.747   7.851
  150    HE1  MET  20          1HE       MET  20 -11.190  -3.942   4.281
  151    HE2  MET  20          2HE       MET  20 -10.757  -2.233   4.347
  152    HE3  MET  20          3HE       MET  20 -10.348  -3.300   5.692
  153    H    THR  21           HN       THR  21  -9.403   1.263   6.704
  154    HA   THR  21           HA       THR  21 -10.097   3.435   8.543
  155    HB   THR  21           HB       THR  21  -7.354   2.957   7.384
  156    HG1  THR  21          1HG       THR  21  -6.757   3.091   9.553
  157   HG21  THR  21          1HG2      THR  21  -7.882   5.265   6.919
  158   HG22  THR  21          2HG2      THR  21  -6.771   5.201   8.288
  159   HG23  THR  21          3HG2      THR  21  -8.488   5.496   8.559
  160    H    THR  22           HN       THR  22 -10.858   5.224   7.553
  161    HA   THR  22           HA       THR  22 -11.345   5.097   4.718
  162    HB   THR  22           HB       THR  22 -12.060   7.190   6.778
  163    HG1  THR  22          1HG       THR  22 -13.499   5.655   7.129
  164   HG21  THR  22          1HG2      THR  22 -13.580   8.079   5.012
  165   HG22  THR  22          2HG2      THR  22 -12.781   7.018   3.851
  166   HG23  THR  22          3HG2      THR  22 -11.869   8.299   4.649
  167    H    ILE  23           HN       ILE  23 -10.865   6.881   3.253
  168    HA   ILE  23           HA       ILE  23  -8.124   7.588   3.313
  169    HB   ILE  23           HB       ILE  23 -10.404   8.460   1.551
  170   HG12  ILE  23          2HG1      ILE  23  -9.683   6.204   1.154
  171   HG13  ILE  23          3HG1      ILE  23  -9.050   7.201  -0.151
  172   HG21  ILE  23          1HG2      ILE  23  -7.848   9.753   1.929
  173   HG22  ILE  23          2HG2      ILE  23  -8.041   9.173   0.274
  174   HG23  ILE  23          3HG2      ILE  23  -9.238  10.264   0.971
  175   HD11  ILE  23          1HD1      ILE  23  -6.986   7.292   1.580
  176   HD12  ILE  23          2HD1      ILE  23  -7.641   5.692   1.931
  177   HD13  ILE  23          3HD1      ILE  23  -7.149   6.102   0.287
  178    H    ALA  24           HN       ALA  24 -10.369  10.131   2.535
  179    HA   ALA  24           HA       ALA  24 -10.614  11.635   4.762
  180    HB1  ALA  24          1HB       ALA  24  -8.435  11.782   5.425
  181    HB2  ALA  24          2HB       ALA  24  -7.811  11.723   3.775
  182    HB3  ALA  24          3HB       ALA  24  -8.531  13.211   4.393
  183    H    GLN  25           HN       GLN  25 -11.706  11.276   2.139
  184    HA   GLN  25           HA       GLN  25 -12.549  13.862   1.552
  185    HB2  GLN  25          2HB       GLN  25 -10.001  13.199   0.383
  186    HB3  GLN  25          3HB       GLN  25 -11.197  13.445  -0.883
  187    HG2  GLN  25          2HG       GLN  25 -10.382  15.379   1.269
  188    HG3  GLN  25          3HG       GLN  25 -10.123  15.523  -0.469
  189   HE21  GLN  25          1HE2      GLN  25 -12.357  15.879   2.134
  190   HE22  GLN  25          2HE2      GLN  25 -13.617  16.642   1.232
  191    H    CYS  26           HN       CYS  26 -11.718  10.786  -0.021
  192    HA   CYS  26           HA       CYS  26 -14.155  10.886  -1.606
  193    HB2  CYS  26          2HB       CYS  26 -13.301   8.797  -2.622
  194    HB3  CYS  26          3HB       CYS  26 -12.133  10.111  -2.710
  195    H    GLN  27           HN       GLN  27 -13.035   9.562   1.342
  196    HA   GLN  27           HA       GLN  27 -14.034   8.287   2.940
  197    HB2  GLN  27          2HB       GLN  27 -16.509   8.640   1.240
  198    HB3  GLN  27          3HB       GLN  27 -16.479   8.050   2.896
  199    HG2  GLN  27          2HG       GLN  27 -15.601  10.788   2.005
  200    HG3  GLN  27          3HG       GLN  27 -17.151  10.398   2.750
  201   HE21  GLN  27          1HE2      GLN  27 -13.668  10.348   3.275
  202   HE22  GLN  27          2HE2      GLN  27 -13.740  10.517   4.993
  203    H    CYS  28           HN       CYS  28 -12.534   6.803   1.443
  204    HA   CYS  28           HA       CYS  28 -14.118   4.578   0.379
  205    HB2  CYS  28          2HB       CYS  28 -11.229   5.380   0.083
  206    HB3  CYS  28          3HB       CYS  28 -11.794   3.780  -0.384
  207    H    ILE  29           HN       ILE  29 -12.638   2.415   0.709
  208    HA   ILE  29           HA       ILE  29 -12.070   2.211   3.589
  209    HB   ILE  29           HB       ILE  29 -14.322   1.143   2.478
  210   HG12  ILE  29          2HG1      ILE  29 -12.832  -0.160   4.755
  211   HG13  ILE  29          3HG1      ILE  29 -13.609   1.411   4.904
  212   HG21  ILE  29          1HG2      ILE  29 -13.016  -0.409   1.112
  213   HG22  ILE  29          2HG2      ILE  29 -12.272  -1.064   2.571
  214   HG23  ILE  29          3HG2      ILE  29 -14.003  -1.266   2.298
  215   HD11  ILE  29          1HD1      ILE  29 -15.500  -0.380   3.804
  216   HD12  ILE  29          2HD1      ILE  29 -14.744  -1.165   5.192
  217   HD13  ILE  29          3HD1      ILE  29 -15.514   0.410   5.381
  218    H    PHE  30           HN       PHE  30 -10.163   1.325   4.029
  219    HA   PHE  30           HA       PHE  30  -9.032  -0.721   2.318
  220    HB2  PHE  30          2HB       PHE  30  -7.542   1.871   2.784
  221    HB3  PHE  30          3HB       PHE  30  -6.930   0.460   1.926
  222    HD1  PHE  30          1HD       PHE  30  -8.641   3.552   1.633
  223    HD2  PHE  30          2HD       PHE  30  -8.221  -0.282  -0.168
  224    HE1  PHE  30          1HE       PHE  30  -9.551   4.445  -0.472
  225    HE2  PHE  30          2HE       PHE  30  -9.129   0.604  -2.276
  226    HZ   PHE  30           HZ       PHE  30  -9.795   2.971  -2.430
  227    H    CYS  31           HN       CYS  31  -8.162  -2.219   3.580
  228    HA   CYS  31           HA       CYS  31  -8.006  -2.033   6.353
  229    HB2  CYS  31          2HB       CYS  31  -6.965  -4.166   6.318
  230    HB3  CYS  31          3HB       CYS  31  -8.046  -4.138   4.929
  231    H    THR  32           HN       THR  32  -6.570  -1.194   7.718
  232    HA   THR  32           HA       THR  32  -4.668   0.602   7.236
  233    HB   THR  32           HB       THR  32  -3.971  -1.504   9.257
  234    HG1  THR  32          1HG       THR  32  -5.911   0.484   9.792
  235   HG21  THR  32          1HG2      THR  32  -4.070   1.385   9.888
  236   HG22  THR  32          2HG2      THR  32  -2.845   0.880   8.723
  237   HG23  THR  32          3HG2      THR  32  -2.876   0.166  10.335
  238    H    LEU  33           HN       LEU  33  -4.028  -2.897   7.252
  239    HA   LEU  33           HA       LEU  33  -1.363  -3.039   6.850
  240    HB2  LEU  33          2HB       LEU  33  -3.653  -4.617   5.856
  241    HB3  LEU  33          3HB       LEU  33  -2.113  -4.879   5.039
  242    HG   LEU  33           HG       LEU  33  -1.317  -5.121   7.594
  243   HD11  LEU  33          1HD1      LEU  33  -4.220  -5.374   7.627
  244   HD12  LEU  33          2HD1      LEU  33  -3.082  -5.165   8.959
  245   HD13  LEU  33          3HD1      LEU  33  -3.385  -6.774   8.303
  246   HD21  LEU  33          1HD2      LEU  33  -2.017  -7.665   7.138
  247   HD22  LEU  33          2HD2      LEU  33  -0.674  -6.873   6.315
  248   HD23  LEU  33          3HD2      LEU  33  -2.241  -7.009   5.517
  249    H    CYS  34           HN       CYS  34  -3.640  -2.854   4.106
  250    HA   CYS  34           HA       CYS  34  -1.623  -2.270   2.207
  251    HB2  CYS  34          2HB       CYS  34  -4.583  -1.688   1.990
  252    HB3  CYS  34          3HB       CYS  34  -3.441  -1.853   0.661
  253    H    LEU  35           HN       LEU  35  -4.243  -0.167   3.416
  254    HA   LEU  35           HA       LEU  35  -3.416   2.213   2.329
  255    HB2  LEU  35          2HB       LEU  35  -5.379   1.447   4.057
  256    HB3  LEU  35          3HB       LEU  35  -4.369   2.452   5.094
  257    HG   LEU  35           HG       LEU  35  -5.646   3.320   2.500
  258   HD11  LEU  35          1HD1      LEU  35  -6.968   2.924   4.788
  259   HD12  LEU  35          2HD1      LEU  35  -7.345   4.239   3.674
  260   HD13  LEU  35          3HD1      LEU  35  -6.348   4.547   5.094
  261   HD21  LEU  35          1HD2      LEU  35  -3.879   4.739   2.573
  262   HD22  LEU  35          2HD2      LEU  35  -3.651   4.547   4.312
  263   HD23  LEU  35          3HD2      LEU  35  -4.933   5.594   3.699
  264    H    LYS  36           HN       LYS  36  -1.876   0.391   4.774
  265    HA   LYS  36           HA       LYS  36  -0.330   2.653   5.767
  266    HB2  LYS  36          2HB       LYS  36  -1.062   1.060   7.426
  267    HB3  LYS  36          3HB       LYS  36  -0.355  -0.272   6.521
  268    HG2  LYS  36          2HG       LYS  36   1.653   1.693   7.077
  269    HG3  LYS  36          3HG       LYS  36   0.822   1.238   8.566
  270    HD2  LYS  36          2HD       LYS  36   1.153  -1.193   7.640
  271    HD3  LYS  36          3HD       LYS  36   2.445  -0.438   6.706
  272    HE2  LYS  36          2HE       LYS  36   3.714  -0.808   8.513
  273    HE3  LYS  36          3HE       LYS  36   2.876   0.580   9.205
  274    HZ1  LYS  36          1HZ       LYS  36   2.682  -1.108  10.787
  275    HZ2  LYS  36          2HZ       LYS  36   2.321  -2.293   9.636
  276    HZ3  LYS  36          3HZ       LYS  36   1.179  -1.102  10.008
  277    H    GLN  37           HN       GLN  37   0.407  -0.568   4.418
  278    HA   GLN  37           HA       GLN  37   3.115  -0.159   3.968
  279    HB2  GLN  37          2HB       GLN  37   1.232  -2.167   3.406
  280    HB3  GLN  37          3HB       GLN  37   1.971  -1.767   1.862
  281    HG2  GLN  37          2HG       GLN  37   4.046  -2.487   2.507
  282    HG3  GLN  37          3HG       GLN  37   3.729  -2.212   4.219
  283   HE21  GLN  37          1HE2      GLN  37   1.775  -3.978   1.876
  284   HE22  GLN  37          2HE2      GLN  37   1.886  -5.510   2.666
  285    H    TYR  38           HN       TYR  38   0.484   1.323   2.452
  286    HA   TYR  38           HA       TYR  38   1.951   1.909  -0.003
  287    HB2  TYR  38          2HB       TYR  38  -0.150   1.702  -0.786
  288    HB3  TYR  38          3HB       TYR  38  -0.860   1.911   0.811
  289    HD1  TYR  38          1HD       TYR  38  -2.355   3.651   0.942
  290    HD2  TYR  38          2HD       TYR  38   1.032   4.065  -1.600
  291    HE1  TYR  38          1HE       TYR  38  -3.109   5.907   0.316
  292    HE2  TYR  38          2HE       TYR  38   0.288   6.323  -2.232
  293    HH   TYR  38           HH       TYR  38  -2.818   7.593  -1.188
  294    H    VAL  39           HN       VAL  39   0.301   3.701   2.599
  295    HA   VAL  39           HA       VAL  39   1.409   6.215   1.801
  296    HB   VAL  39           HB       VAL  39   0.376   7.139   3.762
  297   HG11  VAL  39          1HG1      VAL  39  -1.189   6.748   2.031
  298   HG12  VAL  39          2HG1      VAL  39  -1.280   5.026   2.402
  299   HG13  VAL  39          3HG1      VAL  39  -1.962   6.208   3.521
  300   HG21  VAL  39          1HG2      VAL  39   0.991   5.595   5.457
  301   HG22  VAL  39          2HG2      VAL  39  -0.771   5.608   5.402
  302   HG23  VAL  39          3HG2      VAL  39   0.124   4.278   4.667
  303    H    GLU  40           HN       GLU  40   1.998   4.020   4.543
  304    HA   GLU  40           HA       GLU  40   3.857   5.309   5.995
  305    HB2  GLU  40          2HB       GLU  40   3.020   2.835   6.103
  306    HB3  GLU  40          3HB       GLU  40   4.475   2.492   5.177
  307    HG2  GLU  40          2HG       GLU  40   5.056   4.182   7.439
  308    HG3  GLU  40          3HG       GLU  40   4.247   2.697   7.936
  309    H    LEU  41           HN       LEU  41   4.393   3.863   2.832
  310    HA   LEU  41           HA       LEU  41   7.215   4.318   2.818
  311    HB2  LEU  41          2HB       LEU  41   5.271   3.735   0.591
  312    HB3  LEU  41          3HB       LEU  41   7.020   3.811   0.390
  313    HG   LEU  41           HG       LEU  41   5.341   1.711   1.670
  314   HD11  LEU  41          1HD1      LEU  41   6.433   1.740  -0.697
  315   HD12  LEU  41          2HD1      LEU  41   6.481   0.274   0.282
  316   HD13  LEU  41          3HD1      LEU  41   7.900   1.317   0.187
  317   HD21  LEU  41          1HD2      LEU  41   8.141   2.446   2.477
  318   HD22  LEU  41          2HD2      LEU  41   7.492   0.819   2.683
  319   HD23  LEU  41          3HD2      LEU  41   6.735   2.183   3.508
  320    H    LEU  42           HN       LEU  42   4.393   6.044   1.598
  321    HA   LEU  42           HA       LEU  42   6.015   8.102   0.368
  322    HB2  LEU  42          2HB       LEU  42   3.050   7.733   0.707
  323    HB3  LEU  42          3HB       LEU  42   3.753   9.182  -0.009
  324    HG   LEU  42           HG       LEU  42   4.377   6.485  -1.149
  325   HD11  LEU  42          1HD1      LEU  42   1.883   8.106  -1.599
  326   HD12  LEU  42          2HD1      LEU  42   2.007   6.422  -1.093
  327   HD13  LEU  42          3HD1      LEU  42   2.467   6.886  -2.731
  328   HD21  LEU  42          1HD2      LEU  42   4.252   8.097  -3.229
  329   HD22  LEU  42          2HD2      LEU  42   5.690   8.027  -2.210
  330   HD23  LEU  42          3HD2      LEU  42   4.522   9.332  -1.999
  331    H    ILE  43           HN       ILE  43   3.443   8.164   2.843
  332    HA   ILE  43           HA       ILE  43   3.627  10.665   3.804
  333    HB   ILE  43           HB       ILE  43   2.787   8.159   4.905
  334   HG12  ILE  43          2HG1      ILE  43   1.327   9.761   6.266
  335   HG13  ILE  43          3HG1      ILE  43   2.154  11.063   5.418
  336   HG21  ILE  43          1HG2      ILE  43   4.605   8.292   6.461
  337   HG22  ILE  43          2HG2      ILE  43   4.235   9.978   6.820
  338   HG23  ILE  43          3HG2      ILE  43   3.116   8.706   7.310
  339   HD11  ILE  43          1HD1      ILE  43  -0.132   9.831   4.594
  340   HD12  ILE  43          2HD1      ILE  43   0.961  10.754   3.563
  341   HD13  ILE  43          3HD1      ILE  43   1.103   8.999   3.649
  342    H    LYS  44           HN       LYS  44   6.069   8.218   4.094
  343    HA   LYS  44           HA       LYS  44   7.580   9.590   6.125
  344    HB2  LYS  44          2HB       LYS  44   7.660   7.030   4.803
  345    HB3  LYS  44          3HB       LYS  44   9.257   7.769   4.782
  346    HG2  LYS  44          2HG       LYS  44   8.864   6.305   6.734
  347    HG3  LYS  44          3HG       LYS  44   9.261   7.968   7.171
  348    HD2  LYS  44          2HD       LYS  44   7.472   7.738   8.534
  349    HD3  LYS  44          3HD       LYS  44   6.576   8.141   7.068
  350    HE2  LYS  44          2HE       LYS  44   5.584   6.151   7.071
  351    HE3  LYS  44          3HE       LYS  44   7.142   5.329   7.127
  352    HZ1  LYS  44          1HZ       LYS  44   5.234   5.722   9.207
  353    HZ2  LYS  44          2HZ       LYS  44   6.761   6.286   9.665
  354    HZ3  LYS  44          3HZ       LYS  44   6.569   4.684   9.158
  355    H    GLU  45           HN       GLU  45   7.815   9.144   2.617
  356    HA   GLU  45           HA       GLU  45  10.197  10.737   2.401
  357    HB2  GLU  45          2HB       GLU  45   8.813   8.930   0.750
  358    HB3  GLU  45          3HB       GLU  45   8.758  10.475  -0.086
  359    HG2  GLU  45          2HG       GLU  45  10.740   9.844  -0.899
  360    HG3  GLU  45          3HG       GLU  45  11.355  10.401   0.656
  361    H    GLY  46           HN       GLY  46   6.914  11.190   1.063
  362    HA2  GLY  46          1HA       GLY  46   5.687  13.093   0.690
  363    HA3  GLY  46          2HA       GLY  46   6.600  13.821   2.004
  364    H    LEU  47           HN       LEU  47   7.072  12.863  -1.398
  365    HA   LEU  47           HA       LEU  47   8.836  15.174  -1.749
  366    HB2  LEU  47          2HB       LEU  47   9.245  14.081  -4.008
  367    HB3  LEU  47          3HB       LEU  47   9.859  13.251  -2.581
  368    HG   LEU  47           HG       LEU  47   7.203  12.466  -3.699
  369   HD11  LEU  47          1HD1      LEU  47   9.737  11.232  -4.709
  370   HD12  LEU  47          2HD1      LEU  47   8.999  12.604  -5.533
  371   HD13  LEU  47          3HD1      LEU  47   8.100  11.098  -5.351
  372   HD21  LEU  47          1HD2      LEU  47   9.157  11.460  -1.790
  373   HD22  LEU  47          2HD2      LEU  47   8.640  10.240  -2.955
  374   HD23  LEU  47          3HD2      LEU  47   7.443  11.079  -1.967
  375    H    GLU  48           HN       GLU  48   5.757  13.874  -2.746
  376    HA   GLU  48           HA       GLU  48   4.545  16.226  -3.395
  377    HB2  GLU  48          2HB       GLU  48   4.641  15.981  -5.999
  378    HB3  GLU  48          3HB       GLU  48   5.914  16.844  -5.146
  379    HG2  GLU  48          2HG       GLU  48   7.448  15.136  -5.436
  380    HG3  GLU  48          3HG       GLU  48   6.198  13.928  -5.725
  381    H    THR  49           HN       THR  49   4.941  12.849  -3.996
  382    HA   THR  49           HA       THR  49   2.877  11.988  -5.461
  383    HB   THR  49           HB       THR  49   3.455  10.865  -2.713
  384    HG1  THR  49          1HG       THR  49   4.652   9.482  -4.626
  385   HG21  THR  49          1HG2      THR  49   2.640   9.234  -5.076
  386   HG22  THR  49          2HG2      THR  49   1.404  10.126  -4.189
  387   HG23  THR  49          3HG2      THR  49   2.394   8.928  -3.357
  388    H    ALA  50           HN       ALA  50   2.597  13.590  -2.375
  389    HA   ALA  50           HA       ALA  50   0.817  14.412  -1.219
  390    HB1  ALA  50          1HB       ALA  50  -1.301  14.782  -2.631
  391    HB2  ALA  50          2HB       ALA  50   0.164  15.662  -3.069
  392    HB3  ALA  50          3HB       ALA  50  -0.315  14.235  -3.986
  393    H    ILE  51           HN       ILE  51   1.139  11.356  -1.959
  394    HA   ILE  51           HA       ILE  51  -0.039   9.396  -1.651
  395    HB   ILE  51           HB       ILE  51  -0.725  10.942   0.850
  396   HG12  ILE  51          2HG1      ILE  51   1.203   9.798   1.819
  397   HG13  ILE  51          3HG1      ILE  51   1.487   8.952   0.302
  398   HG21  ILE  51          1HG2      ILE  51  -2.160   8.926   0.378
  399   HG22  ILE  51          2HG2      ILE  51  -0.695   7.953   0.514
  400   HG23  ILE  51          3HG2      ILE  51  -1.265   8.887   1.897
  401   HD11  ILE  51          1HD1      ILE  51   2.826  11.128   0.993
  402   HD12  ILE  51          2HD1      ILE  51   2.427  10.761  -0.685
  403   HD13  ILE  51          3HD1      ILE  51   1.445  11.909   0.224
  404    H    SER  52           HN       SER  52  -1.576   9.596  -3.347
  405    HA   SER  52           HA       SER  52  -4.208  10.647  -2.622
  406    HB2  SER  52          2HB       SER  52  -4.120  11.356  -4.752
  407    HB3  SER  52          3HB       SER  52  -2.719  10.343  -5.099
  408    HG   SER  52           HG       SER  52  -5.382   9.374  -5.000
  409    H    CYS  53           HN       CYS  53  -6.119   9.399  -2.907
  410    HA   CYS  53           HA       CYS  53  -6.349   7.043  -1.688
  411    HB2  CYS  53          2HB       CYS  53  -8.302   8.205  -2.511
  412    HB3  CYS  53          3HB       CYS  53  -7.848   7.872  -4.179
  413    HA   PRO  54           HA       PRO  54  -4.056   4.017  -3.937
  414    HB2  PRO  54          2HB       PRO  54  -5.129   1.802  -2.792
  415    HB3  PRO  54          3HB       PRO  54  -3.971   2.846  -1.961
  416    HG2  PRO  54          2HG       PRO  54  -6.955   2.766  -1.729
  417    HG3  PRO  54          3HG       PRO  54  -5.737   2.917  -0.449
  418    HD2  PRO  54          2HD       PRO  54  -7.115   5.041  -1.407
  419    HD3  PRO  54          3HD       PRO  54  -5.444   5.172  -0.821
  420    H    ASP  55           HN       ASP  55  -7.570   3.883  -3.743
  421    HA   ASP  55           HA       ASP  55  -7.903   1.937  -5.798
  422    HB2  ASP  55          2HB       ASP  55  -9.697   2.175  -4.261
  423    HB3  ASP  55          3HB       ASP  55  -9.778   3.916  -4.510
  424    H    ALA  56           HN       ALA  56  -7.905   2.169  -7.941
  425    HA   ALA  56           HA       ALA  56  -7.232   4.706  -9.100
  426    HB1  ALA  56          1HB       ALA  56  -6.229   2.710  -9.997
  427    HB2  ALA  56          2HB       ALA  56  -7.816   2.036 -10.369
  428    HB3  ALA  56          3HB       ALA  56  -7.236   3.457 -11.236
  429    H    ALA  57           HN       ALA  57 -10.026   2.518  -9.308
  430    HA   ALA  57           HA       ALA  57 -11.578   3.944 -11.102
  431    HB1  ALA  57          1HB       ALA  57 -11.971   1.795  -9.253
  432    HB2  ALA  57          2HB       ALA  57 -13.354   2.888  -9.196
  433    HB3  ALA  57          3HB       ALA  57 -12.859   2.172 -10.730
  434    H    CYS  58           HN       CYS  58 -11.060   4.486  -7.675
  435    HA   CYS  58           HA       CYS  58 -13.015   6.038  -6.777
  436    HB2  CYS  58          2HB       CYS  58 -10.800   5.674  -5.656
  437    HB3  CYS  58          3HB       CYS  58 -10.140   6.965  -6.657
  438    HA   PRO  59           HA       PRO  59 -13.335   8.942 -10.260
  439    HB2  PRO  59          2HB       PRO  59 -15.931   9.564  -9.767
  440    HB3  PRO  59          3HB       PRO  59 -15.442   8.120 -10.663
  441    HG2  PRO  59          2HG       PRO  59 -16.238   8.388  -7.790
  442    HG3  PRO  59          3HG       PRO  59 -16.691   7.140  -8.964
  443    HD2  PRO  59          2HD       PRO  59 -14.764   6.756  -7.102
  444    HD3  PRO  59          3HD       PRO  59 -14.706   5.997  -8.706
  445    H    LYS  60           HN       LYS  60 -13.109   9.294  -6.991
  446    HA   LYS  60           HA       LYS  60 -13.544  12.206  -7.117
  447    HB2  LYS  60          2HB       LYS  60 -14.255  10.205  -5.120
  448    HB3  LYS  60          3HB       LYS  60 -13.345  11.542  -4.429
  449    HG2  LYS  60          2HG       LYS  60 -15.054  12.995  -5.789
  450    HG3  LYS  60          3HG       LYS  60 -16.036  11.531  -5.697
  451    HD2  LYS  60          2HD       LYS  60 -15.264  11.693  -3.139
  452    HD3  LYS  60          3HD       LYS  60 -15.205  13.406  -3.560
  453    HE2  LYS  60          2HE       LYS  60 -17.589  11.655  -4.117
  454    HE3  LYS  60          3HE       LYS  60 -17.395  12.565  -2.619
  455    HZ1  LYS  60          1HZ       LYS  60 -17.261  14.601  -3.941
  456    HZ2  LYS  60          2HZ       LYS  60 -18.729  13.798  -4.183
  457    HZ3  LYS  60          3HZ       LYS  60 -17.514  13.711  -5.357
  458    H    GLN  61           HN       GLN  61 -11.256   9.713  -6.722
  459    HA   GLN  61           HA       GLN  61  -9.089   9.663  -5.942
  460    HB2  GLN  61          2HB       GLN  61  -9.102  12.222  -7.551
  461    HB3  GLN  61          3HB       GLN  61  -7.670  11.295  -7.124
  462    HG2  GLN  61          2HG       GLN  61  -8.501   9.404  -8.423
  463    HG3  GLN  61          3HG       GLN  61  -9.940  10.330  -8.848
  464   HE21  GLN  61          1HE2      GLN  61  -6.476  10.078  -9.246
  465   HE22  GLN  61          2HE2      GLN  61  -6.377  11.032 -10.683
  466    H    GLY  62           HN       GLY  62  -9.789  10.056  -3.695
  467    HA2  GLY  62          1HA       GLY  62  -9.476  12.752  -2.671
  468    HA3  GLY  62          2HA       GLY  62  -9.887  11.321  -1.738
  469    H    HIS  63           HN       HIS  63  -7.734  13.596  -1.715
  470    HA   HIS  63           HA       HIS  63  -5.296  12.024  -1.667
  471    HB2  HIS  63          2HB       HIS  63  -5.823  14.944  -1.083
  472    HB3  HIS  63          3HB       HIS  63  -4.227  14.199  -1.049
  473    HD1  HIS  63          1HD       HIS  63  -6.941  15.252  -3.413
  474    HD2  HIS  63          2HD       HIS  63  -3.075  13.736  -3.539
  475    HE1  HIS  63          1HE       HIS  63  -6.212  15.469  -5.810
  476    H    LEU  64           HN       LEU  64  -3.861  12.072   0.223
  477    HA   LEU  64           HA       LEU  64  -5.404  11.986   2.730
  478    HB2  LEU  64          2HB       LEU  64  -3.133  10.317   1.715
  479    HB3  LEU  64          3HB       LEU  64  -3.462  10.440   3.442
  480    HG   LEU  64           HG       LEU  64  -5.641   9.606   1.572
  481   HD11  LEU  64          1HD1      LEU  64  -3.206   8.082   2.250
  482   HD12  LEU  64          2HD1      LEU  64  -4.285   7.946   0.863
  483   HD13  LEU  64          3HD1      LEU  64  -4.740   7.226   2.407
  484   HD21  LEU  64          1HD2      LEU  64  -5.062   9.539   4.466
  485   HD22  LEU  64          2HD2      LEU  64  -5.893   8.132   3.801
  486   HD23  LEU  64          3HD2      LEU  64  -6.594   9.741   3.617
  487    H    GLN  65           HN       GLN  65  -4.190  12.488   4.703
  488    HA   GLN  65           HA       GLN  65  -2.550  14.839   4.299
  489    HB2  GLN  65          2HB       GLN  65  -2.848  13.962   7.059
  490    HB3  GLN  65          3HB       GLN  65  -3.306  15.486   6.309
  491    HG2  GLN  65          2HG       GLN  65  -5.333  14.675   7.012
  492    HG3  GLN  65          3HG       GLN  65  -5.285  14.119   5.340
  493   HE21  GLN  65          1HE2      GLN  65  -3.190  12.118   6.193
  494   HE22  GLN  65          2HE2      GLN  65  -4.097  10.833   6.908
  495    H    GLU  66           HN       GLU  66  -0.547  15.151   5.559
  496    HA   GLU  66           HA       GLU  66   1.133  12.781   5.326
  497    HB2  GLU  66          2HB       GLU  66   1.557  15.693   5.268
  498    HB3  GLU  66          3HB       GLU  66   2.816  14.787   6.095
  499    HG2  GLU  66          2HG       GLU  66   3.618  13.925   4.197
  500    HG3  GLU  66          3HG       GLU  66   2.011  13.646   3.527
  501    H    ASN  67           HN       ASN  67  -0.227  14.875   7.745
  502    HA   ASN  67           HA       ASN  67   1.441  13.759   9.854
  503    HB2  ASN  67          2HB       ASN  67   1.035  16.097  10.078
  504    HB3  ASN  67          3HB       ASN  67  -0.695  15.891   9.826
  505   HD21  ASN  67          1HD2      ASN  67  -1.921  14.841  11.483
  506   HD22  ASN  67          2HD2      ASN  67  -1.389  14.908  13.125
  507    H    GLU  68           HN       GLU  68  -2.061  14.094   9.248
  508    HA   GLU  68           HA       GLU  68  -3.040  12.512  11.253
  509    HB2  GLU  68          2HB       GLU  68  -3.998  13.475   8.705
  510    HB3  GLU  68          3HB       GLU  68  -4.604  11.854   9.015
  511    HG2  GLU  68          2HG       GLU  68  -4.782  13.836  11.211
  512    HG3  GLU  68          3HG       GLU  68  -5.874  14.019   9.840
  513    H    ILE  69           HN       ILE  69  -1.833  11.450   8.096
  514    HA   ILE  69           HA       ILE  69  -2.403   8.697   8.497
  515    HB   ILE  69           HB       ILE  69  -0.607  10.161   6.584
  516   HG12  ILE  69          2HG1      ILE  69  -3.335   9.098   6.592
  517   HG13  ILE  69          3HG1      ILE  69  -2.613  10.333   5.567
  518   HG21  ILE  69          1HG2      ILE  69   0.496   8.052   7.114
  519   HG22  ILE  69          2HG2      ILE  69  -0.991   7.175   6.758
  520   HG23  ILE  69          3HG2      ILE  69  -0.144   8.034   5.471
  521   HD11  ILE  69          1HD1      ILE  69  -1.686   8.641   4.122
  522   HD12  ILE  69          2HD1      ILE  69  -2.286   7.368   5.184
  523   HD13  ILE  69          3HD1      ILE  69  -3.421   8.391   4.305
  524    H    GLU  70           HN       GLU  70   0.810  10.226   8.239
  525    HA   GLU  70           HA       GLU  70   2.369   8.224   9.193
  526    HB2  GLU  70          2HB       GLU  70   4.035   9.792   9.574
  527    HB3  GLU  70          3HB       GLU  70   2.981  10.641   8.451
  528    HG2  GLU  70          2HG       GLU  70   1.949  11.831  10.315
  529    HG3  GLU  70          3HG       GLU  70   3.002  10.979  11.442
  530    H    CYS  71           HN       CYS  71   0.107  10.107  11.001
  531    HA   CYS  71           HA       CYS  71   1.148   9.602  13.595
  532    HB2  CYS  71          2HB       CYS  71  -0.349  11.428  13.394
  533    HB3  CYS  71          3HB       CYS  71  -1.563  10.445  12.585
  534    HG   CYS  71           HG       CYS  71  -2.443  11.158  15.170
  535    H    MET  72           HN       MET  72  -1.269   7.988  11.578
  536    HA   MET  72           HA       MET  72  -1.921   6.035  13.574
  537    HB2  MET  72          2HB       MET  72  -3.513   5.282  12.112
  538    HB3  MET  72          3HB       MET  72  -3.284   6.904  11.474
  539    HG2  MET  72          2HG       MET  72  -1.510   5.769   9.955
  540    HG3  MET  72          3HG       MET  72  -2.374   4.290  10.368
  541    HE1  MET  72          1HE       MET  72  -1.995   5.111   7.468
  542    HE2  MET  72          2HE       MET  72  -3.101   3.777   7.796
  543    HE3  MET  72          3HE       MET  72  -3.595   5.089   6.724
  544    H    VAL  73           HN       VAL  73   0.856   6.472  12.035
  545    HA   VAL  73           HA       VAL  73   1.484   3.607  12.053
  546    HB   VAL  73           HB       VAL  73   3.111   4.342  10.063
  547   HG11  VAL  73          1HG1      VAL  73   1.699   2.434   9.910
  548   HG12  VAL  73          2HG1      VAL  73   0.247   3.433   9.854
  549   HG13  VAL  73          3HG1      VAL  73   1.371   3.433   8.495
  550   HG21  VAL  73          1HG2      VAL  73   2.475   6.106   8.830
  551   HG22  VAL  73          2HG2      VAL  73   0.760   5.743   9.017
  552   HG23  VAL  73          3HG2      VAL  73   1.620   6.615  10.286
  553    H    ALA  74           HN       ALA  74   3.301   6.538  11.182
  554    HA   ALA  74           HA       ALA  74   5.461   5.730  12.939
  555    HB1  ALA  74          1HB       ALA  74   6.750   6.855  11.521
  556    HB2  ALA  74          2HB       ALA  74   5.311   7.149  10.544
  557    HB3  ALA  74          3HB       ALA  74   5.815   8.332  11.750
  558    H    ALA  75           HN       ALA  75   3.188   6.280  14.403
  559    HA   ALA  75           HA       ALA  75   2.747   8.821  15.342
  560    HB1  ALA  75          1HB       ALA  75   2.727   7.076  17.590
  561    HB2  ALA  75          2HB       ALA  75   1.362   7.704  16.666
  562    HB3  ALA  75          3HB       ALA  75   2.129   6.191  16.186
  Start of MODEL   12
    1    H1   ALA   1           HN       ALA   1 -22.385 -12.204  -9.101
    2    HA   ALA   1           HA       ALA   1 -20.836  -9.973  -8.729
    3    HB1  ALA   1          1HB       ALA   1 -23.565  -9.166  -9.157
    4    HB2  ALA   1          2HB       ALA   1 -22.195  -9.127 -10.268
    5    HB3  ALA   1          3HB       ALA   1 -23.175 -10.586 -10.128
    6    H    LEU   2           HN       LEU   2 -22.683 -11.403  -6.385
    7    HA   LEU   2           HA       LEU   2 -22.595  -8.980  -4.741
    8    HB2  LEU   2          2HB       LEU   2 -24.976 -10.808  -5.019
    9    HB3  LEU   2          3HB       LEU   2 -24.805  -9.575  -3.770
   10    HG   LEU   2           HG       LEU   2 -24.640  -8.760  -6.635
   11   HD11  LEU   2          1HD1      LEU   2 -26.791 -10.248  -5.740
   12   HD12  LEU   2          2HD1      LEU   2 -26.771  -9.162  -7.129
   13   HD13  LEU   2          3HD1      LEU   2 -27.325  -8.578  -5.560
   14   HD21  LEU   2          1HD2      LEU   2 -24.459  -6.815  -5.567
   15   HD22  LEU   2          2HD2      LEU   2 -24.944  -7.525  -4.027
   16   HD23  LEU   2          3HD2      LEU   2 -26.170  -6.983  -5.174
   17    H    ASP   3           HN       ASP   3 -20.636 -10.304  -4.135
   18    HA   ASP   3           HA       ASP   3 -21.146 -12.642  -2.504
   19    HB2  ASP   3          2HB       ASP   3 -18.776 -12.847  -2.319
   20    HB3  ASP   3          3HB       ASP   3 -19.113 -12.371  -3.981
   21    HA   PRO   4           HA       PRO   4 -21.581 -10.546   1.339
   22    HB2  PRO   4          2HB       PRO   4 -20.794 -12.531   3.015
   23    HB3  PRO   4          3HB       PRO   4 -22.347 -12.546   2.172
   24    HG2  PRO   4          2HG       PRO   4 -19.803 -13.961   1.478
   25    HG3  PRO   4          3HG       PRO   4 -21.468 -14.568   1.436
   26    HD2  PRO   4          2HD       PRO   4 -20.160 -13.749  -0.788
   27    HD3  PRO   4          3HD       PRO   4 -21.915 -13.568  -0.593
   28    H    LEU   5           HN       LEU   5 -20.357  -9.227   2.560
   29    HA   LEU   5           HA       LEU   5 -18.550  -8.222   3.507
   30    HB2  LEU   5          2HB       LEU   5 -16.958 -10.732   3.169
   31    HB3  LEU   5          3HB       LEU   5 -16.871  -9.525   4.451
   32    HG   LEU   5           HG       LEU   5 -19.454 -10.743   4.502
   33   HD11  LEU   5          1HD1      LEU   5 -17.188 -12.570   3.989
   34   HD12  LEU   5          2HD1      LEU   5 -18.907 -12.765   3.650
   35   HD13  LEU   5          3HD1      LEU   5 -18.297 -13.020   5.285
   36   HD21  LEU   5          1HD2      LEU   5 -18.318 -11.580   6.744
   37   HD22  LEU   5          2HD2      LEU   5 -18.794  -9.897   6.512
   38   HD23  LEU   5          3HD2      LEU   5 -17.111 -10.377   6.288
   39    H    VAL   6           HN       VAL   6 -15.782  -8.649   2.997
   40    HA   VAL   6           HA       VAL   6 -14.126  -8.114   1.526
   41    HB   VAL   6           HB       VAL   6 -16.084  -8.816  -0.664
   42   HG11  VAL   6          1HG1      VAL   6 -13.905  -7.524  -1.144
   43   HG12  VAL   6          2HG1      VAL   6 -13.100  -9.054  -0.791
   44   HG13  VAL   6          3HG1      VAL   6 -14.267  -8.954  -2.110
   45   HG21  VAL   6          1HG2      VAL   6 -16.028 -10.794   0.501
   46   HG22  VAL   6          2HG2      VAL   6 -14.636 -11.003  -0.560
   47   HG23  VAL   6          3HG2      VAL   6 -14.400 -10.513   1.118
   48    H    SER   7           HN       SER   7 -13.444  -6.145   0.970
   49    HA   SER   7           HA       SER   7 -15.182  -4.320  -0.474
   50    HB2  SER   7          2HB       SER   7 -13.959  -3.044   1.888
   51    HB3  SER   7          3HB       SER   7 -15.551  -2.801   1.171
   52    HG   SER   7           HG       SER   7 -15.653  -3.780   3.250
   53    H    CYS   8           HN       CYS   8 -12.203  -4.139   1.484
   54    HA   CYS   8           HA       CYS   8 -10.751  -2.304   0.194
   55    HB2  CYS   8          2HB       CYS   8  -9.972  -3.767   2.091
   56    HB3  CYS   8          3HB       CYS   8  -9.576  -4.999   0.897
   57    H    LYS   9           HN       LYS   9  -9.440  -2.111  -1.614
   58    HA   LYS   9           HA       LYS   9  -9.799  -4.193  -3.670
   59    HB2  LYS   9          2HB       LYS   9  -9.445  -1.254  -4.244
   60    HB3  LYS   9          3HB       LYS   9  -9.949  -2.520  -5.356
   61    HG2  LYS   9          2HG       LYS   9 -12.047  -1.966  -4.930
   62    HG3  LYS   9          3HG       LYS   9 -11.822  -2.566  -3.285
   63    HD2  LYS   9          2HD       LYS   9 -11.512  -0.466  -2.417
   64    HD3  LYS   9          3HD       LYS   9 -10.884   0.186  -3.932
   65    HE2  LYS   9          2HE       LYS   9 -12.978   1.183  -3.741
   66    HE3  LYS   9          3HE       LYS   9 -13.271  -0.176  -4.827
   67    HZ1  LYS   9          1HZ       LYS   9 -13.612  -0.773  -2.019
   68    HZ2  LYS   9          2HZ       LYS   9 -14.587  -1.183  -3.339
   69    HZ3  LYS   9          3HZ       LYS   9 -14.718   0.350  -2.634
   70    H    LEU  10           HN       LEU  10  -7.619  -3.572  -1.641
   71    HA   LEU  10           HA       LEU  10  -5.391  -3.244  -3.539
   72    HB2  LEU  10          2HB       LEU  10  -5.602  -2.659  -0.598
   73    HB3  LEU  10          3HB       LEU  10  -4.057  -2.739  -1.444
   74    HG   LEU  10           HG       LEU  10  -6.175  -0.884  -2.439
   75   HD11  LEU  10          1HD1      LEU  10  -5.718   0.777  -0.893
   76   HD12  LEU  10          2HD1      LEU  10  -4.234   0.000  -0.342
   77   HD13  LEU  10          3HD1      LEU  10  -5.800  -0.671   0.111
   78   HD21  LEU  10          1HD2      LEU  10  -3.529   0.162  -2.385
   79   HD22  LEU  10          2HD2      LEU  10  -4.524  -0.256  -3.780
   80   HD23  LEU  10          3HD2      LEU  10  -3.475  -1.471  -3.049
   81    H    CYS  11           HN       CYS  11  -7.068  -5.530  -1.842
   82    HA   CYS  11           HA       CYS  11  -4.995  -7.496  -2.233
   83    HB2  CYS  11          2HB       CYS  11  -4.958  -8.299   0.072
   84    HB3  CYS  11          3HB       CYS  11  -4.432  -6.620   0.001
   85    H    LEU  12           HN       LEU  12  -8.212  -6.706  -1.033
   86    HA   LEU  12           HA       LEU  12 -10.222  -7.736  -1.325
   87    HB2  LEU  12          2HB       LEU  12  -8.922  -9.833  -3.018
   88    HB3  LEU  12          3HB       LEU  12 -10.558  -9.187  -3.115
   89    HG   LEU  12           HG       LEU  12  -8.043  -7.730  -3.926
   90   HD11  LEU  12          1HD1      LEU  12  -8.846  -9.699  -5.345
   91   HD12  LEU  12          2HD1      LEU  12  -8.609  -8.150  -6.154
   92   HD13  LEU  12          3HD1      LEU  12 -10.236  -8.686  -5.735
   93   HD21  LEU  12          1HD2      LEU  12  -9.805  -6.245  -3.081
   94   HD22  LEU  12          2HD2      LEU  12 -10.943  -6.952  -4.229
   95   HD23  LEU  12          3HD2      LEU  12  -9.548  -6.044  -4.814
   96    H    GLY  13           HN       GLY  13  -8.971  -8.293   0.972
   97    HA2  GLY  13          1HA       GLY  13  -9.129 -11.216   1.307
   98    HA3  GLY  13          2HA       GLY  13  -8.281 -10.119   2.385
   99    H    GLU  14           HN       GLU  14 -10.758  -8.298   2.050
  100    HA   GLU  14           HA       GLU  14 -12.811  -7.993   3.028
  101    HB2  GLU  14          2HB       GLU  14 -14.151  -9.779   3.119
  102    HB3  GLU  14          3HB       GLU  14 -12.762 -10.749   2.649
  103    HG2  GLU  14          2HG       GLU  14 -12.231 -11.161   4.979
  104    HG3  GLU  14          3HG       GLU  14 -13.574 -10.136   5.482
  105    H    TYR  15           HN       TYR  15 -13.158  -6.953   4.893
  106    HA   TYR  15           HA       TYR  15 -12.199  -7.929   7.414
  107    HB2  TYR  15          2HB       TYR  15 -11.042  -5.282   6.591
  108    HB3  TYR  15          3HB       TYR  15 -10.543  -6.346   7.901
  109    HD1  TYR  15          1HD       TYR  15  -8.919  -8.039   7.552
  110    HD2  TYR  15          2HD       TYR  15 -10.504  -5.905   4.228
  111    HE1  TYR  15          1HE       TYR  15  -7.180  -9.007   6.108
  112    HE2  TYR  15          2HE       TYR  15  -8.769  -6.869   2.776
  113    HH   TYR  15           HH       TYR  15  -6.031  -8.322   3.898
  114    HA   PRO  16           HA       PRO  16 -15.583  -5.518   8.837
  115    HB2  PRO  16          2HB       PRO  16 -14.848  -5.113  11.418
  116    HB3  PRO  16          3HB       PRO  16 -15.406  -6.677  10.812
  117    HG2  PRO  16          2HG       PRO  16 -12.609  -5.714  11.278
  118    HG3  PRO  16          3HG       PRO  16 -13.329  -7.289  11.662
  119    HD2  PRO  16          2HD       PRO  16 -11.775  -6.891   9.480
  120    HD3  PRO  16          3HD       PRO  16 -13.115  -8.055   9.498
  121    H    VAL  17           HN       VAL  17 -16.160  -3.423   9.785
  122    HA   VAL  17           HA       VAL  17 -14.681  -1.302   8.673
  123    HB   VAL  17           HB       VAL  17 -17.217  -1.575   9.729
  124   HG11  VAL  17          1HG1      VAL  17 -16.329  -1.140  11.982
  125   HG12  VAL  17          2HG1      VAL  17 -15.708   0.413  11.422
  126   HG13  VAL  17          3HG1      VAL  17 -17.447   0.116  11.450
  127   HG21  VAL  17          1HG2      VAL  17 -17.005  -0.151   7.939
  128   HG22  VAL  17          2HG2      VAL  17 -17.238   1.004   9.252
  129   HG23  VAL  17          3HG2      VAL  17 -15.618   0.690   8.631
  130    H    GLU  18           HN       GLU  18 -14.305  -3.005  11.598
  131    HA   GLU  18           HA       GLU  18 -12.924  -0.825  12.948
  132    HB2  GLU  18          2HB       GLU  18 -13.397  -3.681  13.819
  133    HB3  GLU  18          3HB       GLU  18 -12.696  -2.412  14.814
  134    HG2  GLU  18          2HG       GLU  18 -14.815  -1.138  14.579
  135    HG3  GLU  18          3HG       GLU  18 -15.501  -2.526  13.735
  136    H    GLN  19           HN       GLN  19 -12.073  -2.656  10.499
  137    HA   GLN  19           HA       GLN  19  -9.304  -2.984  11.449
  138    HB2  GLN  19          2HB       GLN  19 -11.060  -4.866   9.972
  139    HB3  GLN  19          3HB       GLN  19  -9.379  -4.788   9.460
  140    HG2  GLN  19          2HG       GLN  19  -8.784  -5.135  11.906
  141    HG3  GLN  19          3HG       GLN  19 -10.476  -5.568  12.139
  142   HE21  GLN  19          1HE2      GLN  19  -9.063  -7.524  12.842
  143   HE22  GLN  19          2HE2      GLN  19  -8.874  -8.749  11.638
  144    H    MET  20           HN       MET  20 -11.369  -1.441   9.329
  145    HA   MET  20           HA       MET  20  -9.292  -1.042   7.294
  146    HB2  MET  20          2HB       MET  20 -11.969   0.181   6.953
  147    HB3  MET  20          3HB       MET  20 -10.936  -0.617   5.774
  148    HG2  MET  20          2HG       MET  20 -11.593  -2.722   7.300
  149    HG3  MET  20          3HG       MET  20 -13.028  -1.724   7.525
  150    HE1  MET  20          1HE       MET  20 -10.531  -3.104   5.072
  151    HE2  MET  20          2HE       MET  20 -11.445  -3.479   3.611
  152    HE3  MET  20          3HE       MET  20 -10.955  -1.817   3.944
  153    H    THR  21           HN       THR  21  -9.353   1.278   6.343
  154    HA   THR  21           HA       THR  21  -9.630   3.274   8.477
  155    HB   THR  21           HB       THR  21  -7.149   2.710   6.873
  156    HG1  THR  21          1HG       THR  21  -7.007   3.490   9.517
  157   HG21  THR  21          1HG2      THR  21  -6.352   4.916   7.997
  158   HG22  THR  21          2HG2      THR  21  -8.071   5.309   8.043
  159   HG23  THR  21          3HG2      THR  21  -7.279   4.999   6.499
  160    H    THR  22           HN       THR  22 -10.653   5.045   7.814
  161    HA   THR  22           HA       THR  22 -11.616   5.315   5.173
  162    HB   THR  22           HB       THR  22 -11.485   7.648   7.054
  163    HG1  THR  22          1HG       THR  22 -12.507   6.509   8.505
  164   HG21  THR  22          1HG2      THR  22 -13.243   6.694   4.846
  165   HG22  THR  22          2HG2      THR  22 -12.629   8.313   5.180
  166   HG23  THR  22          3HG2      THR  22 -13.962   7.661   6.132
  167    H    ILE  23           HN       ILE  23 -11.241   7.117   3.710
  168    HA   ILE  23           HA       ILE  23  -8.414   7.623   3.391
  169    HB   ILE  23           HB       ILE  23 -10.819   8.289   1.706
  170   HG12  ILE  23          2HG1      ILE  23 -10.135   5.987   1.559
  171   HG13  ILE  23          3HG1      ILE  23  -9.616   6.798   0.085
  172   HG21  ILE  23          1HG2      ILE  23  -9.642  10.060   0.981
  173   HG22  ILE  23          2HG2      ILE  23  -8.126   9.452   1.644
  174   HG23  ILE  23          3HG2      ILE  23  -8.712   8.852   0.094
  175   HD11  ILE  23          1HD1      ILE  23  -7.828   5.429   0.718
  176   HD12  ILE  23          2HD1      ILE  23  -7.358   7.057   1.208
  177   HD13  ILE  23          3HD1      ILE  23  -7.948   5.910   2.410
  178    H    ALA  24           HN       ALA  24 -11.255   9.371   4.402
  179    HA   ALA  24           HA       ALA  24 -11.402  11.343   5.570
  180    HB1  ALA  24          1HB       ALA  24  -9.585  12.012   6.666
  181    HB2  ALA  24          2HB       ALA  24  -8.704  10.749   5.807
  182    HB3  ALA  24          3HB       ALA  24  -8.736  12.393   5.169
  183    H    GLN  25           HN       GLN  25 -11.354  10.889   2.528
  184    HA   GLN  25           HA       GLN  25 -11.772  13.679   1.854
  185    HB2  GLN  25          2HB       GLN  25  -9.468  12.114   0.902
  186    HB3  GLN  25          3HB       GLN  25 -10.371  12.932  -0.366
  187    HG2  GLN  25          2HG       GLN  25  -8.744  14.470   0.218
  188    HG3  GLN  25          3HG       GLN  25 -10.163  15.019   1.108
  189   HE21  GLN  25          1HE2      GLN  25  -8.365  16.125   2.292
  190   HE22  GLN  25          2HE2      GLN  25  -7.668  15.283   3.631
  191    H    CYS  26           HN       CYS  26 -11.306  10.638   0.047
  192    HA   CYS  26           HA       CYS  26 -13.680  11.148  -1.512
  193    HB2  CYS  26          2HB       CYS  26 -13.101   9.002  -2.626
  194    HB3  CYS  26          3HB       CYS  26 -11.771  10.156  -2.621
  195    H    GLN  27           HN       GLN  27 -12.843   9.361   1.315
  196    HA   GLN  27           HA       GLN  27 -14.187   8.304   2.836
  197    HB2  GLN  27          2HB       GLN  27 -16.516   8.522   0.947
  198    HB3  GLN  27          3HB       GLN  27 -16.534   8.421   2.702
  199    HG2  GLN  27          2HG       GLN  27 -15.121  10.753   1.633
  200    HG3  GLN  27          3HG       GLN  27 -16.845  10.701   1.270
  201   HE21  GLN  27          1HE2      GLN  27 -14.483  11.366   3.597
  202   HE22  GLN  27          2HE2      GLN  27 -15.535  11.666   4.935
  203    H    CYS  28           HN       CYS  28 -12.596   6.778   1.376
  204    HA   CYS  28           HA       CYS  28 -14.222   4.585   0.296
  205    HB2  CYS  28          2HB       CYS  28 -11.326   5.343  -0.037
  206    HB3  CYS  28          3HB       CYS  28 -11.922   3.749  -0.488
  207    H    ILE  29           HN       ILE  29 -13.056   2.361   0.674
  208    HA   ILE  29           HA       ILE  29 -12.306   2.182   3.517
  209    HB   ILE  29           HB       ILE  29 -14.670   1.244   2.519
  210   HG12  ILE  29          2HG1      ILE  29 -14.463  -0.359   4.606
  211   HG13  ILE  29          3HG1      ILE  29 -12.971   0.534   4.876
  212   HG21  ILE  29          1HG2      ILE  29 -13.529  -0.429   1.150
  213   HG22  ILE  29          2HG2      ILE  29 -12.760  -1.088   2.593
  214   HG23  ILE  29          3HG2      ILE  29 -14.510  -1.188   2.404
  215   HD11  ILE  29          1HD1      ILE  29 -14.210   2.614   4.968
  216   HD12  ILE  29          2HD1      ILE  29 -15.711   1.752   4.634
  217   HD13  ILE  29          3HD1      ILE  29 -14.842   1.458   6.140
  218    H    PHE  30           HN       PHE  30 -10.427   1.208   3.876
  219    HA   PHE  30           HA       PHE  30  -9.520  -0.962   2.187
  220    HB2  PHE  30          2HB       PHE  30  -7.928   1.600   2.432
  221    HB3  PHE  30          3HB       PHE  30  -7.330   0.104   1.722
  222    HD1  PHE  30          1HD       PHE  30  -9.097   3.147   1.147
  223    HD2  PHE  30          2HD       PHE  30  -8.543  -0.811  -0.316
  224    HE1  PHE  30          1HE       PHE  30 -10.000   3.831  -1.037
  225    HE2  PHE  30          2HE       PHE  30  -9.444  -0.134  -2.503
  226    HZ   PHE  30           HZ       PHE  30 -10.173   2.191  -2.866
  227    H    CYS  31           HN       CYS  31  -8.360  -2.415   3.313
  228    HA   CYS  31           HA       CYS  31  -8.212  -2.321   6.090
  229    HB2  CYS  31          2HB       CYS  31  -6.986  -4.351   5.973
  230    HB3  CYS  31          3HB       CYS  31  -8.075  -4.367   4.590
  231    H    THR  32           HN       THR  32  -6.884  -1.345   7.465
  232    HA   THR  32           HA       THR  32  -5.122   0.597   7.024
  233    HB   THR  32           HB       THR  32  -4.337  -1.484   9.047
  234    HG1  THR  32          1HG       THR  32  -6.560   0.297   9.141
  235   HG21  THR  32          1HG2      THR  32  -4.199   0.836  10.336
  236   HG22  THR  32          2HG2      THR  32  -4.024   1.451   8.692
  237   HG23  THR  32          3HG2      THR  32  -2.883   0.258   9.315
  238    H    LEU  33           HN       LEU  33  -3.932  -2.741   7.467
  239    HA   LEU  33           HA       LEU  33  -1.338  -2.559   6.901
  240    HB2  LEU  33          2HB       LEU  33  -3.376  -4.573   6.361
  241    HB3  LEU  33          3HB       LEU  33  -1.993  -4.679   5.274
  242    HG   LEU  33           HG       LEU  33  -1.439  -4.491   8.185
  243   HD11  LEU  33          1HD1      LEU  33  -2.626  -6.276   8.748
  244   HD12  LEU  33          2HD1      LEU  33  -1.672  -7.228   7.609
  245   HD13  LEU  33          3HD1      LEU  33  -3.182  -6.481   7.087
  246   HD21  LEU  33          1HD2      LEU  33  -0.245  -5.928   5.825
  247   HD22  LEU  33          2HD2      LEU  33   0.300  -6.169   7.485
  248   HD23  LEU  33          3HD2      LEU  33   0.437  -4.578   6.733
  249    H    CYS  34           HN       CYS  34  -3.818  -2.716   4.348
  250    HA   CYS  34           HA       CYS  34  -2.022  -2.355   2.201
  251    HB2  CYS  34          2HB       CYS  34  -4.986  -2.126   2.538
  252    HB3  CYS  34          3HB       CYS  34  -4.245  -1.523   1.060
  253    H    LEU  35           HN       LEU  35  -4.389  -0.035   3.527
  254    HA   LEU  35           HA       LEU  35  -3.446   2.201   2.159
  255    HB2  LEU  35          2HB       LEU  35  -5.552   1.763   3.713
  256    HB3  LEU  35          3HB       LEU  35  -4.521   2.552   4.905
  257    HG   LEU  35           HG       LEU  35  -4.315   4.456   3.216
  258   HD11  LEU  35          1HD1      LEU  35  -5.180   4.056   1.206
  259   HD12  LEU  35          2HD1      LEU  35  -6.763   4.251   1.957
  260   HD13  LEU  35          3HD1      LEU  35  -6.064   2.641   1.780
  261   HD21  LEU  35          1HD2      LEU  35  -7.148   4.295   4.027
  262   HD22  LEU  35          2HD2      LEU  35  -5.946   5.548   4.334
  263   HD23  LEU  35          3HD2      LEU  35  -5.956   4.077   5.308
  264    H    LYS  36           HN       LYS  36  -1.953   0.446   4.611
  265    HA   LYS  36           HA       LYS  36  -0.403   2.697   5.627
  266    HB2  LYS  36          2HB       LYS  36  -1.045   1.172   7.323
  267    HB3  LYS  36          3HB       LYS  36  -0.558  -0.220   6.365
  268    HG2  LYS  36          2HG       LYS  36   1.668   1.557   6.811
  269    HG3  LYS  36          3HG       LYS  36   0.920   1.071   8.335
  270    HD2  LYS  36          2HD       LYS  36   0.995  -1.314   7.345
  271    HD3  LYS  36          3HD       LYS  36   2.169  -0.640   6.213
  272    HE2  LYS  36          2HE       LYS  36   3.753  -0.331   7.827
  273    HE3  LYS  36          3HE       LYS  36   2.562  -0.089   9.104
  274    HZ1  LYS  36          1HZ       LYS  36   3.975  -2.409   8.511
  275    HZ2  LYS  36          2HZ       LYS  36   2.358  -2.719   8.123
  276    HZ3  LYS  36          3HZ       LYS  36   2.769  -2.202   9.680
  277    H    GLN  37           HN       GLN  37   0.481  -0.562   4.472
  278    HA   GLN  37           HA       GLN  37   3.125  -0.161   3.959
  279    HB2  GLN  37          2HB       GLN  37   1.241  -2.126   3.332
  280    HB3  GLN  37          3HB       GLN  37   1.939  -1.668   1.785
  281    HG2  GLN  37          2HG       GLN  37   4.201  -2.011   2.835
  282    HG3  GLN  37          3HG       GLN  37   3.359  -2.732   4.206
  283   HE21  GLN  37          1HE2      GLN  37   2.189  -4.669   3.881
  284   HE22  GLN  37          2HE2      GLN  37   2.565  -5.725   2.567
  285    H    TYR  38           HN       TYR  38   0.469   1.232   2.287
  286    HA   TYR  38           HA       TYR  38   2.016   1.928  -0.064
  287    HB2  TYR  38          2HB       TYR  38  -0.119   1.682  -0.801
  288    HB3  TYR  38          3HB       TYR  38  -0.818   2.098   0.760
  289    HD1  TYR  38          1HD       TYR  38  -2.133   3.983   0.761
  290    HD2  TYR  38          2HD       TYR  38   1.198   3.826  -1.882
  291    HE1  TYR  38          1HE       TYR  38  -2.711   6.218  -0.089
  292    HE2  TYR  38          2HE       TYR  38   0.629   6.061  -2.739
  293    HH   TYR  38           HH       TYR  38  -1.209   7.564  -2.885
  294    H    VAL  39           HN       VAL  39   0.103   3.886   2.226
  295    HA   VAL  39           HA       VAL  39   1.352   6.319   1.600
  296    HB   VAL  39           HB       VAL  39   0.287   7.243   3.531
  297   HG11  VAL  39          1HG1      VAL  39  -1.373   5.080   2.250
  298   HG12  VAL  39          2HG1      VAL  39  -2.038   6.348   3.282
  299   HG13  VAL  39          3HG1      VAL  39  -1.245   6.770   1.764
  300   HG21  VAL  39          1HG2      VAL  39   0.042   4.394   4.474
  301   HG22  VAL  39          2HG2      VAL  39   0.922   5.714   5.242
  302   HG23  VAL  39          3HG2      VAL  39  -0.840   5.738   5.197
  303    H    GLU  40           HN       GLU  40   1.905   4.087   4.318
  304    HA   GLU  40           HA       GLU  40   3.762   5.374   5.794
  305    HB2  GLU  40          2HB       GLU  40   2.878   2.875   5.830
  306    HB3  GLU  40          3HB       GLU  40   4.422   2.562   5.050
  307    HG2  GLU  40          2HG       GLU  40   4.556   4.256   7.442
  308    HG3  GLU  40          3HG       GLU  40   4.033   2.596   7.720
  309    H    LEU  41           HN       LEU  41   4.258   3.989   2.613
  310    HA   LEU  41           HA       LEU  41   7.103   4.340   2.626
  311    HB2  LEU  41          2HB       LEU  41   5.052   3.555   0.613
  312    HB3  LEU  41          3HB       LEU  41   6.638   4.075   0.046
  313    HG   LEU  41           HG       LEU  41   6.413   1.621   0.214
  314   HD11  LEU  41          1HD1      LEU  41   8.391   2.751   2.185
  315   HD12  LEU  41          2HD1      LEU  41   8.597   2.769   0.434
  316   HD13  LEU  41          3HD1      LEU  41   8.521   1.233   1.296
  317   HD21  LEU  41          1HD2      LEU  41   5.769   0.531   2.071
  318   HD22  LEU  41          2HD2      LEU  41   5.035   2.076   2.498
  319   HD23  LEU  41          3HD2      LEU  41   6.618   1.643   3.146
  320    H    LEU  42           HN       LEU  42   4.331   6.179   1.487
  321    HA   LEU  42           HA       LEU  42   6.020   8.199   0.265
  322    HB2  LEU  42          2HB       LEU  42   3.039   7.929   0.575
  323    HB3  LEU  42          3HB       LEU  42   3.810   9.335  -0.156
  324    HG   LEU  42           HG       LEU  42   4.373   6.618  -1.262
  325   HD11  LEU  42          1HD1      LEU  42   2.441   6.943  -2.804
  326   HD12  LEU  42          2HD1      LEU  42   1.879   8.238  -1.746
  327   HD13  LEU  42          3HD1      LEU  42   1.987   6.586  -1.137
  328   HD21  LEU  42          1HD2      LEU  42   4.428   9.453  -2.204
  329   HD22  LEU  42          2HD2      LEU  42   4.266   8.141  -3.372
  330   HD23  LEU  42          3HD2      LEU  42   5.674   8.209  -2.311
  331    H    ILE  43           HN       ILE  43   3.415   8.293   2.705
  332    HA   ILE  43           HA       ILE  43   3.655  10.777   3.702
  333    HB   ILE  43           HB       ILE  43   2.730   8.278   4.758
  334   HG12  ILE  43          2HG1      ILE  43   1.284   9.922   6.105
  335   HG13  ILE  43          3HG1      ILE  43   2.142  11.194   5.243
  336   HG21  ILE  43          1HG2      ILE  43   4.499   8.354   6.364
  337   HG22  ILE  43          2HG2      ILE  43   4.183  10.054   6.709
  338   HG23  ILE  43          3HG2      ILE  43   3.007   8.825   7.177
  339   HD11  ILE  43          1HD1      ILE  43   0.992  10.853   3.359
  340   HD12  ILE  43          2HD1      ILE  43   1.036   9.097   3.529
  341   HD13  ILE  43          3HD1      ILE  43  -0.161  10.040   4.416
  342    H    LYS  44           HN       LYS  44   6.022   8.263   3.983
  343    HA   LYS  44           HA       LYS  44   7.537   9.574   6.059
  344    HB2  LYS  44          2HB       LYS  44   7.573   7.014   4.703
  345    HB3  LYS  44          3HB       LYS  44   9.190   7.700   4.800
  346    HG2  LYS  44          2HG       LYS  44   8.604   6.214   6.695
  347    HG3  LYS  44          3HG       LYS  44   9.060   7.848   7.182
  348    HD2  LYS  44          2HD       LYS  44   7.185   7.676   8.439
  349    HD3  LYS  44          3HD       LYS  44   6.407   8.177   6.936
  350    HE2  LYS  44          2HE       LYS  44   5.316   6.245   6.783
  351    HE3  LYS  44          3HE       LYS  44   6.809   5.326   6.971
  352    HZ1  LYS  44          1HZ       LYS  44   4.732   5.617   8.807
  353    HZ2  LYS  44          2HZ       LYS  44   6.079   6.403   9.460
  354    HZ3  LYS  44          3HZ       LYS  44   6.187   4.777   9.008
  355    H    GLU  45           HN       GLU  45   8.316   8.703   2.684
  356    HA   GLU  45           HA       GLU  45  10.622   9.967   2.240
  357    HB2  GLU  45          2HB       GLU  45   8.261   9.455   0.588
  358    HB3  GLU  45          3HB       GLU  45   9.234  10.800   0.010
  359    HG2  GLU  45          2HG       GLU  45  10.819   9.452  -0.760
  360    HG3  GLU  45          3HG       GLU  45  10.859   8.514   0.733
  361    H    GLY  46           HN       GLY  46   7.527  11.696   1.783
  362    HA2  GLY  46          1HA       GLY  46   6.966  13.884   2.245
  363    HA3  GLY  46          2HA       GLY  46   8.467  14.026   3.149
  364    H    LEU  47           HN       LEU  47   7.592  13.494  -0.270
  365    HA   LEU  47           HA       LEU  47   9.235  15.832  -0.960
  366    HB2  LEU  47          2HB       LEU  47  10.444  14.733  -2.568
  367    HB3  LEU  47          3HB       LEU  47  10.303  13.489  -1.328
  368    HG   LEU  47           HG       LEU  47   8.442  13.622  -3.687
  369   HD11  LEU  47          1HD1      LEU  47  10.910  13.446  -4.311
  370   HD12  LEU  47          2HD1      LEU  47   9.826  12.198  -4.922
  371   HD13  LEU  47          3HD1      LEU  47  10.867  11.860  -3.538
  372   HD21  LEU  47          1HD2      LEU  47   8.383  12.149  -1.358
  373   HD22  LEU  47          2HD2      LEU  47   9.113  11.045  -2.523
  374   HD23  LEU  47          3HD2      LEU  47   7.536  11.762  -2.856
  375    H    GLU  48           HN       GLU  48   6.797  13.506  -2.075
  376    HA   GLU  48           HA       GLU  48   5.054  15.522  -3.008
  377    HB2  GLU  48          2HB       GLU  48   5.222  15.315  -5.366
  378    HB3  GLU  48          3HB       GLU  48   6.858  15.579  -4.779
  379    HG2  GLU  48          2HG       GLU  48   7.572  13.591  -5.503
  380    HG3  GLU  48          3HG       GLU  48   6.107  12.762  -4.982
  381    H    THR  49           HN       THR  49   4.028  13.842  -5.218
  382    HA   THR  49           HA       THR  49   2.786  11.936  -5.594
  383    HB   THR  49           HB       THR  49   3.222  11.008  -2.769
  384    HG1  THR  49          1HG       THR  49   5.297  11.077  -3.263
  385   HG21  THR  49          1HG2      THR  49   1.804   9.972  -4.881
  386   HG22  THR  49          2HG2      THR  49   2.396   9.052  -3.497
  387   HG23  THR  49          3HG2      THR  49   3.338   9.108  -4.987
  388    H    ALA  50           HN       ALA  50   2.483  13.645  -2.536
  389    HA   ALA  50           HA       ALA  50   0.682  14.434  -1.387
  390    HB1  ALA  50          1HB       ALA  50  -0.918  14.077  -3.907
  391    HB2  ALA  50          2HB       ALA  50  -1.146  15.263  -2.621
  392    HB3  ALA  50          3HB       ALA  50   0.246  15.386  -3.696
  393    H    ILE  51           HN       ILE  51   1.052  11.387  -2.123
  394    HA   ILE  51           HA       ILE  51  -0.098   9.411  -1.828
  395    HB   ILE  51           HB       ILE  51  -0.813  10.971   0.655
  396   HG12  ILE  51          2HG1      ILE  51   1.071   9.803   1.657
  397   HG13  ILE  51          3HG1      ILE  51   1.338   8.899   0.171
  398   HG21  ILE  51          1HG2      ILE  51  -0.951   7.992   0.210
  399   HG22  ILE  51          2HG2      ILE  51  -1.305   8.848   1.710
  400   HG23  ILE  51          3HG2      ILE  51  -2.341   9.074   0.301
  401   HD11  ILE  51          1HD1      ILE  51   2.762  11.029   0.795
  402   HD12  ILE  51          2HD1      ILE  51   2.333  10.651  -0.874
  403   HD13  ILE  51          3HD1      ILE  51   1.411  11.857   0.022
  404    H    SER  52           HN       SER  52  -1.626   9.430  -3.490
  405    HA   SER  52           HA       SER  52  -4.270  10.529  -2.881
  406    HB2  SER  52          2HB       SER  52  -3.946   9.223  -5.481
  407    HB3  SER  52          3HB       SER  52  -4.524  10.845  -5.100
  408    HG   SER  52           HG       SER  52  -2.286  10.313  -6.209
  409    H    CYS  53           HN       CYS  53  -6.181   9.240  -3.253
  410    HA   CYS  53           HA       CYS  53  -6.423   6.961  -1.857
  411    HB2  CYS  53          2HB       CYS  53  -8.338   8.129  -2.838
  412    HB3  CYS  53          3HB       CYS  53  -7.878   7.563  -4.440
  413    HA   PRO  54           HA       PRO  54  -4.061   3.842  -3.904
  414    HB2  PRO  54          2HB       PRO  54  -5.106   1.688  -2.624
  415    HB3  PRO  54          3HB       PRO  54  -3.965   2.800  -1.858
  416    HG2  PRO  54          2HG       PRO  54  -6.948   2.690  -1.628
  417    HG3  PRO  54          3HG       PRO  54  -5.736   2.939  -0.358
  418    HD2  PRO  54          2HD       PRO  54  -7.141   4.979  -1.451
  419    HD3  PRO  54          3HD       PRO  54  -5.475   5.171  -0.870
  420    H    ASP  55           HN       ASP  55  -7.236   4.502  -4.457
  421    HA   ASP  55           HA       ASP  55  -7.595   2.186  -6.242
  422    HB2  ASP  55          2HB       ASP  55  -9.332   3.258  -4.334
  423    HB3  ASP  55          3HB       ASP  55  -9.973   3.808  -5.880
  424    H    ALA  56           HN       ALA  56  -7.891   2.489  -8.389
  425    HA   ALA  56           HA       ALA  56  -7.299   5.123  -9.442
  426    HB1  ALA  56          1HB       ALA  56  -7.249   2.363 -10.459
  427    HB2  ALA  56          2HB       ALA  56  -7.680   3.600 -11.642
  428    HB3  ALA  56          3HB       ALA  56  -6.153   3.710 -10.767
  429    H    ALA  57           HN       ALA  57 -10.023   2.941  -9.212
  430    HA   ALA  57           HA       ALA  57 -11.689   4.217 -11.113
  431    HB1  ALA  57          1HB       ALA  57 -11.947   1.892 -10.086
  432    HB2  ALA  57          2HB       ALA  57 -12.706   2.715  -8.724
  433    HB3  ALA  57          3HB       ALA  57 -13.414   2.840 -10.334
  434    H    CYS  58           HN       CYS  58 -11.018   4.791  -7.728
  435    HA   CYS  58           HA       CYS  58 -13.018   6.200  -6.701
  436    HB2  CYS  58          2HB       CYS  58 -10.646   5.996  -5.797
  437    HB3  CYS  58          3HB       CYS  58 -10.258   7.420  -6.758
  438    HA   PRO  59           HA       PRO  59 -13.779   9.061 -10.151
  439    HB2  PRO  59          2HB       PRO  59 -16.377   9.490  -9.488
  440    HB3  PRO  59          3HB       PRO  59 -15.842   8.084 -10.416
  441    HG2  PRO  59          2HG       PRO  59 -16.465   8.301  -7.495
  442    HG3  PRO  59          3HG       PRO  59 -16.902   7.019  -8.640
  443    HD2  PRO  59          2HD       PRO  59 -14.832   6.785  -6.909
  444    HD3  PRO  59          3HD       PRO  59 -14.824   6.027  -8.514
  445    H    LYS  60           HN       LYS  60 -13.367   9.439  -6.904
  446    HA   LYS  60           HA       LYS  60 -14.137  12.279  -6.929
  447    HB2  LYS  60          2HB       LYS  60 -15.167  11.273  -5.075
  448    HB3  LYS  60          3HB       LYS  60 -13.758  10.285  -4.712
  449    HG2  LYS  60          2HG       LYS  60 -12.987  11.809  -3.307
  450    HG3  LYS  60          3HG       LYS  60 -13.064  13.061  -4.550
  451    HD2  LYS  60          2HD       LYS  60 -14.421  13.544  -2.507
  452    HD3  LYS  60          3HD       LYS  60 -15.343  13.551  -4.012
  453    HE2  LYS  60          2HE       LYS  60 -15.421  10.910  -3.079
  454    HE3  LYS  60          3HE       LYS  60 -15.683  11.925  -1.660
  455    HZ1  LYS  60          1HZ       LYS  60 -17.183  12.324  -4.180
  456    HZ2  LYS  60          2HZ       LYS  60 -17.552  12.914  -2.638
  457    HZ3  LYS  60          3HZ       LYS  60 -17.718  11.264  -2.974
  458    H    GLN  61           HN       GLN  61 -11.482  10.055  -6.270
  459    HA   GLN  61           HA       GLN  61  -9.224  10.354  -6.282
  460    HB2  GLN  61          2HB       GLN  61  -9.558  13.203  -7.156
  461    HB3  GLN  61          3HB       GLN  61  -8.286  12.060  -7.565
  462    HG2  GLN  61          2HG       GLN  61 -10.180  10.764  -8.765
  463    HG3  GLN  61          3HG       GLN  61 -11.040  12.301  -8.688
  464   HE21  GLN  61          1HE2      GLN  61  -8.583  13.858  -8.903
  465   HE22  GLN  61          2HE2      GLN  61  -8.094  13.755 -10.556
  466    H    GLY  62           HN       GLY  62 -10.340  10.535  -3.873
  467    HA2  GLY  62          1HA       GLY  62  -9.736  13.008  -2.536
  468    HA3  GLY  62          2HA       GLY  62 -10.237  11.506  -1.776
  469    H    HIS  63           HN       HIS  63  -7.780  13.661  -1.969
  470    HA   HIS  63           HA       HIS  63  -5.567  11.804  -1.877
  471    HB2  HIS  63          2HB       HIS  63  -5.771  14.793  -1.506
  472    HB3  HIS  63          3HB       HIS  63  -4.260  13.910  -1.307
  473    HD1  HIS  63          1HD       HIS  63  -6.873  14.599  -3.966
  474    HD2  HIS  63          2HD       HIS  63  -2.887  13.479  -3.622
  475    HE1  HIS  63          1HE       HIS  63  -5.967  14.608  -6.312
  476    H    LEU  64           HN       LEU  64  -3.993  11.963  -0.019
  477    HA   LEU  64           HA       LEU  64  -5.485  11.989   2.521
  478    HB2  LEU  64          2HB       LEU  64  -3.134  10.327   1.643
  479    HB3  LEU  64          3HB       LEU  64  -3.698  10.408   3.310
  480    HG   LEU  64           HG       LEU  64  -5.703   9.651   1.268
  481   HD11  LEU  64          1HD1      LEU  64  -4.787   7.224   1.652
  482   HD12  LEU  64          2HD1      LEU  64  -3.251   8.066   1.855
  483   HD13  LEU  64          3HD1      LEU  64  -4.155   8.233   0.351
  484   HD21  LEU  64          1HD2      LEU  64  -6.760   8.779   3.040
  485   HD22  LEU  64          2HD2      LEU  64  -5.626   9.736   3.993
  486   HD23  LEU  64          3HD2      LEU  64  -5.292   8.033   3.672
  487    H    GLN  65           HN       GLN  65  -4.228  12.557   4.448
  488    HA   GLN  65           HA       GLN  65  -2.591  14.885   3.929
  489    HB2  GLN  65          2HB       GLN  65  -2.821  14.062   6.719
  490    HB3  GLN  65          3HB       GLN  65  -3.258  15.585   5.956
  491    HG2  GLN  65          2HG       GLN  65  -5.290  14.846   6.708
  492    HG3  GLN  65          3HG       GLN  65  -5.289  14.243   5.052
  493   HE21  GLN  65          1HE2      GLN  65  -3.223  12.217   5.924
  494   HE22  GLN  65          2HE2      GLN  65  -4.148  10.975   6.690
  495    H    GLU  66           HN       GLU  66  -0.591  15.217   5.288
  496    HA   GLU  66           HA       GLU  66   1.130  12.892   4.942
  497    HB2  GLU  66          2HB       GLU  66   1.499  15.807   5.020
  498    HB3  GLU  66          3HB       GLU  66   2.765  14.897   5.832
  499    HG2  GLU  66          2HG       GLU  66   3.626  14.149   3.915
  500    HG3  GLU  66          3HG       GLU  66   2.041  13.826   3.216
  501    H    ASN  67           HN       ASN  67  -0.147  14.953   7.469
  502    HA   ASN  67           HA       ASN  67   1.465  13.647   9.511
  503    HB2  ASN  67          2HB       ASN  67   1.266  15.899  10.029
  504    HB3  ASN  67          3HB       ASN  67  -0.398  15.991   9.458
  505   HD21  ASN  67          1HD2      ASN  67  -2.065  15.384  10.810
  506   HD22  ASN  67          2HD2      ASN  67  -1.844  15.140  12.507
  507    H    GLU  68           HN       GLU  68  -2.026  14.272   9.079
  508    HA   GLU  68           HA       GLU  68  -3.086  12.666  10.981
  509    HB2  GLU  68          2HB       GLU  68  -3.980  13.682   8.412
  510    HB3  GLU  68          3HB       GLU  68  -4.710  12.126   8.780
  511    HG2  GLU  68          2HG       GLU  68  -4.694  14.265  10.854
  512    HG3  GLU  68          3HG       GLU  68  -5.859  14.335   9.534
  513    H    ILE  69           HN       ILE  69  -1.733  11.623   7.904
  514    HA   ILE  69           HA       ILE  69  -2.515   8.889   8.196
  515    HB   ILE  69           HB       ILE  69  -0.657  10.335   6.342
  516   HG12  ILE  69          2HG1      ILE  69  -3.367   9.223   6.284
  517   HG13  ILE  69          3HG1      ILE  69  -2.648  10.486   5.291
  518   HG21  ILE  69          1HG2      ILE  69  -0.992   7.345   6.522
  519   HG22  ILE  69          2HG2      ILE  69  -0.167   8.205   5.223
  520   HG23  ILE  69          3HG2      ILE  69   0.479   8.256   6.863
  521   HD11  ILE  69          1HD1      ILE  69  -2.258   7.532   4.878
  522   HD12  ILE  69          2HD1      ILE  69  -3.385   8.551   3.982
  523   HD13  ILE  69          3HD1      ILE  69  -1.649   8.829   3.850
  524    H    GLU  70           HN       GLU  70   0.711  10.419   8.241
  525    HA   GLU  70           HA       GLU  70   2.180   8.273   9.129
  526    HB2  GLU  70          2HB       GLU  70   3.895   9.753   9.539
  527    HB3  GLU  70          3HB       GLU  70   2.877  10.718   8.481
  528    HG2  GLU  70          2HG       GLU  70   1.931  11.868  10.391
  529    HG3  GLU  70          3HG       GLU  70   2.879  10.863  11.486
  530    H    CYS  71           HN       CYS  71  -0.191  10.032  10.838
  531    HA   CYS  71           HA       CYS  71   0.777   9.466  13.480
  532    HB2  CYS  71          2HB       CYS  71  -1.033  11.243  12.472
  533    HB3  CYS  71          3HB       CYS  71  -2.099  10.019  13.153
  534    HG   CYS  71           HG       CYS  71   0.265  11.830  14.836
  535    H    MET  72           HN       MET  72  -1.417   7.955  11.203
  536    HA   MET  72           HA       MET  72  -2.406   6.040  13.116
  537    HB2  MET  72          2HB       MET  72  -3.826   5.300  11.447
  538    HB3  MET  72          3HB       MET  72  -3.577   6.975  10.977
  539    HG2  MET  72          2HG       MET  72  -1.554   5.752   9.652
  540    HG3  MET  72          3HG       MET  72  -2.790   4.497   9.631
  541    HE1  MET  72          1HE       MET  72  -2.016   5.056   7.037
  542    HE2  MET  72          2HE       MET  72  -3.665   4.429   7.068
  543    HE3  MET  72          3HE       MET  72  -3.273   5.830   6.069
  544    H    VAL  73           HN       VAL  73   0.530   6.368  11.877
  545    HA   VAL  73           HA       VAL  73   1.019   3.474  11.891
  546    HB   VAL  73           HB       VAL  73   2.797   3.911  10.097
  547   HG11  VAL  73          1HG1      VAL  73   0.018   4.243   9.033
  548   HG12  VAL  73          2HG1      VAL  73   1.338   3.243   8.422
  549   HG13  VAL  73          3HG1      VAL  73   0.481   2.772   9.889
  550   HG21  VAL  73          1HG2      VAL  73   1.623   5.850   8.583
  551   HG22  VAL  73          2HG2      VAL  73   1.443   6.508  10.209
  552   HG23  VAL  73          3HG2      VAL  73   3.044   6.087   9.601
  553    H    ALA  74           HN       ALA  74   2.766   6.578  11.624
  554    HA   ALA  74           HA       ALA  74   4.755   5.550  13.522
  555    HB1  ALA  74          1HB       ALA  74   5.987   6.319  11.765
  556    HB2  ALA  74          2HB       ALA  74   4.820   7.576  11.351
  557    HB3  ALA  74          3HB       ALA  74   5.902   7.795  12.726
  558    H    ALA  75           HN       ALA  75   2.413   6.151  14.743
  559    HA   ALA  75           HA       ALA  75   1.913   8.725  15.590
  560    HB1  ALA  75          1HB       ALA  75   1.364   7.328  17.846
  561    HB2  ALA  75          2HB       ALA  75   0.301   7.412  16.441
  562    HB3  ALA  75          3HB       ALA  75   1.385   6.037  16.645
  Start of MODEL   13
    1    H1   ALA   1           HN       ALA   1 -19.284 -20.163   1.271
    2    HA   ALA   1           HA       ALA   1 -20.313 -17.817  -0.040
    3    HB1  ALA   1          1HB       ALA   1 -20.766 -19.467  -1.763
    4    HB2  ALA   1          2HB       ALA   1 -21.606 -20.485  -0.593
    5    HB3  ALA   1          3HB       ALA   1 -22.272 -18.911  -1.032
    6    H    LEU   2           HN       LEU   2 -20.564 -17.013   2.041
    7    HA   LEU   2           HA       LEU   2 -22.909 -18.023   3.452
    8    HB2  LEU   2          2HB       LEU   2 -20.604 -17.268   5.154
    9    HB3  LEU   2          3HB       LEU   2 -21.906 -18.413   5.459
   10    HG   LEU   2           HG       LEU   2 -20.649 -19.795   3.586
   11   HD11  LEU   2          1HD1      LEU   2 -18.193 -18.786   4.822
   12   HD12  LEU   2          2HD1      LEU   2 -18.966 -17.663   3.703
   13   HD13  LEU   2          3HD1      LEU   2 -18.512 -19.278   3.158
   14   HD21  LEU   2          1HD2      LEU   2 -20.676 -21.059   5.422
   15   HD22  LEU   2          2HD2      LEU   2 -20.510 -19.663   6.487
   16   HD23  LEU   2          3HD2      LEU   2 -19.077 -20.399   5.766
   17    H    ASP   3           HN       ASP   3 -20.327 -15.569   3.585
   18    HA   ASP   3           HA       ASP   3 -22.151 -13.411   3.310
   19    HB2  ASP   3          2HB       ASP   3 -21.417 -12.478   5.675
   20    HB3  ASP   3          3HB       ASP   3 -22.825 -13.524   5.508
   21    HA   PRO   4           HA       PRO   4 -17.730 -12.601   2.211
   22    HB2  PRO   4          2HB       PRO   4 -18.297 -11.551  -0.227
   23    HB3  PRO   4          3HB       PRO   4 -18.093 -13.285   0.048
   24    HG2  PRO   4          2HG       PRO   4 -20.614 -11.683  -0.172
   25    HG3  PRO   4          3HG       PRO   4 -20.230 -13.267  -0.872
   26    HD2  PRO   4          2HD       PRO   4 -21.722 -12.989   1.370
   27    HD3  PRO   4          3HD       PRO   4 -20.656 -14.382   1.100
   28    H    LEU   5           HN       LEU   5 -17.160 -10.362   0.812
   29    HA   LEU   5           HA       LEU   5 -18.658  -8.066   1.405
   30    HB2  LEU   5          2HB       LEU   5 -17.814  -8.908   3.715
   31    HB3  LEU   5          3HB       LEU   5 -16.269  -8.238   3.197
   32    HG   LEU   5           HG       LEU   5 -17.141  -6.033   3.145
   33   HD11  LEU   5          1HD1      LEU   5 -19.669  -5.863   3.937
   34   HD12  LEU   5          2HD1      LEU   5 -19.758  -7.425   3.121
   35   HD13  LEU   5          3HD1      LEU   5 -19.221  -5.996   2.236
   36   HD21  LEU   5          1HD2      LEU   5 -16.618  -6.339   5.339
   37   HD22  LEU   5          2HD2      LEU   5 -17.749  -7.676   5.541
   38   HD23  LEU   5          3HD2      LEU   5 -18.344  -6.016   5.506
   39    H    VAL   6           HN       VAL   6 -15.254  -9.131   1.380
   40    HA   VAL   6           HA       VAL   6 -13.413  -8.212   0.358
   41    HB   VAL   6           HB       VAL   6 -14.303  -9.549  -1.444
   42   HG11  VAL   6          1HG1      VAL   6 -16.014  -7.142  -2.041
   43   HG12  VAL   6          2HG1      VAL   6 -15.793  -8.491  -3.156
   44   HG13  VAL   6          3HG1      VAL   6 -16.550  -8.758  -1.585
   45   HG21  VAL   6          1HG2      VAL   6 -12.578  -7.442  -1.752
   46   HG22  VAL   6          2HG2      VAL   6 -12.863  -8.712  -2.942
   47   HG23  VAL   6          3HG2      VAL   6 -13.733  -7.183  -3.059
   48    H    SER   7           HN       SER   7 -14.214  -6.237   1.826
   49    HA   SER   7           HA       SER   7 -15.164  -3.921   0.513
   50    HB2  SER   7          2HB       SER   7 -14.477  -4.655   3.155
   51    HB3  SER   7          3HB       SER   7 -13.504  -3.239   2.761
   52    HG   SER   7           HG       SER   7 -16.204  -3.453   3.170
   53    H    CYS   8           HN       CYS   8 -11.928  -4.279   1.950
   54    HA   CYS   8           HA       CYS   8 -10.646  -2.241   0.699
   55    HB2  CYS   8          2HB       CYS   8  -9.700  -3.855   2.414
   56    HB3  CYS   8          3HB       CYS   8  -9.351  -4.941   1.074
   57    H    LYS   9           HN       LYS   9  -9.374  -1.994  -1.176
   58    HA   LYS   9           HA       LYS   9 -10.023  -3.881  -3.345
   59    HB2  LYS   9          2HB       LYS   9  -9.357  -1.111  -4.107
   60    HB3  LYS   9          3HB       LYS   9 -10.586  -2.192  -4.750
   61    HG2  LYS   9          2HG       LYS   9 -11.716  -1.717  -2.409
   62    HG3  LYS   9          3HG       LYS   9 -10.744  -0.246  -2.516
   63    HD2  LYS   9          2HD       LYS   9 -11.925   0.567  -4.291
   64    HD3  LYS   9          3HD       LYS   9 -12.307  -1.041  -4.912
   65    HE2  LYS   9          2HE       LYS   9 -14.033  -1.346  -3.330
   66    HE3  LYS   9          3HE       LYS   9 -13.502   0.036  -2.373
   67    HZ1  LYS   9          1HZ       LYS   9 -15.451   0.052  -4.281
   68    HZ2  LYS   9          2HZ       LYS   9 -14.129   0.760  -5.064
   69    HZ3  LYS   9          3HZ       LYS   9 -14.702   1.414  -3.613
   70    H    LEU  10           HN       LEU  10  -7.670  -3.597  -1.461
   71    HA   LEU  10           HA       LEU  10  -5.576  -3.327  -3.518
   72    HB2  LEU  10          2HB       LEU  10  -5.563  -2.668  -0.591
   73    HB3  LEU  10          3HB       LEU  10  -4.066  -2.947  -1.479
   74    HG   LEU  10           HG       LEU  10  -6.032  -0.885  -2.409
   75   HD11  LEU  10          1HD1      LEU  10  -5.111  -0.764   0.119
   76   HD12  LEU  10          2HD1      LEU  10  -5.428   0.653  -0.881
   77   HD13  LEU  10          3HD1      LEU  10  -3.786   0.025  -0.737
   78   HD21  LEU  10          1HD2      LEU  10  -3.119  -0.506  -2.587
   79   HD22  LEU  10          2HD2      LEU  10  -4.380  -0.212  -3.784
   80   HD23  LEU  10          3HD2      LEU  10  -3.769  -1.847  -3.530
   81    H    CYS  11           HN       CYS  11  -7.043  -5.334  -1.145
   82    HA   CYS  11           HA       CYS  11  -5.117  -7.459  -1.783
   83    HB2  CYS  11          2HB       CYS  11  -5.140  -8.243   0.520
   84    HB3  CYS  11          3HB       CYS  11  -4.604  -6.566   0.467
   85    H    LEU  12           HN       LEU  12  -8.323  -6.630  -0.536
   86    HA   LEU  12           HA       LEU  12 -10.347  -7.649  -0.735
   87    HB2  LEU  12          2HB       LEU  12  -9.179  -9.449  -2.828
   88    HB3  LEU  12          3HB       LEU  12 -10.830  -8.849  -2.684
   89    HG   LEU  12           HG       LEU  12  -9.259  -6.567  -3.025
   90   HD11  LEU  12          1HD1      LEU  12  -8.140  -8.901  -4.458
   91   HD12  LEU  12          2HD1      LEU  12  -7.354  -7.426  -3.898
   92   HD13  LEU  12          3HD1      LEU  12  -8.320  -7.405  -5.373
   93   HD21  LEU  12          1HD2      LEU  12 -10.569  -6.239  -4.919
   94   HD22  LEU  12          2HD2      LEU  12 -11.569  -7.285  -3.911
   95   HD23  LEU  12          3HD2      LEU  12 -10.671  -7.965  -5.268
   96    H    GLY  13           HN       GLY  13  -9.705  -8.520   1.421
   97    HA2  GLY  13          1HA       GLY  13  -9.612 -11.470   1.302
   98    HA3  GLY  13          2HA       GLY  13  -8.673 -10.566   2.481
   99    H    GLU  14           HN       GLU  14 -11.761  -9.287   1.740
  100    HA   GLU  14           HA       GLU  14 -13.652  -9.028   2.979
  101    HB2  GLU  14          2HB       GLU  14 -13.813 -11.470   2.410
  102    HB3  GLU  14          3HB       GLU  14 -13.079 -11.824   3.966
  103    HG2  GLU  14          2HG       GLU  14 -15.247 -10.078   4.440
  104    HG3  GLU  14          3HG       GLU  14 -15.809 -11.339   3.344
  105    H    TYR  15           HN       TYR  15 -13.582  -7.607   4.582
  106    HA   TYR  15           HA       TYR  15 -12.699  -8.467   7.215
  107    HB2  TYR  15          2HB       TYR  15 -11.584  -5.923   6.036
  108    HB3  TYR  15          3HB       TYR  15 -11.149  -6.683   7.562
  109    HD1  TYR  15          1HD       TYR  15  -9.842  -8.809   7.548
  110    HD2  TYR  15          2HD       TYR  15 -10.549  -6.574   3.998
  111    HE1  TYR  15          1HE       TYR  15  -8.013 -10.015   6.431
  112    HE2  TYR  15          2HE       TYR  15  -8.723  -7.775   2.871
  113    HH   TYR  15           HH       TYR  15  -6.393  -9.260   4.217
  114    HA   PRO  16           HA       PRO  16 -16.101  -6.022   8.534
  115    HB2  PRO  16          2HB       PRO  16 -15.311  -5.389  11.053
  116    HB3  PRO  16          3HB       PRO  16 -15.843  -7.010  10.593
  117    HG2  PRO  16          2HG       PRO  16 -13.063  -5.945  10.901
  118    HG3  PRO  16          3HG       PRO  16 -13.731  -7.499  11.432
  119    HD2  PRO  16          2HD       PRO  16 -12.243  -7.245   9.184
  120    HD3  PRO  16          3HD       PRO  16 -13.551  -8.437   9.334
  121    H    VAL  17           HN       VAL  17 -16.762  -3.883   9.059
  122    HA   VAL  17           HA       VAL  17 -15.131  -1.849   7.930
  123    HB   VAL  17           HB       VAL  17 -17.814  -2.102   8.398
  124   HG11  VAL  17          1HG1      VAL  17 -16.976   0.200  10.131
  125   HG12  VAL  17          2HG1      VAL  17 -18.564  -0.557   9.984
  126   HG13  VAL  17          3HG1      VAL  17 -17.254  -1.408  10.802
  127   HG21  VAL  17          1HG2      VAL  17 -17.987   0.174   7.490
  128   HG22  VAL  17          2HG2      VAL  17 -16.270   0.423   7.807
  129   HG23  VAL  17          3HG2      VAL  17 -16.783  -0.787   6.631
  130    H    GLU  18           HN       GLU  18 -15.152  -3.250  10.978
  131    HA   GLU  18           HA       GLU  18 -14.232  -0.843  12.353
  132    HB2  GLU  18          2HB       GLU  18 -14.358  -2.148  14.387
  133    HB3  GLU  18          3HB       GLU  18 -15.852  -2.337  13.480
  134    HG2  GLU  18          2HG       GLU  18 -15.580  -4.534  13.288
  135    HG3  GLU  18          3HG       GLU  18 -13.890  -4.367  12.814
  136    H    GLN  19           HN       GLN  19 -12.814  -2.785  10.297
  137    HA   GLN  19           HA       GLN  19 -10.277  -2.863  11.791
  138    HB2  GLN  19          2HB       GLN  19 -11.500  -4.900   9.962
  139    HB3  GLN  19          3HB       GLN  19  -9.752  -4.801  10.126
  140    HG2  GLN  19          2HG       GLN  19  -9.947  -5.167  12.527
  141    HG3  GLN  19          3HG       GLN  19 -11.701  -5.253  12.373
  142   HE21  GLN  19          1HE2      GLN  19 -11.040  -7.351  13.496
  143   HE22  GLN  19          2HE2      GLN  19 -10.792  -8.713  12.463
  144    H    MET  20           HN       MET  20 -11.893  -1.370   9.379
  145    HA   MET  20           HA       MET  20  -9.485  -1.010   7.724
  146    HB2  MET  20          2HB       MET  20 -12.046   0.026   6.703
  147    HB3  MET  20          3HB       MET  20 -10.780  -0.867   5.872
  148    HG2  MET  20          2HG       MET  20 -11.672  -2.872   7.286
  149    HG3  MET  20          3HG       MET  20 -13.124  -1.880   7.400
  150    HE1  MET  20          1HE       MET  20 -10.533  -3.499   5.323
  151    HE2  MET  20          2HE       MET  20 -11.358  -4.063   3.868
  152    HE3  MET  20          3HE       MET  20 -10.727  -2.416   3.945
  153    H    THR  21           HN       THR  21  -9.515   1.254   6.624
  154    HA   THR  21           HA       THR  21 -10.378   3.323   8.515
  155    HB   THR  21           HB       THR  21  -7.565   2.936   7.501
  156    HG1  THR  21          1HG       THR  21  -8.241   3.611  10.137
  157   HG21  THR  21          1HG2      THR  21  -7.241   5.174   8.813
  158   HG22  THR  21          2HG2      THR  21  -8.947   5.418   8.438
  159   HG23  THR  21          3HG2      THR  21  -7.778   5.210   7.134
  160    H    THR  22           HN       THR  22 -11.178   5.101   7.561
  161    HA   THR  22           HA       THR  22 -11.605   5.129   4.753
  162    HB   THR  22           HB       THR  22 -12.058   7.316   6.793
  163    HG1  THR  22          1HG       THR  22 -13.407   5.028   6.138
  164   HG21  THR  22          1HG2      THR  22 -12.728   7.083   3.883
  165   HG22  THR  22          2HG2      THR  22 -12.082   8.461   4.774
  166   HG23  THR  22          3HG2      THR  22 -13.774   8.002   4.964
  167    H    ILE  23           HN       ILE  23 -10.957   6.797   3.259
  168    HA   ILE  23           HA       ILE  23  -8.175   7.298   3.307
  169    HB   ILE  23           HB       ILE  23 -10.378   8.340   1.538
  170   HG12  ILE  23          2HG1      ILE  23  -9.844   5.993   1.237
  171   HG13  ILE  23          3HG1      ILE  23  -9.238   6.904  -0.142
  172   HG21  ILE  23          1HG2      ILE  23  -7.932   8.774   0.259
  173   HG22  ILE  23          2HG2      ILE  23  -9.048   9.991   0.876
  174   HG23  ILE  23          3HG2      ILE  23  -7.730   9.409   1.892
  175   HD11  ILE  23          1HD1      ILE  23  -7.674   5.739   2.138
  176   HD12  ILE  23          2HD1      ILE  23  -7.568   5.344   0.422
  177   HD13  ILE  23          3HD1      ILE  23  -6.996   6.908   1.004
  178    H    ALA  24           HN       ALA  24 -10.202  10.001   2.482
  179    HA   ALA  24           HA       ALA  24 -10.338  11.559   4.678
  180    HB1  ALA  24          1HB       ALA  24  -8.181  11.593   5.383
  181    HB2  ALA  24          2HB       ALA  24  -7.529  11.342   3.763
  182    HB3  ALA  24          3HB       ALA  24  -8.101  12.939   4.246
  183    H    GLN  25           HN       GLN  25 -11.424  11.246   2.044
  184    HA   GLN  25           HA       GLN  25 -12.073  13.867   1.409
  185    HB2  GLN  25          2HB       GLN  25  -9.538  13.038   0.312
  186    HB3  GLN  25          3HB       GLN  25 -10.680  13.369  -0.983
  187    HG2  GLN  25          2HG       GLN  25  -9.797  15.233   1.202
  188    HG3  GLN  25          3HG       GLN  25  -9.478  15.368  -0.527
  189   HE21  GLN  25          1HE2      GLN  25 -11.550  16.181   2.010
  190   HE22  GLN  25          2HE2      GLN  25 -12.809  16.908   1.079
  191    H    CYS  26           HN       CYS  26 -11.438  10.687  -0.018
  192    HA   CYS  26           HA       CYS  26 -13.792  10.941  -1.723
  193    HB2  CYS  26          2HB       CYS  26 -13.047   8.843  -2.737
  194    HB3  CYS  26          3HB       CYS  26 -11.733  10.014  -2.698
  195    H    GLN  27           HN       GLN  27 -12.741   9.388   1.192
  196    HA   GLN  27           HA       GLN  27 -13.914   8.277   2.803
  197    HB2  GLN  27          2HB       GLN  27 -16.379   8.534   1.090
  198    HB3  GLN  27          3HB       GLN  27 -16.290   8.326   2.834
  199    HG2  GLN  27          2HG       GLN  27 -15.080  10.747   1.590
  200    HG3  GLN  27          3HG       GLN  27 -16.828  10.656   1.795
  201   HE21  GLN  27          1HE2      GLN  27 -13.749  10.580   3.471
  202   HE22  GLN  27          2HE2      GLN  27 -14.362  11.060   5.013
  203    H    CYS  28           HN       CYS  28 -12.444   6.709   1.341
  204    HA   CYS  28           HA       CYS  28 -14.128   4.538   0.310
  205    HB2  CYS  28          2HB       CYS  28 -11.223   5.239  -0.068
  206    HB3  CYS  28          3HB       CYS  28 -11.853   3.652  -0.499
  207    H    ILE  29           HN       ILE  29 -12.753   2.325   0.640
  208    HA   ILE  29           HA       ILE  29 -12.156   2.138   3.518
  209    HB   ILE  29           HB       ILE  29 -14.410   1.096   2.446
  210   HG12  ILE  29          2HG1      ILE  29 -14.363  -0.493   4.416
  211   HG13  ILE  29          3HG1      ILE  29 -12.706   0.029   4.702
  212   HG21  ILE  29          1HG2      ILE  29 -12.390  -1.144   2.385
  213   HG22  ILE  29          2HG2      ILE  29 -14.128  -1.297   2.129
  214   HG23  ILE  29          3HG2      ILE  29 -13.143  -0.402   0.972
  215   HD11  ILE  29          1HD1      ILE  29 -13.350   2.137   5.371
  216   HD12  ILE  29          2HD1      ILE  29 -14.897   2.045   4.528
  217   HD13  ILE  29          3HD1      ILE  29 -14.645   1.126   6.011
  218    H    PHE  30           HN       PHE  30 -10.243   1.275   3.969
  219    HA   PHE  30           HA       PHE  30  -9.100  -0.789   2.290
  220    HB2  PHE  30          2HB       PHE  30  -7.757   1.895   2.645
  221    HB3  PHE  30          3HB       PHE  30  -6.937   0.458   2.044
  222    HD1  PHE  30          1HD       PHE  30  -8.015  -0.681  -0.029
  223    HD2  PHE  30          2HD       PHE  30  -8.765   3.337   1.158
  224    HE1  PHE  30          1HE       PHE  30  -8.756  -0.148  -2.314
  225    HE2  PHE  30          2HE       PHE  30  -9.509   3.877  -1.125
  226    HZ   PHE  30           HZ       PHE  30  -9.505   2.132  -2.864
  227    H    CYS  31           HN       CYS  31  -8.186  -2.261   3.555
  228    HA   CYS  31           HA       CYS  31  -8.054  -2.044   6.333
  229    HB2  CYS  31          2HB       CYS  31  -6.999  -4.171   6.326
  230    HB3  CYS  31          3HB       CYS  31  -8.079  -4.166   4.935
  231    H    THR  32           HN       THR  32  -6.602  -1.233   7.707
  232    HA   THR  32           HA       THR  32  -4.720   0.589   7.217
  233    HB   THR  32           HB       THR  32  -3.903  -1.465   9.222
  234    HG1  THR  32          1HG       THR  32  -6.317   0.024   9.252
  235   HG21  THR  32          1HG2      THR  32  -4.325   1.373   9.920
  236   HG22  THR  32          2HG2      THR  32  -3.072   1.055   8.720
  237   HG23  THR  32          3HG2      THR  32  -2.984   0.295  10.309
  238    H    LEU  33           HN       LEU  33  -4.060  -2.906   7.218
  239    HA   LEU  33           HA       LEU  33  -1.396  -3.033   6.809
  240    HB2  LEU  33          2HB       LEU  33  -3.684  -4.636   5.940
  241    HB3  LEU  33          3HB       LEU  33  -2.253  -4.828   4.927
  242    HG   LEU  33           HG       LEU  33  -1.723  -5.022   7.805
  243   HD11  LEU  33          1HD1      LEU  33  -3.895  -6.558   6.599
  244   HD12  LEU  33          2HD1      LEU  33  -3.478  -6.316   8.296
  245   HD13  LEU  33          3HD1      LEU  33  -2.650  -7.554   7.352
  246   HD21  LEU  33          1HD2      LEU  33  -0.048  -6.328   7.089
  247   HD22  LEU  33          2HD2      LEU  33  -0.439  -5.683   5.494
  248   HD23  LEU  33          3HD2      LEU  33  -1.092  -7.243   6.000
  249    H    CYS  34           HN       CYS  34  -3.600  -3.017   4.005
  250    HA   CYS  34           HA       CYS  34  -1.595  -2.330   2.151
  251    HB2  CYS  34          2HB       CYS  34  -4.549  -1.791   1.825
  252    HB3  CYS  34          3HB       CYS  34  -3.361  -2.075   0.556
  253    H    LEU  35           HN       LEU  35  -4.271  -0.324   3.400
  254    HA   LEU  35           HA       LEU  35  -3.548   2.083   2.272
  255    HB2  LEU  35          2HB       LEU  35  -5.629   1.586   3.562
  256    HB3  LEU  35          3HB       LEU  35  -4.685   1.748   5.042
  257    HG   LEU  35           HG       LEU  35  -4.324   4.081   4.633
  258   HD11  LEU  35          1HD1      LEU  35  -4.001   4.372   2.371
  259   HD12  LEU  35          2HD1      LEU  35  -5.607   5.065   2.593
  260   HD13  LEU  35          3HD1      LEU  35  -5.433   3.438   1.936
  261   HD21  LEU  35          1HD2      LEU  35  -6.300   4.453   5.565
  262   HD22  LEU  35          2HD2      LEU  35  -6.899   2.914   4.945
  263   HD23  LEU  35          3HD2      LEU  35  -7.063   4.378   3.976
  264    H    LYS  36           HN       LYS  36  -1.904   0.318   4.676
  265    HA   LYS  36           HA       LYS  36  -0.483   2.625   5.734
  266    HB2  LYS  36          2HB       LYS  36  -1.071   0.868   7.297
  267    HB3  LYS  36          3HB       LYS  36  -0.242  -0.332   6.314
  268    HG2  LYS  36          2HG       LYS  36   1.883   0.921   6.734
  269    HG3  LYS  36          3HG       LYS  36   0.990   1.918   7.885
  270    HD2  LYS  36          2HD       LYS  36   1.126  -1.088   8.051
  271    HD3  LYS  36          3HD       LYS  36   2.261  -0.017   8.879
  272    HE2  LYS  36          2HE       LYS  36   0.687   0.724  10.363
  273    HE3  LYS  36          3HE       LYS  36  -0.649   0.475   9.241
  274    HZ1  LYS  36          1HZ       LYS  36  -0.299  -1.957   9.570
  275    HZ2  LYS  36          2HZ       LYS  36  -0.838  -1.137  10.947
  276    HZ3  LYS  36          3HZ       LYS  36   0.786  -1.589  10.814
  277    H    GLN  37           HN       GLN  37   0.701  -0.514   4.532
  278    HA   GLN  37           HA       GLN  37   3.266   0.192   3.940
  279    HB2  GLN  37          2HB       GLN  37   1.521  -1.959   3.272
  280    HB3  GLN  37          3HB       GLN  37   2.387  -1.490   1.816
  281    HG2  GLN  37          2HG       GLN  37   3.967  -2.871   2.572
  282    HG3  GLN  37          3HG       GLN  37   4.399  -1.529   3.630
  283   HE21  GLN  37          1HE2      GLN  37   2.296  -4.368   3.462
  284   HE22  GLN  37          2HE2      GLN  37   2.397  -4.761   5.141
  285    H    TYR  38           HN       TYR  38   0.417   1.228   2.334
  286    HA   TYR  38           HA       TYR  38   1.726   1.986  -0.122
  287    HB2  TYR  38          2HB       TYR  38  -0.412   1.786  -0.772
  288    HB3  TYR  38          3HB       TYR  38  -0.999   1.868   0.886
  289    HD1  TYR  38          1HD       TYR  38  -2.639   3.464   1.123
  290    HD2  TYR  38          2HD       TYR  38   0.676   4.305  -1.409
  291    HE1  TYR  38          1HE       TYR  38  -3.542   5.712   0.697
  292    HE2  TYR  38          2HE       TYR  38  -0.217   6.556  -1.840
  293    HH   TYR  38           HH       TYR  38  -3.394   7.487  -0.879
  294    H    VAL  39           HN       VAL  39   0.255   3.748   2.604
  295    HA   VAL  39           HA       VAL  39   1.333   6.265   1.706
  296    HB   VAL  39           HB       VAL  39   0.362   7.196   3.756
  297   HG11  VAL  39          1HG1      VAL  39  -1.767   7.161   2.967
  298   HG12  VAL  39          2HG1      VAL  39  -0.973   6.390   1.593
  299   HG13  VAL  39          3HG1      VAL  39  -1.795   5.405   2.804
  300   HG21  VAL  39          1HG2      VAL  39  -0.042   4.304   4.422
  301   HG22  VAL  39          2HG2      VAL  39   0.651   5.587   5.414
  302   HG23  VAL  39          3HG2      VAL  39  -1.086   5.546   5.111
  303    H    GLU  40           HN       GLU  40   1.850   4.178   4.549
  304    HA   GLU  40           HA       GLU  40   3.704   5.447   5.986
  305    HB2  GLU  40          2HB       GLU  40   2.900   2.876   5.894
  306    HB3  GLU  40          3HB       GLU  40   4.536   2.694   5.276
  307    HG2  GLU  40          2HG       GLU  40   4.385   4.372   7.651
  308    HG3  GLU  40          3HG       GLU  40   3.808   2.728   7.914
  309    H    LEU  41           HN       LEU  41   4.248   4.094   2.798
  310    HA   LEU  41           HA       LEU  41   7.084   4.645   2.850
  311    HB2  LEU  41          2HB       LEU  41   5.164   3.477   0.902
  312    HB3  LEU  41          3HB       LEU  41   6.683   4.127   0.289
  313    HG   LEU  41           HG       LEU  41   6.803   1.711   0.634
  314   HD11  LEU  41          1HD1      LEU  41   8.591   3.660   1.649
  315   HD12  LEU  41          2HD1      LEU  41   8.954   2.045   1.041
  316   HD13  LEU  41          3HD1      LEU  41   8.605   2.285   2.753
  317   HD21  LEU  41          1HD2      LEU  41   6.405   0.645   2.639
  318   HD22  LEU  41          2HD2      LEU  41   5.160   1.895   2.648
  319   HD23  LEU  41          3HD2      LEU  41   6.637   2.113   3.589
  320    H    LEU  42           HN       LEU  42   4.202   5.998   1.297
  321    HA   LEU  42           HA       LEU  42   5.676   8.072  -0.035
  322    HB2  LEU  42          2HB       LEU  42   2.744   7.557   0.374
  323    HB3  LEU  42          3HB       LEU  42   3.349   8.985  -0.464
  324    HG   LEU  42           HG       LEU  42   4.100   6.232  -1.386
  325   HD11  LEU  42          1HD1      LEU  42   1.734   6.097  -1.335
  326   HD12  LEU  42          2HD1      LEU  42   2.187   6.448  -3.002
  327   HD13  LEU  42          3HD1      LEU  42   1.559   7.733  -1.972
  328   HD21  LEU  42          1HD2      LEU  42   4.318   8.998  -2.357
  329   HD22  LEU  42          2HD2      LEU  42   3.815   7.816  -3.566
  330   HD23  LEU  42          3HD2      LEU  42   5.330   7.592  -2.689
  331    H    ILE  43           HN       ILE  43   3.088   8.246   2.417
  332    HA   ILE  43           HA       ILE  43   3.184  10.824   3.160
  333    HB   ILE  43           HB       ILE  43   2.217   8.499   4.350
  334   HG12  ILE  43          2HG1      ILE  43   1.333  10.435   6.021
  335   HG13  ILE  43          3HG1      ILE  43   1.926  11.426   4.692
  336   HG21  ILE  43          1HG2      ILE  43   4.339   8.553   5.711
  337   HG22  ILE  43          2HG2      ILE  43   3.739  10.044   6.434
  338   HG23  ILE  43          3HG2      ILE  43   2.837   8.541   6.635
  339   HD11  ILE  43          1HD1      ILE  43   0.182  10.917   3.420
  340   HD12  ILE  43          2HD1      ILE  43   0.327   9.194   3.770
  341   HD13  ILE  43          3HD1      ILE  43  -0.551  10.249   4.877
  342    H    LYS  44           HN       LYS  44   5.674   8.467   3.738
  343    HA   LYS  44           HA       LYS  44   7.116  10.036   5.659
  344    HB2  LYS  44          2HB       LYS  44   7.295   7.401   4.533
  345    HB3  LYS  44          3HB       LYS  44   8.864   8.188   4.424
  346    HG2  LYS  44          2HG       LYS  44   8.595   6.885   6.486
  347    HG3  LYS  44          3HG       LYS  44   8.871   8.600   6.801
  348    HD2  LYS  44          2HD       LYS  44   7.112   8.338   8.196
  349    HD3  LYS  44          3HD       LYS  44   6.181   8.568   6.716
  350    HE2  LYS  44          2HE       LYS  44   5.355   6.506   6.840
  351    HE3  LYS  44          3HE       LYS  44   6.968   5.814   7.000
  352    HZ1  LYS  44          1HZ       LYS  44   6.772   5.652   9.215
  353    HZ2  LYS  44          2HZ       LYS  44   5.110   5.718   8.911
  354    HZ3  LYS  44          3HZ       LYS  44   5.940   7.117   9.374
  355    H    GLU  45           HN       GLU  45   7.730   9.153   2.257
  356    HA   GLU  45           HA       GLU  45   9.981  10.775   1.902
  357    HB2  GLU  45          2HB       GLU  45   8.153   9.263   0.204
  358    HB3  GLU  45          3HB       GLU  45   8.762  10.711  -0.585
  359    HG2  GLU  45          2HG       GLU  45  10.420   9.312  -1.183
  360    HG3  GLU  45          3HG       GLU  45  11.059   9.776   0.392
  361    H    GLY  46           HN       GLY  46   6.794  11.437   0.443
  362    HA2  GLY  46          1HA       GLY  46   5.623  13.407   0.222
  363    HA3  GLY  46          2HA       GLY  46   6.650  14.092   1.472
  364    H    LEU  47           HN       LEU  47   6.622  13.228  -1.971
  365    HA   LEU  47           HA       LEU  47   8.489  15.458  -2.446
  366    HB2  LEU  47          2HB       LEU  47   9.057  14.242  -4.565
  367    HB3  LEU  47          3HB       LEU  47   9.573  13.458  -3.073
  368    HG   LEU  47           HG       LEU  47   7.057  12.663  -4.515
  369   HD11  LEU  47          1HD1      LEU  47   9.480  12.491  -5.705
  370   HD12  LEU  47          2HD1      LEU  47   8.157  11.355  -5.971
  371   HD13  LEU  47          3HD1      LEU  47   9.435  10.966  -4.820
  372   HD21  LEU  47          1HD2      LEU  47   8.222  11.964  -2.047
  373   HD22  LEU  47          2HD2      LEU  47   8.436  10.582  -3.122
  374   HD23  LEU  47          3HD2      LEU  47   6.823  11.235  -2.835
  375    H    GLU  48           HN       GLU  48   5.449  14.003  -3.259
  376    HA   GLU  48           HA       GLU  48   4.201  16.248  -4.177
  377    HB2  GLU  48          2HB       GLU  48   4.229  15.688  -6.721
  378    HB3  GLU  48          3HB       GLU  48   5.549  16.616  -6.024
  379    HG2  GLU  48          2HG       GLU  48   7.039  15.086  -6.609
  380    HG3  GLU  48          3HG       GLU  48   6.088  13.789  -5.887
  381    H    THR  49           HN       THR  49   4.607  12.822  -4.336
  382    HA   THR  49           HA       THR  49   2.413  11.862  -5.617
  383    HB   THR  49           HB       THR  49   3.182  10.808  -2.898
  384    HG1  THR  49          1HG       THR  49   5.117  10.573  -3.721
  385   HG21  THR  49          1HG2      THR  49   2.744   8.919  -5.062
  386   HG22  THR  49          2HG2      THR  49   1.339   9.947  -4.781
  387   HG23  THR  49          3HG2      THR  49   2.008   8.990  -3.461
  388    H    ALA  50           HN       ALA  50   2.453  13.727  -2.705
  389    HA   ALA  50           HA       ALA  50   0.820  14.446  -1.279
  390    HB1  ALA  50          1HB       ALA  50   0.020  15.785  -2.982
  391    HB2  ALA  50          2HB       ALA  50  -0.500  14.411  -3.960
  392    HB3  ALA  50          3HB       ALA  50  -1.419  14.871  -2.526
  393    H    ILE  51           HN       ILE  51   1.093  11.444  -1.859
  394    HA   ILE  51           HA       ILE  51  -0.079   9.483  -1.501
  395    HB   ILE  51           HB       ILE  51  -0.739  11.125   0.946
  396   HG12  ILE  51          2HG1      ILE  51   1.180   9.998   1.942
  397   HG13  ILE  51          3HG1      ILE  51   1.431   9.070   0.467
  398   HG21  ILE  51          1HG2      ILE  51  -0.834   8.130   0.619
  399   HG22  ILE  51          2HG2      ILE  51  -1.199   9.046   2.080
  400   HG23  ILE  51          3HG2      ILE  51  -2.245   9.187   0.668
  401   HD11  ILE  51          1HD1      ILE  51   2.825  11.244   1.029
  402   HD12  ILE  51          2HD1      ILE  51   2.389  10.811  -0.625
  403   HD13  ILE  51          3HD1      ILE  51   1.449  12.023   0.247
  404    H    SER  52           HN       SER  52  -1.639   9.528  -3.157
  405    HA   SER  52           HA       SER  52  -4.296  10.526  -2.393
  406    HB2  SER  52          2HB       SER  52  -4.499  11.232  -4.510
  407    HB3  SER  52          3HB       SER  52  -2.833  10.728  -4.795
  408    HG   SER  52           HG       SER  52  -3.549   9.115  -5.928
  409    H    CYS  53           HN       CYS  53  -6.157   9.212  -2.824
  410    HA   CYS  53           HA       CYS  53  -6.310   6.792  -1.734
  411    HB2  CYS  53          2HB       CYS  53  -8.229   8.050  -2.719
  412    HB3  CYS  53          3HB       CYS  53  -7.756   7.454  -4.307
  413    HA   PRO  54           HA       PRO  54  -3.749   4.028  -4.042
  414    HB2  PRO  54          2HB       PRO  54  -4.659   1.711  -2.962
  415    HB3  PRO  54          3HB       PRO  54  -3.585   2.817  -2.097
  416    HG2  PRO  54          2HG       PRO  54  -6.555   2.506  -1.885
  417    HG3  PRO  54          3HG       PRO  54  -5.357   2.714  -0.594
  418    HD2  PRO  54          2HD       PRO  54  -6.885   4.756  -1.505
  419    HD3  PRO  54          3HD       PRO  54  -5.232   4.995  -0.905
  420    H    ASP  55           HN       ASP  55  -7.052   4.405  -4.405
  421    HA   ASP  55           HA       ASP  55  -7.251   2.279  -6.424
  422    HB2  ASP  55          2HB       ASP  55  -9.065   3.251  -4.463
  423    HB3  ASP  55          3HB       ASP  55  -9.737   3.638  -6.045
  424    H    ALA  56           HN       ALA  56  -6.948   2.839  -8.466
  425    HA   ALA  56           HA       ALA  56  -6.693   5.517  -9.330
  426    HB1  ALA  56          1HB       ALA  56  -5.835   3.187 -10.317
  427    HB2  ALA  56          2HB       ALA  56  -7.243   3.430 -11.352
  428    HB3  ALA  56          3HB       ALA  56  -5.970   4.650 -11.294
  429    H    ALA  57           HN       ALA  57  -9.289   3.131  -9.668
  430    HA   ALA  57           HA       ALA  57 -10.976   4.506 -11.380
  431    HB1  ALA  57          1HB       ALA  57 -12.653   3.240  -9.534
  432    HB2  ALA  57          2HB       ALA  57 -12.074   2.602 -11.072
  433    HB3  ALA  57          3HB       ALA  57 -11.182   2.268  -9.588
  434    H    CYS  58           HN       CYS  58 -10.611   4.808  -7.878
  435    HA   CYS  58           HA       CYS  58 -12.669   6.241  -7.002
  436    HB2  CYS  58          2HB       CYS  58 -10.505   5.816  -5.774
  437    HB3  CYS  58          3HB       CYS  58  -9.849   7.238  -6.578
  438    HA   PRO  59           HA       PRO  59 -12.801   9.431 -10.237
  439    HB2  PRO  59          2HB       PRO  59 -15.438   9.969  -9.883
  440    HB3  PRO  59          3HB       PRO  59 -14.856   8.615 -10.859
  441    HG2  PRO  59          2HG       PRO  59 -15.860   8.623  -8.039
  442    HG3  PRO  59          3HG       PRO  59 -16.202   7.474  -9.344
  443    HD2  PRO  59          2HD       PRO  59 -14.404   6.961  -7.386
  444    HD3  PRO  59          3HD       PRO  59 -14.217   6.343  -9.041
  445    H    LYS  60           HN       LYS  60 -12.801   9.506  -6.946
  446    HA   LYS  60           HA       LYS  60 -13.365  12.394  -6.828
  447    HB2  LYS  60          2HB       LYS  60 -13.297  10.386  -4.568
  448    HB3  LYS  60          3HB       LYS  60 -13.688  12.094  -4.417
  449    HG2  LYS  60          2HG       LYS  60 -15.429  11.134  -6.364
  450    HG3  LYS  60          3HG       LYS  60 -15.383   9.877  -5.126
  451    HD2  LYS  60          2HD       LYS  60 -15.603  11.988  -3.526
  452    HD3  LYS  60          3HD       LYS  60 -16.361  12.677  -4.965
  453    HE2  LYS  60          2HE       LYS  60 -17.762  10.530  -5.013
  454    HE3  LYS  60          3HE       LYS  60 -17.197  10.278  -3.363
  455    HZ1  LYS  60          1HZ       LYS  60 -18.046  12.645  -2.976
  456    HZ2  LYS  60          2HZ       LYS  60 -19.189  11.405  -3.102
  457    HZ3  LYS  60          3HZ       LYS  60 -18.912  12.437  -4.414
  458    H    GLN  61           HN       GLN  61 -10.907  10.075  -6.746
  459    HA   GLN  61           HA       GLN  61  -8.743  10.076  -5.935
  460    HB2  GLN  61          2HB       GLN  61  -9.150  12.599  -7.499
  461    HB3  GLN  61          3HB       GLN  61  -7.583  12.258  -6.779
  462    HG2  GLN  61          2HG       GLN  61  -7.981   9.925  -7.993
  463    HG3  GLN  61          3HG       GLN  61  -8.961  10.948  -9.043
  464   HE21  GLN  61          1HE2      GLN  61  -7.354  13.298  -8.703
  465   HE22  GLN  61          2HE2      GLN  61  -5.887  13.039  -9.576
  466    H    GLY  62           HN       GLY  62  -9.443  10.154  -3.661
  467    HA2  GLY  62          1HA       GLY  62  -9.338  12.731  -2.333
  468    HA3  GLY  62          2HA       GLY  62  -9.623  11.172  -1.572
  469    H    HIS  63           HN       HIS  63  -7.695  13.566  -1.187
  470    HA   HIS  63           HA       HIS  63  -5.147  12.131  -1.271
  471    HB2  HIS  63          2HB       HIS  63  -5.786  15.020  -0.647
  472    HB3  HIS  63          3HB       HIS  63  -4.164  14.335  -0.649
  473    HD1  HIS  63          1HD       HIS  63  -6.662  15.855  -2.831
  474    HD2  HIS  63          2HD       HIS  63  -3.322  13.426  -3.288
  475    HE1  HIS  63          1HE       HIS  63  -6.050  16.004  -5.265
  476    H    LEU  64           HN       LEU  64  -3.824  11.901   0.574
  477    HA   LEU  64           HA       LEU  64  -5.349  11.776   3.076
  478    HB2  LEU  64          2HB       LEU  64  -2.823  10.415   2.172
  479    HB3  LEU  64          3HB       LEU  64  -3.419  10.336   3.827
  480    HG   LEU  64           HG       LEU  64  -3.909   8.388   2.188
  481   HD11  LEU  64          1HD1      LEU  64  -5.085   7.870   3.997
  482   HD12  LEU  64          2HD1      LEU  64  -6.457   8.697   3.260
  483   HD13  LEU  64          3HD1      LEU  64  -5.391   9.568   4.362
  484   HD21  LEU  64          1HD2      LEU  64  -6.032   8.660   0.976
  485   HD22  LEU  64          2HD2      LEU  64  -4.766   9.719   0.353
  486   HD23  LEU  64          3HD2      LEU  64  -6.034  10.374   1.390
  487    H    GLN  65           HN       GLN  65  -4.133  12.249   5.096
  488    HA   GLN  65           HA       GLN  65  -2.733  14.778   4.794
  489    HB2  GLN  65          2HB       GLN  65  -3.025  13.786   7.519
  490    HB3  GLN  65          3HB       GLN  65  -3.574  15.297   6.809
  491    HG2  GLN  65          2HG       GLN  65  -5.555  14.323   7.423
  492    HG3  GLN  65          3HG       GLN  65  -5.420  13.822   5.738
  493   HE21  GLN  65          1HE2      GLN  65  -3.203  11.958   6.609
  494   HE22  GLN  65          2HE2      GLN  65  -4.035  10.588   7.255
  495    H    GLU  66           HN       GLU  66  -0.731  15.234   5.869
  496    HA   GLU  66           HA       GLU  66   1.084  12.959   5.786
  497    HB2  GLU  66          2HB       GLU  66   1.420  15.933   5.746
  498    HB3  GLU  66          3HB       GLU  66   2.777  14.918   6.213
  499    HG2  GLU  66          2HG       GLU  66   3.232  14.461   4.100
  500    HG3  GLU  66          3HG       GLU  66   1.588  13.889   3.825
  501    H    ASN  67           HN       ASN  67  -0.543  14.911   8.075
  502    HA   ASN  67           HA       ASN  67   1.314  14.269  10.229
  503    HB2  ASN  67          2HB       ASN  67  -1.101  15.526  11.153
  504    HB3  ASN  67          3HB       ASN  67   0.545  16.154  11.158
  505   HD21  ASN  67          1HD2      ASN  67  -2.539  16.349   9.774
  506   HD22  ASN  67          2HD2      ASN  67  -2.183  17.518   8.554
  507    H    GLU  68           HN       GLU  68  -2.135  13.793   9.475
  508    HA   GLU  68           HA       GLU  68  -2.765  12.168  11.650
  509    HB2  GLU  68          2HB       GLU  68  -3.990  12.904   9.126
  510    HB3  GLU  68          3HB       GLU  68  -4.330  11.228   9.535
  511    HG2  GLU  68          2HG       GLU  68  -4.676  13.253  11.668
  512    HG3  GLU  68          3HG       GLU  68  -5.852  13.235  10.355
  513    H    ILE  69           HN       ILE  69  -2.236  11.036   8.307
  514    HA   ILE  69           HA       ILE  69  -2.137   8.350   8.722
  515    HB   ILE  69           HB       ILE  69  -0.428   9.991   6.856
  516   HG12  ILE  69          2HG1      ILE  69  -3.164   8.949   6.824
  517   HG13  ILE  69          3HG1      ILE  69  -2.438  10.231   5.862
  518   HG21  ILE  69          1HG2      ILE  69   0.683   7.874   7.237
  519   HG22  ILE  69          2HG2      ILE  69  -0.818   7.003   6.924
  520   HG23  ILE  69          3HG2      ILE  69  -0.029   7.897   5.625
  521   HD11  ILE  69          1HD1      ILE  69  -3.223   8.444   4.443
  522   HD12  ILE  69          2HD1      ILE  69  -1.462   8.540   4.380
  523   HD13  ILE  69          3HD1      ILE  69  -2.243   7.277   5.330
  524    H    GLU  70           HN       GLU  70   0.835  10.324   8.570
  525    HA   GLU  70           HA       GLU  70   2.626   8.456   9.469
  526    HB2  GLU  70          2HB       GLU  70   4.119  10.205   9.877
  527    HB3  GLU  70          3HB       GLU  70   3.023  10.875   8.676
  528    HG2  GLU  70          2HG       GLU  70   1.898  12.180  10.287
  529    HG3  GLU  70          3HG       GLU  70   2.661  11.319  11.622
  530    H    CYS  71           HN       CYS  71   0.113   9.953  11.240
  531    HA   CYS  71           HA       CYS  71   1.262   9.604  13.847
  532    HB2  CYS  71          2HB       CYS  71  -0.649  11.221  13.040
  533    HB3  CYS  71          3HB       CYS  71  -1.688   9.847  13.397
  534    HG   CYS  71           HG       CYS  71  -1.942  11.349  15.624
  535    H    MET  72           HN       MET  72  -0.863   7.764  11.741
  536    HA   MET  72           HA       MET  72  -1.430   5.780  13.764
  537    HB2  MET  72          2HB       MET  72  -2.930   4.864  12.268
  538    HB3  MET  72          3HB       MET  72  -2.914   6.543  11.743
  539    HG2  MET  72          2HG       MET  72  -0.938   5.557  10.212
  540    HG3  MET  72          3HG       MET  72  -1.942   4.120  10.387
  541    HE1  MET  72          1HE       MET  72  -1.620   4.719   7.618
  542    HE2  MET  72          2HE       MET  72  -3.015   3.727   8.047
  543    HE3  MET  72          3HE       MET  72  -3.198   5.065   6.911
  544    H    VAL  73           HN       VAL  73   1.270   6.448  12.115
  545    HA   VAL  73           HA       VAL  73   2.113   3.632  12.099
  546    HB   VAL  73           HB       VAL  73   3.638   4.288  10.141
  547   HG11  VAL  73          1HG1      VAL  73   1.565   4.074   8.533
  548   HG12  VAL  73          2HG1      VAL  73   2.063   2.728   9.561
  549   HG13  VAL  73          3HG1      VAL  73   0.711   3.753  10.042
  550   HG21  VAL  73          1HG2      VAL  73   3.525   6.542   9.821
  551   HG22  VAL  73          2HG2      VAL  73   2.254   6.042   8.706
  552   HG23  VAL  73          3HG2      VAL  73   1.834   6.640  10.311
  553    H    ALA  74           HN       ALA  74   3.435   6.926  11.708
  554    HA   ALA  74           HA       ALA  74   5.826   6.155  13.171
  555    HB1  ALA  74          1HB       ALA  74   6.077   8.836  12.674
  556    HB2  ALA  74          2HB       ALA  74   6.653   7.541  11.624
  557    HB3  ALA  74          3HB       ALA  74   5.084   8.289  11.322
  558    H    ALA  75           HN       ALA  75   3.063   6.493  14.400
  559    HA   ALA  75           HA       ALA  75   2.592   8.619  15.943
  560    HB1  ALA  75          1HB       ALA  75   2.580   6.316  17.682
  561    HB2  ALA  75          2HB       ALA  75   1.228   7.240  17.026
  562    HB3  ALA  75          3HB       ALA  75   1.928   5.920  16.091
  Start of MODEL   14
    1    H1   ALA   1           HN       ALA   1 -19.833 -21.029   7.218
    2    HA   ALA   1           HA       ALA   1 -17.386 -21.643   8.621
    3    HB1  ALA   1          1HB       ALA   1 -17.852 -22.981   5.964
    4    HB2  ALA   1          2HB       ALA   1 -16.464 -23.164   7.037
    5    HB3  ALA   1          3HB       ALA   1 -18.039 -23.795   7.519
    6    H    LEU   2           HN       LEU   2 -18.866 -20.687   5.543
    7    HA   LEU   2           HA       LEU   2 -16.583 -18.960   4.961
    8    HB2  LEU   2          2HB       LEU   2 -18.264 -20.498   3.375
    9    HB3  LEU   2          3HB       LEU   2 -18.773 -18.840   3.069
   10    HG   LEU   2           HG       LEU   2 -16.039 -18.678   2.854
   11   HD11  LEU   2          1HD1      LEU   2 -16.659 -21.055   1.197
   12   HD12  LEU   2          2HD1      LEU   2 -16.323 -21.320   2.907
   13   HD13  LEU   2          3HD1      LEU   2 -15.127 -20.519   1.888
   14   HD21  LEU   2          1HD2      LEU   2 -16.438 -18.298   0.550
   15   HD22  LEU   2          2HD2      LEU   2 -17.877 -17.738   1.405
   16   HD23  LEU   2          3HD2      LEU   2 -17.897 -19.291   0.567
   17    H    ASP   3           HN       ASP   3 -16.629 -16.800   5.139
   18    HA   ASP   3           HA       ASP   3 -19.215 -15.466   5.521
   19    HB2  ASP   3          2HB       ASP   3 -16.905 -14.552   7.173
   20    HB3  ASP   3          3HB       ASP   3 -18.632 -14.452   7.506
   21    HA   PRO   4           HA       PRO   4 -16.444 -13.329   2.438
   22    HB2  PRO   4          2HB       PRO   4 -18.323 -13.173   0.484
   23    HB3  PRO   4          3HB       PRO   4 -17.260 -14.571   0.685
   24    HG2  PRO   4          2HG       PRO   4 -20.095 -14.205   1.571
   25    HG3  PRO   4          3HG       PRO   4 -19.333 -15.616   0.816
   26    HD2  PRO   4          2HD       PRO   4 -19.788 -15.459   3.481
   27    HD3  PRO   4          3HD       PRO   4 -18.401 -16.333   2.799
   28    H    LEU   5           HN       LEU   5 -16.311 -11.297   3.199
   29    HA   LEU   5           HA       LEU   5 -18.767  -9.670   3.248
   30    HB2  LEU   5          2HB       LEU   5 -16.492  -9.910   5.086
   31    HB3  LEU   5          3HB       LEU   5 -16.972  -8.254   4.725
   32    HG   LEU   5           HG       LEU   5 -18.057  -8.951   6.744
   33   HD11  LEU   5          1HD1      LEU   5 -19.945  -7.926   6.180
   34   HD12  LEU   5          2HD1      LEU   5 -20.437  -9.255   5.131
   35   HD13  LEU   5          3HD1      LEU   5 -19.385  -7.985   4.508
   36   HD21  LEU   5          1HD2      LEU   5 -19.037 -11.303   5.133
   37   HD22  LEU   5          2HD2      LEU   5 -19.639 -10.868   6.732
   38   HD23  LEU   5          3HD2      LEU   5 -17.952 -11.338   6.522
   39    H    VAL   6           HN       VAL   6 -15.356  -9.745   2.366
   40    HA   VAL   6           HA       VAL   6 -14.111  -8.491   0.928
   41    HB   VAL   6           HB       VAL   6 -15.013  -8.400  -1.107
   42   HG11  VAL   6          1HG1      VAL   6 -17.005  -9.580  -1.464
   43   HG12  VAL   6          2HG1      VAL   6 -16.391 -10.204   0.068
   44   HG13  VAL   6          3HG1      VAL   6 -17.707  -9.030   0.057
   45   HG21  VAL   6          1HG2      VAL   6 -17.077  -6.565   0.093
   46   HG22  VAL   6          2HG2      VAL   6 -15.678  -6.126  -0.887
   47   HG23  VAL   6          3HG2      VAL   6 -17.032  -6.987  -1.619
   48    H    SER   7           HN       SER   7 -13.701  -6.242   0.118
   49    HA   SER   7           HA       SER   7 -15.028  -3.963   0.867
   50    HB2  SER   7          2HB       SER   7 -13.605  -3.319   2.924
   51    HB3  SER   7          3HB       SER   7 -14.949  -4.433   3.170
   52    HG   SER   7           HG       SER   7 -12.851  -5.896   2.551
   53    H    CYS   8           HN       CYS   8 -11.717  -4.419   1.960
   54    HA   CYS   8           HA       CYS   8 -10.628  -2.315   0.547
   55    HB2  CYS   8          2HB       CYS   8  -9.508  -3.531   2.405
   56    HB3  CYS   8          3HB       CYS   8  -9.198  -4.871   1.304
   57    H    LYS   9           HN       LYS   9  -9.176  -2.276  -1.286
   58    HA   LYS   9           HA       LYS   9  -9.863  -4.309  -3.308
   59    HB2  LYS   9          2HB       LYS   9 -10.602  -2.648  -4.600
   60    HB3  LYS   9          3HB       LYS   9 -10.175  -1.472  -3.363
   61    HG2  LYS   9          2HG       LYS   9  -7.886  -1.390  -4.275
   62    HG3  LYS   9          3HG       LYS   9  -8.383  -2.498  -5.555
   63    HD2  LYS   9          2HD       LYS   9  -9.151   0.356  -5.108
   64    HD3  LYS   9          3HD       LYS   9  -8.609  -0.442  -6.587
   65    HE2  LYS   9          2HE       LYS   9 -10.773  -1.721  -6.563
   66    HE3  LYS   9          3HE       LYS   9 -11.298  -0.672  -5.247
   67    HZ1  LYS   9          1HZ       LYS   9 -11.978  -0.026  -7.587
   68    HZ2  LYS   9          2HZ       LYS   9 -10.365   0.422  -7.831
   69    HZ3  LYS   9          3HZ       LYS   9 -11.283   1.189  -6.636
   70    H    LEU  10           HN       LEU  10  -7.354  -2.298  -1.913
   71    HA   LEU  10           HA       LEU  10  -5.263  -2.772  -3.672
   72    HB2  LEU  10          2HB       LEU  10  -5.201  -2.474  -0.674
   73    HB3  LEU  10          3HB       LEU  10  -3.777  -2.415  -1.711
   74    HG   LEU  10           HG       LEU  10  -6.079  -0.481  -1.929
   75   HD11  LEU  10          1HD1      LEU  10  -3.482  -0.210  -0.424
   76   HD12  LEU  10          2HD1      LEU  10  -5.107  -0.230   0.262
   77   HD13  LEU  10          3HD1      LEU  10  -4.598   1.112  -0.763
   78   HD21  LEU  10          1HD2      LEU  10  -3.777   0.702  -2.856
   79   HD22  LEU  10          2HD2      LEU  10  -5.043  -0.014  -3.852
   80   HD23  LEU  10          3HD2      LEU  10  -3.622  -0.964  -3.416
   81    H    CYS  11           HN       CYS  11  -6.765  -4.902  -1.398
   82    HA   CYS  11           HA       CYS  11  -4.905  -7.025  -2.208
   83    HB2  CYS  11          2HB       CYS  11  -4.741  -7.890   0.015
   84    HB3  CYS  11          3HB       CYS  11  -4.363  -6.173   0.101
   85    H    LEU  12           HN       LEU  12  -7.969  -5.941  -2.240
   86    HA   LEU  12           HA       LEU  12 -10.070  -6.907  -2.186
   87    HB2  LEU  12          2HB       LEU  12  -8.317  -8.290  -4.125
   88    HB3  LEU  12          3HB       LEU  12  -9.876  -9.042  -3.796
   89    HG   LEU  12           HG       LEU  12 -10.063  -6.183  -4.371
   90   HD11  LEU  12          1HD1      LEU  12  -8.472  -7.905  -6.115
   91   HD12  LEU  12          2HD1      LEU  12  -8.599  -6.147  -6.060
   92   HD13  LEU  12          3HD1      LEU  12  -9.807  -7.090  -6.931
   93   HD21  LEU  12          1HD2      LEU  12 -11.360  -8.653  -5.519
   94   HD22  LEU  12          2HD2      LEU  12 -11.842  -6.991  -5.862
   95   HD23  LEU  12          3HD2      LEU  12 -12.000  -7.636  -4.228
   96    H    GLY  13           HN       GLY  13  -9.345  -7.541   0.184
   97    HA2  GLY  13          1HA       GLY  13  -9.452 -10.477   0.444
   98    HA3  GLY  13          2HA       GLY  13  -8.839  -9.378   1.672
   99    H    GLU  14           HN       GLU  14 -10.258 -10.489   3.153
  100    HA   GLU  14           HA       GLU  14 -13.020  -9.485   2.974
  101    HB2  GLU  14          2HB       GLU  14 -13.108 -11.851   2.529
  102    HB3  GLU  14          3HB       GLU  14 -12.090 -12.198   3.920
  103    HG2  GLU  14          2HG       GLU  14 -14.519 -10.722   4.581
  104    HG3  GLU  14          3HG       GLU  14 -14.814 -12.311   3.877
  105    H    TYR  15           HN       TYR  15 -13.199  -7.954   4.472
  106    HA   TYR  15           HA       TYR  15 -12.608  -8.588   7.233
  107    HB2  TYR  15          2HB       TYR  15 -11.447  -6.012   6.253
  108    HB3  TYR  15          3HB       TYR  15 -11.004  -6.974   7.658
  109    HD1  TYR  15          1HD       TYR  15 -10.522  -6.489   4.070
  110    HD2  TYR  15          2HD       TYR  15  -9.516  -8.899   7.430
  111    HE1  TYR  15          1HE       TYR  15  -8.661  -7.475   2.799
  112    HE2  TYR  15          2HE       TYR  15  -7.652  -9.891   6.167
  113    HH   TYR  15           HH       TYR  15  -6.222  -8.746   3.793
  114    HA   PRO  16           HA       PRO  16 -16.163  -6.110   7.939
  115    HB2  PRO  16          2HB       PRO  16 -15.691  -5.252  10.471
  116    HB3  PRO  16          3HB       PRO  16 -16.143  -6.917  10.090
  117    HG2  PRO  16          2HG       PRO  16 -13.433  -5.768  10.635
  118    HG3  PRO  16          3HG       PRO  16 -14.140  -7.288  11.212
  119    HD2  PRO  16          2HD       PRO  16 -12.397  -7.187   9.143
  120    HD3  PRO  16          3HD       PRO  16 -13.697  -8.391   9.238
  121    H    VAL  17           HN       VAL  17 -16.519  -3.857   9.370
  122    HA   VAL  17           HA       VAL  17 -14.971  -1.883   7.848
  123    HB   VAL  17           HB       VAL  17 -16.761  -0.431   7.955
  124   HG11  VAL  17          1HG1      VAL  17 -17.265  -2.864   6.990
  125   HG12  VAL  17          2HG1      VAL  17 -18.508  -2.804   8.242
  126   HG13  VAL  17          3HG1      VAL  17 -18.464  -1.572   6.980
  127   HG21  VAL  17          1HG2      VAL  17 -17.016  -0.305  10.335
  128   HG22  VAL  17          2HG2      VAL  17 -18.599  -0.627   9.626
  129   HG23  VAL  17          3HG2      VAL  17 -17.697  -1.931  10.396
  130    H    GLU  18           HN       GLU  18 -14.769  -3.307  10.750
  131    HA   GLU  18           HA       GLU  18 -14.134  -0.867  12.245
  132    HB2  GLU  18          2HB       GLU  18 -14.266  -3.717  13.243
  133    HB3  GLU  18          3HB       GLU  18 -14.109  -2.269  14.228
  134    HG2  GLU  18          2HG       GLU  18 -16.310  -1.575  13.729
  135    HG3  GLU  18          3HG       GLU  18 -16.471  -2.770  12.442
  136    H    GLN  19           HN       GLN  19 -12.652  -3.318  10.452
  137    HA   GLN  19           HA       GLN  19 -10.067  -2.877  11.783
  138    HB2  GLN  19          2HB       GLN  19 -11.255  -5.177  10.332
  139    HB3  GLN  19          3HB       GLN  19  -9.530  -4.912  10.118
  140    HG2  GLN  19          2HG       GLN  19  -9.072  -5.257  12.375
  141    HG3  GLN  19          3HG       GLN  19 -10.754  -5.014  12.846
  142   HE21  GLN  19          1HE2      GLN  19 -10.400  -7.035  14.010
  143   HE22  GLN  19          2HE2      GLN  19 -10.614  -8.529  13.171
  144    H    MET  20           HN       MET  20 -11.581  -1.256   9.663
  145    HA   MET  20           HA       MET  20  -9.392  -1.159   7.692
  146    HB2  MET  20          2HB       MET  20 -12.081  -0.015   7.079
  147    HB3  MET  20          3HB       MET  20 -10.877  -0.688   5.987
  148    HG2  MET  20          2HG       MET  20 -11.459  -2.918   7.249
  149    HG3  MET  20          3HG       MET  20 -12.959  -2.062   7.601
  150    HE1  MET  20          1HE       MET  20 -10.511  -2.215   4.526
  151    HE2  MET  20          2HE       MET  20 -10.822  -3.906   4.924
  152    HE3  MET  20          3HE       MET  20 -11.434  -3.228   3.414
  153    H    THR  21           HN       THR  21  -9.436   1.127   6.568
  154    HA   THR  21           HA       THR  21  -9.756   3.203   8.627
  155    HB   THR  21           HB       THR  21  -7.334   2.763   6.876
  156    HG1  THR  21          1HG       THR  21  -6.419   3.002   9.145
  157   HG21  THR  21          1HG2      THR  21  -8.392   5.214   8.119
  158   HG22  THR  21          2HG2      THR  21  -7.262   5.018   6.780
  159   HG23  THR  21          3HG2      THR  21  -6.691   4.882   8.442
  160    H    THR  22           HN       THR  22 -10.396   5.202   7.910
  161    HA   THR  22           HA       THR  22 -11.536   5.285   5.249
  162    HB   THR  22           HB       THR  22 -11.596   7.366   7.445
  163    HG1  THR  22          1HG       THR  22 -13.752   5.716   6.648
  164   HG21  THR  22          1HG2      THR  22 -11.963   8.307   5.200
  165   HG22  THR  22          2HG2      THR  22 -13.428   8.363   6.181
  166   HG23  THR  22          3HG2      THR  22 -13.252   7.135   4.929
  167    H    ILE  23           HN       ILE  23 -11.157   6.994   3.741
  168    HA   ILE  23           HA       ILE  23  -8.393   7.618   3.429
  169    HB   ILE  23           HB       ILE  23 -10.835   8.500   1.895
  170   HG12  ILE  23          2HG1      ILE  23 -10.314   6.158   1.608
  171   HG13  ILE  23          3HG1      ILE  23  -9.844   7.017   0.145
  172   HG21  ILE  23          1HG2      ILE  23  -9.641  10.102   0.930
  173   HG22  ILE  23          2HG2      ILE  23  -8.246   9.688   1.926
  174   HG23  ILE  23          3HG2      ILE  23  -8.488   8.892   0.371
  175   HD11  ILE  23          1HD1      ILE  23  -8.023   5.688   0.441
  176   HD12  ILE  23          2HD1      ILE  23  -7.512   7.106   1.359
  177   HD13  ILE  23          3HD1      ILE  23  -8.161   5.698   2.199
  178    H    ALA  24           HN       ALA  24 -10.871  10.070   2.962
  179    HA   ALA  24           HA       ALA  24 -10.686  11.675   5.124
  180    HB1  ALA  24          1HB       ALA  24  -8.782  13.267   3.957
  181    HB2  ALA  24          2HB       ALA  24  -8.524  12.199   5.336
  182    HB3  ALA  24          3HB       ALA  24  -8.138  11.645   3.707
  183    H    GLN  25           HN       GLN  25 -10.289  11.752   1.612
  184    HA   GLN  25           HA       GLN  25 -12.032  14.112   1.489
  185    HB2  GLN  25          2HB       GLN  25  -9.764  13.190  -0.070
  186    HB3  GLN  25          3HB       GLN  25 -11.147  13.548  -1.094
  187    HG2  GLN  25          2HG       GLN  25  -9.579  15.449  -0.755
  188    HG3  GLN  25          3HG       GLN  25 -11.251  15.787  -0.312
  189   HE21  GLN  25          1HE2      GLN  25 -11.417  16.941   1.458
  190   HE22  GLN  25          2HE2      GLN  25 -10.369  16.872   2.829
  191    H    CYS  26           HN       CYS  26 -11.579  10.916  -0.001
  192    HA   CYS  26           HA       CYS  26 -14.247  11.033  -1.158
  193    HB2  CYS  26          2HB       CYS  26 -13.583   8.725  -2.028
  194    HB3  CYS  26          3HB       CYS  26 -12.657  10.095  -2.632
  195    H    GLN  27           HN       GLN  27 -12.472   9.280   1.331
  196    HA   GLN  27           HA       GLN  27 -13.288   8.292   3.243
  197    HB2  GLN  27          2HB       GLN  27 -16.085   8.353   2.162
  198    HB3  GLN  27          3HB       GLN  27 -15.545   8.389   3.835
  199    HG2  GLN  27          2HG       GLN  27 -14.532  10.677   2.449
  200    HG3  GLN  27          3HG       GLN  27 -16.274  10.551   2.206
  201   HE21  GLN  27          1HE2      GLN  27 -14.013  11.898   4.099
  202   HE22  GLN  27          2HE2      GLN  27 -14.900  12.062   5.573
  203    H    CYS  28           HN       CYS  28 -12.203   6.832   1.243
  204    HA   CYS  28           HA       CYS  28 -13.954   4.634   0.549
  205    HB2  CYS  28          2HB       CYS  28 -11.062   5.261  -0.013
  206    HB3  CYS  28          3HB       CYS  28 -11.764   3.697  -0.419
  207    H    ILE  29           HN       ILE  29 -13.050   2.356   0.891
  208    HA   ILE  29           HA       ILE  29 -12.141   2.131   3.685
  209    HB   ILE  29           HB       ILE  29 -14.467   1.148   2.640
  210   HG12  ILE  29          2HG1      ILE  29 -14.420  -0.379   4.681
  211   HG13  ILE  29          3HG1      ILE  29 -12.780   0.197   4.955
  212   HG21  ILE  29          1HG2      ILE  29 -12.486  -1.126   2.666
  213   HG22  ILE  29          2HG2      ILE  29 -14.230  -1.274   2.461
  214   HG23  ILE  29          3HG2      ILE  29 -13.265  -0.451   1.236
  215   HD11  ILE  29          1HD1      ILE  29 -15.134   2.045   4.734
  216   HD12  ILE  29          2HD1      ILE  29 -14.597   1.343   6.260
  217   HD13  ILE  29          3HD1      ILE  29 -13.520   2.399   5.348
  218    H    PHE  30           HN       PHE  30 -10.233   1.211   4.031
  219    HA   PHE  30           HA       PHE  30  -9.246  -0.888   2.298
  220    HB2  PHE  30          2HB       PHE  30  -7.712   1.700   2.627
  221    HB3  PHE  30          3HB       PHE  30  -7.103   0.246   1.842
  222    HD1  PHE  30          1HD       PHE  30  -8.818  -0.675  -0.036
  223    HD2  PHE  30          2HD       PHE  30  -8.429   3.367   1.241
  224    HE1  PHE  30          1HE       PHE  30  -9.756   0.089  -2.178
  225    HE2  PHE  30          2HE       PHE  30  -9.368   4.137  -0.900
  226    HZ   PHE  30           HZ       PHE  30 -10.033   2.496  -2.612
  227    H    CYS  31           HN       CYS  31  -8.148  -2.356   3.440
  228    HA   CYS  31           HA       CYS  31  -7.966  -2.259   6.215
  229    HB2  CYS  31          2HB       CYS  31  -6.779  -4.310   6.090
  230    HB3  CYS  31          3HB       CYS  31  -7.878  -4.309   4.715
  231    H    THR  32           HN       THR  32  -6.650  -1.214   7.541
  232    HA   THR  32           HA       THR  32  -4.806   0.646   6.993
  233    HB   THR  32           HB       THR  32  -4.105  -1.242   9.209
  234    HG1  THR  32          1HG       THR  32  -6.336   0.535   9.232
  235   HG21  THR  32          1HG2      THR  32  -2.894   0.519   9.839
  236   HG22  THR  32          2HG2      THR  32  -4.378   1.453  10.026
  237   HG23  THR  32          3HG2      THR  32  -3.519   1.459   8.485
  238    H    LEU  33           HN       LEU  33  -4.041  -2.812   7.331
  239    HA   LEU  33           HA       LEU  33  -1.340  -2.828   7.042
  240    HB2  LEU  33          2HB       LEU  33  -3.488  -4.661   6.112
  241    HB3  LEU  33          3HB       LEU  33  -1.847  -4.945   5.536
  242    HG   LEU  33           HG       LEU  33  -2.207  -4.626   8.460
  243   HD11  LEU  33          1HD1      LEU  33  -3.135  -7.054   6.938
  244   HD12  LEU  33          2HD1      LEU  33  -4.109  -6.012   7.975
  245   HD13  LEU  33          3HD1      LEU  33  -2.835  -7.012   8.675
  246   HD21  LEU  33          1HD2      LEU  33  -0.646  -6.643   6.860
  247   HD22  LEU  33          2HD2      LEU  33  -0.432  -6.204   8.554
  248   HD23  LEU  33          3HD2      LEU  33  -0.027  -5.048   7.285
  249    H    CYS  34           HN       CYS  34  -3.714  -2.574   4.417
  250    HA   CYS  34           HA       CYS  34  -1.727  -2.420   2.363
  251    HB2  CYS  34          2HB       CYS  34  -4.699  -1.989   2.459
  252    HB3  CYS  34          3HB       CYS  34  -3.779  -1.565   1.018
  253    H    LEU  35           HN       LEU  35  -4.106  -0.005   3.482
  254    HA   LEU  35           HA       LEU  35  -2.958   2.186   2.200
  255    HB2  LEU  35          2HB       LEU  35  -5.194   1.797   3.645
  256    HB3  LEU  35          3HB       LEU  35  -4.223   2.679   4.822
  257    HG   LEU  35           HG       LEU  35  -4.060   4.572   3.350
  258   HD11  LEU  35          1HD1      LEU  35  -5.716   4.214   1.229
  259   HD12  LEU  35          2HD1      LEU  35  -4.959   2.626   1.350
  260   HD13  LEU  35          3HD1      LEU  35  -3.959   4.067   1.169
  261   HD21  LEU  35          1HD2      LEU  35  -6.047   4.463   4.731
  262   HD22  LEU  35          2HD2      LEU  35  -6.883   3.519   3.497
  263   HD23  LEU  35          3HD2      LEU  35  -6.434   5.194   3.174
  264    H    LYS  36           HN       LYS  36  -1.760   0.390   4.781
  265    HA   LYS  36           HA       LYS  36  -0.222   2.585   5.926
  266    HB2  LYS  36          2HB       LYS  36  -1.141   1.025   7.510
  267    HB3  LYS  36          3HB       LYS  36  -0.443  -0.339   6.647
  268    HG2  LYS  36          2HG       LYS  36   1.733   1.269   7.238
  269    HG3  LYS  36          3HG       LYS  36   0.719   1.357   8.680
  270    HD2  LYS  36          2HD       LYS  36   0.589  -1.168   8.583
  271    HD3  LYS  36          3HD       LYS  36   1.859  -1.098   7.358
  272    HE2  LYS  36          2HE       LYS  36   2.696   0.530   9.504
  273    HE3  LYS  36          3HE       LYS  36   2.084  -0.965  10.209
  274    HZ1  LYS  36          1HZ       LYS  36   4.100  -0.826   8.033
  275    HZ2  LYS  36          2HZ       LYS  36   3.566  -2.226   8.820
  276    HZ3  LYS  36          3HZ       LYS  36   4.462  -1.067   9.667
  277    H    GLN  37           HN       GLN  37   0.555  -0.679   4.704
  278    HA   GLN  37           HA       GLN  37   3.296  -0.288   4.441
  279    HB2  GLN  37          2HB       GLN  37   1.374  -2.282   3.686
  280    HB3  GLN  37          3HB       GLN  37   2.498  -2.024   2.358
  281    HG2  GLN  37          2HG       GLN  37   4.235  -2.919   3.471
  282    HG3  GLN  37          3HG       GLN  37   3.709  -2.280   5.027
  283   HE21  GLN  37          1HE2      GLN  37   4.087  -4.241   6.055
  284   HE22  GLN  37          2HE2      GLN  37   3.051  -5.607   5.842
  285    H    TYR  38           HN       TYR  38   0.795   1.138   2.694
  286    HA   TYR  38           HA       TYR  38   2.434   1.593   0.316
  287    HB2  TYR  38          2HB       TYR  38   0.389   1.284  -0.588
  288    HB3  TYR  38          3HB       TYR  38  -0.440   1.647   0.922
  289    HD1  TYR  38          1HD       TYR  38   1.642   3.533  -1.556
  290    HD2  TYR  38          2HD       TYR  38  -1.894   3.423   0.808
  291    HE1  TYR  38          1HE       TYR  38   0.982   5.724  -2.454
  292    HE2  TYR  38          2HE       TYR  38  -2.565   5.614  -0.085
  293    HH   TYR  38           HH       TYR  38  -1.074   7.040  -2.775
  294    H    VAL  39           HN       VAL  39   0.577   3.489   2.694
  295    HA   VAL  39           HA       VAL  39   1.715   5.977   1.853
  296    HB   VAL  39           HB       VAL  39   0.463   7.005   3.561
  297   HG11  VAL  39          1HG1      VAL  39  -1.752   5.575   3.500
  298   HG12  VAL  39          2HG1      VAL  39  -1.146   6.387   2.056
  299   HG13  VAL  39          3HG1      VAL  39  -0.857   4.663   2.286
  300   HG21  VAL  39          1HG2      VAL  39  -0.555   5.728   5.431
  301   HG22  VAL  39          2HG2      VAL  39   0.334   4.302   4.894
  302   HG23  VAL  39          3HG2      VAL  39   1.209   5.726   5.459
  303    H    GLU  40           HN       GLU  40   2.157   3.884   4.695
  304    HA   GLU  40           HA       GLU  40   3.889   5.289   6.220
  305    HB2  GLU  40          2HB       GLU  40   3.051   2.836   6.438
  306    HB3  GLU  40          3HB       GLU  40   4.540   2.427   5.597
  307    HG2  GLU  40          2HG       GLU  40   5.121   4.230   7.736
  308    HG3  GLU  40          3HG       GLU  40   4.167   2.877   8.341
  309    H    LEU  41           HN       LEU  41   4.659   3.645   3.202
  310    HA   LEU  41           HA       LEU  41   7.470   4.170   3.365
  311    HB2  LEU  41          2HB       LEU  41   5.622   2.884   1.490
  312    HB3  LEU  41          3HB       LEU  41   6.988   3.692   0.723
  313    HG   LEU  41           HG       LEU  41   8.505   2.191   1.528
  314   HD11  LEU  41          1HD1      LEU  41   8.465   2.316   3.800
  315   HD12  LEU  41          2HD1      LEU  41   7.772   0.708   3.590
  316   HD13  LEU  41          3HD1      LEU  41   6.719   2.089   3.897
  317   HD21  LEU  41          1HD2      LEU  41   7.372   0.711   0.217
  318   HD22  LEU  41          2HD2      LEU  41   5.877   0.863   1.140
  319   HD23  LEU  41          3HD2      LEU  41   7.210  -0.106   1.772
  320    H    LEU  42           HN       LEU  42   4.685   5.782   2.008
  321    HA   LEU  42           HA       LEU  42   6.311   7.710   0.570
  322    HB2  LEU  42          2HB       LEU  42   3.396   7.151   0.831
  323    HB3  LEU  42          3HB       LEU  42   3.908   8.754   0.307
  324    HG   LEU  42           HG       LEU  42   4.868   6.283  -1.099
  325   HD11  LEU  42          1HD1      LEU  42   2.296   7.775  -1.590
  326   HD12  LEU  42          2HD1      LEU  42   2.467   6.090  -1.100
  327   HD13  LEU  42          3HD1      LEU  42   3.012   6.603  -2.696
  328   HD21  LEU  42          1HD2      LEU  42   5.929   7.778  -2.344
  329   HD22  LEU  42          2HD2      LEU  42   5.260   9.089  -1.372
  330   HD23  LEU  42          3HD2      LEU  42   4.384   8.504  -2.787
  331    H    ILE  43           HN       ILE  43   3.705   8.026   2.990
  332    HA   ILE  43           HA       ILE  43   3.924  10.595   3.734
  333    HB   ILE  43           HB       ILE  43   3.066   8.189   5.069
  334   HG12  ILE  43          2HG1      ILE  43   1.444   9.814   6.088
  335   HG13  ILE  43          3HG1      ILE  43   2.336  11.114   5.306
  336   HG21  ILE  43          1HG2      ILE  43   3.302   8.954   7.385
  337   HG22  ILE  43          2HG2      ILE  43   4.867   8.648   6.635
  338   HG23  ILE  43          3HG2      ILE  43   4.293  10.303   6.834
  339   HD11  ILE  43          1HD1      ILE  43   1.649  10.478   3.189
  340   HD12  ILE  43          2HD1      ILE  43   1.228   8.846   3.708
  341   HD13  ILE  43          3HD1      ILE  43   0.216  10.210   4.180
  342    H    LYS  44           HN       LYS  44   6.212   8.056   4.531
  343    HA   LYS  44           HA       LYS  44   7.737   9.599   6.382
  344    HB2  LYS  44          2HB       LYS  44   7.801   6.932   5.273
  345    HB3  LYS  44          3HB       LYS  44   9.414   7.634   5.279
  346    HG2  LYS  44          2HG       LYS  44   8.906   6.345   7.316
  347    HG3  LYS  44          3HG       LYS  44   9.286   8.037   7.646
  348    HD2  LYS  44          2HD       LYS  44   7.430   7.795   8.958
  349    HD3  LYS  44          3HD       LYS  44   6.662   8.295   7.449
  350    HE2  LYS  44          2HE       LYS  44   5.554   6.373   7.314
  351    HE3  LYS  44          3HE       LYS  44   7.046   5.449   7.472
  352    HZ1  LYS  44          1HZ       LYS  44   6.447   6.445   9.990
  353    HZ2  LYS  44          2HZ       LYS  44   6.364   4.837   9.472
  354    HZ3  LYS  44          3HZ       LYS  44   4.997   5.828   9.372
  355    H    GLU  45           HN       GLU  45   8.036   8.871   2.930
  356    HA   GLU  45           HA       GLU  45  10.506  10.255   2.600
  357    HB2  GLU  45          2HB       GLU  45   8.961   8.543   1.052
  358    HB3  GLU  45          3HB       GLU  45   8.873  10.075   0.195
  359    HG2  GLU  45          2HG       GLU  45  10.887   9.750  -0.646
  360    HG3  GLU  45          3HG       GLU  45  11.571   9.635   0.974
  361    H    GLY  46           HN       GLY  46   7.109  11.095   2.041
  362    HA2  GLY  46          1HA       GLY  46   6.108  13.107   1.533
  363    HA3  GLY  46          2HA       GLY  46   7.253  13.748   2.702
  364    H    LEU  47           HN       LEU  47   7.199  12.664  -0.695
  365    HA   LEU  47           HA       LEU  47   9.152  14.750  -1.335
  366    HB2  LEU  47          2HB       LEU  47   9.412  13.595  -3.468
  367    HB3  LEU  47          3HB       LEU  47   9.677  12.512  -2.102
  368    HG   LEU  47           HG       LEU  47   7.027  12.603  -3.501
  369   HD11  LEU  47          1HD1      LEU  47   9.270  10.752  -4.265
  370   HD12  LEU  47          2HD1      LEU  47   8.910  12.238  -5.144
  371   HD13  LEU  47          3HD1      LEU  47   7.703  10.956  -5.050
  372   HD21  LEU  47          1HD2      LEU  47   7.830  10.030  -2.645
  373   HD22  LEU  47          2HD2      LEU  47   6.538  11.044  -2.003
  374   HD23  LEU  47          3HD2      LEU  47   8.164  11.156  -1.329
  375    H    GLU  48           HN       GLU  48   5.931  13.604  -2.239
  376    HA   GLU  48           HA       GLU  48   4.708  15.988  -2.626
  377    HB2  GLU  48          2HB       GLU  48   4.823  16.129  -5.218
  378    HB3  GLU  48          3HB       GLU  48   6.125  16.823  -4.262
  379    HG2  GLU  48          2HG       GLU  48   6.736  14.093  -4.800
  380    HG3  GLU  48          3HG       GLU  48   6.289  14.891  -6.307
  381    H    THR  49           HN       THR  49   5.135  12.714  -3.585
  382    HA   THR  49           HA       THR  49   3.141  11.984  -5.196
  383    HB   THR  49           HB       THR  49   3.631  10.641  -2.531
  384    HG1  THR  49          1HG       THR  49   5.274  10.999  -4.566
  385   HG21  THR  49          1HG2      THR  49   2.974   8.957  -4.810
  386   HG22  THR  49          2HG2      THR  49   1.681  10.090  -4.415
  387   HG23  THR  49          3HG2      THR  49   2.286   8.977  -3.187
  388    H    ALA  50           HN       ALA  50   2.709  13.265  -1.970
  389    HA   ALA  50           HA       ALA  50   0.875  14.014  -0.849
  390    HB1  ALA  50          1HB       ALA  50   0.527  14.918  -3.328
  391    HB2  ALA  50          2HB       ALA  50  -0.882  13.863  -3.228
  392    HB3  ALA  50          3HB       ALA  50  -0.668  15.162  -2.055
  393    H    ILE  51           HN       ILE  51   1.215  11.022  -1.911
  394    HA   ILE  51           HA       ILE  51   0.037   9.048  -1.800
  395    HB   ILE  51           HB       ILE  51  -0.735  10.340   0.820
  396   HG12  ILE  51          2HG1      ILE  51   1.192   9.121   1.727
  397   HG13  ILE  51          3HG1      ILE  51   1.554   8.483   0.125
  398   HG21  ILE  51          1HG2      ILE  51  -0.513   7.394   0.441
  399   HG22  ILE  51          2HG2      ILE  51  -1.472   8.312   1.600
  400   HG23  ILE  51          3HG2      ILE  51  -1.982   8.216  -0.086
  401   HD11  ILE  51          1HD1      ILE  51   2.493  10.410  -0.574
  402   HD12  ILE  51          2HD1      ILE  51   1.403  11.419   0.377
  403   HD13  ILE  51          3HD1      ILE  51   2.767  10.617   1.156
  404    H    SER  52           HN       SER  52  -1.421   9.704  -3.558
  405    HA   SER  52           HA       SER  52  -4.039  10.693  -2.864
  406    HB2  SER  52          2HB       SER  52  -4.446  10.022  -5.365
  407    HB3  SER  52          3HB       SER  52  -3.417  11.404  -4.989
  408    HG   SER  52           HG       SER  52  -1.647  10.242  -5.483
  409    H    CYS  53           HN       CYS  53  -6.012   9.552  -3.168
  410    HA   CYS  53           HA       CYS  53  -6.404   7.238  -1.909
  411    HB2  CYS  53          2HB       CYS  53  -8.236   8.559  -2.856
  412    HB3  CYS  53          3HB       CYS  53  -7.808   8.013  -4.474
  413    HA   PRO  54           HA       PRO  54  -4.221   4.060  -4.062
  414    HB2  PRO  54          2HB       PRO  54  -5.383   1.930  -2.844
  415    HB3  PRO  54          3HB       PRO  54  -4.179   2.950  -2.049
  416    HG2  PRO  54          2HG       PRO  54  -7.163   3.003  -1.810
  417    HG3  PRO  54          3HG       PRO  54  -5.935   3.143  -0.538
  418    HD2  PRO  54          2HD       PRO  54  -7.224   5.294  -1.561
  419    HD3  PRO  54          3HD       PRO  54  -5.547   5.371  -0.981
  420    H    ASP  55           HN       ASP  55  -7.357   4.914  -4.574
  421    HA   ASP  55           HA       ASP  55  -7.906   2.649  -6.368
  422    HB2  ASP  55          2HB       ASP  55  -9.702   3.008  -4.815
  423    HB3  ASP  55          3HB       ASP  55  -9.737   4.733  -5.171
  424    H    ALA  56           HN       ALA  56  -7.338   2.969  -8.408
  425    HA   ALA  56           HA       ALA  56  -6.910   5.604  -9.475
  426    HB1  ALA  56          1HB       ALA  56  -5.382   4.005 -10.238
  427    HB2  ALA  56          2HB       ALA  56  -6.652   2.837 -10.606
  428    HB3  ALA  56          3HB       ALA  56  -6.459   4.275 -11.610
  429    H    ALA  57           HN       ALA  57  -9.681   4.233  -8.798
  430    HA   ALA  57           HA       ALA  57 -11.044   5.462 -11.079
  431    HB1  ALA  57          1HB       ALA  57 -12.513   3.607 -11.420
  432    HB2  ALA  57          2HB       ALA  57 -10.855   3.014 -11.507
  433    HB3  ALA  57          3HB       ALA  57 -11.814   2.736 -10.055
  434    H    CYS  58           HN       CYS  58 -10.598   6.188  -8.258
  435    HA   CYS  58           HA       CYS  58 -13.017   5.779  -6.811
  436    HB2  CYS  58          2HB       CYS  58 -10.857   6.295  -5.718
  437    HB3  CYS  58          3HB       CYS  58 -10.900   7.906  -6.427
  438    HA   PRO  59           HA       PRO  59 -15.560   8.777  -8.824
  439    HB2  PRO  59          2HB       PRO  59 -17.502   8.933  -6.933
  440    HB3  PRO  59          3HB       PRO  59 -17.340   7.559  -8.034
  441    HG2  PRO  59          2HG       PRO  59 -16.433   7.829  -5.193
  442    HG3  PRO  59          3HG       PRO  59 -17.226   6.456  -5.989
  443    HD2  PRO  59          2HD       PRO  59 -14.556   6.537  -5.542
  444    HD3  PRO  59          3HD       PRO  59 -15.266   5.717  -6.948
  445    H    LYS  60           HN       LYS  60 -14.056   9.216  -5.760
  446    HA   LYS  60           HA       LYS  60 -14.554  12.115  -5.931
  447    HB2  LYS  60          2HB       LYS  60 -14.638  10.262  -3.604
  448    HB3  LYS  60          3HB       LYS  60 -13.979  11.870  -3.335
  449    HG2  LYS  60          2HG       LYS  60 -16.476  11.923  -4.818
  450    HG3  LYS  60          3HG       LYS  60 -16.633  11.159  -3.235
  451    HD2  LYS  60          2HD       LYS  60 -15.068  13.655  -3.294
  452    HD3  LYS  60          3HD       LYS  60 -16.787  13.827  -3.656
  453    HE2  LYS  60          2HE       LYS  60 -16.421  12.070  -1.415
  454    HE3  LYS  60          3HE       LYS  60 -15.568  13.588  -1.135
  455    HZ1  LYS  60          1HZ       LYS  60 -18.189  13.968  -2.227
  456    HZ2  LYS  60          2HZ       LYS  60 -17.475  14.675  -0.866
  457    HZ3  LYS  60          3HZ       LYS  60 -18.221  13.161  -0.740
  458    H    GLN  61           HN       GLN  61 -12.288   9.688  -6.138
  459    HA   GLN  61           HA       GLN  61 -10.002   9.575  -5.798
  460    HB2  GLN  61          2HB       GLN  61  -9.772  12.268  -7.021
  461    HB3  GLN  61          3HB       GLN  61  -8.987  10.759  -7.465
  462    HG2  GLN  61          2HG       GLN  61 -10.995   9.980  -8.544
  463    HG3  GLN  61          3HG       GLN  61 -11.873  11.411  -8.008
  464   HE21  GLN  61          1HE2      GLN  61 -10.457  13.492  -8.592
  465   HE22  GLN  61          2HE2      GLN  61 -10.032  13.574 -10.264
  466    H    GLY  62           HN       GLY  62 -10.931  10.283  -3.401
  467    HA2  GLY  62          1HA       GLY  62  -9.907  12.794  -2.469
  468    HA3  GLY  62          2HA       GLY  62 -10.521  11.482  -1.472
  469    H    HIS  63           HN       HIS  63  -7.788  13.181  -2.418
  470    HA   HIS  63           HA       HIS  63  -5.835  11.118  -2.113
  471    HB2  HIS  63          2HB       HIS  63  -4.498  12.686  -2.977
  472    HB3  HIS  63          3HB       HIS  63  -5.852  13.812  -2.950
  473    HD1  HIS  63          1HD       HIS  63  -6.089  14.518  -0.044
  474    HD2  HIS  63          2HD       HIS  63  -2.422  14.075  -1.947
  475    HE1  HIS  63          1HE       HIS  63  -4.451  15.829   1.341
  476    H    LEU  64           HN       LEU  64  -4.102  11.276  -0.414
  477    HA   LEU  64           HA       LEU  64  -5.366  11.716   2.206
  478    HB2  LEU  64          2HB       LEU  64  -3.103   9.909   1.376
  479    HB3  LEU  64          3HB       LEU  64  -3.601  10.162   3.048
  480    HG   LEU  64           HG       LEU  64  -5.662   9.231   1.123
  481   HD11  LEU  64          1HD1      LEU  64  -4.875   6.856   1.726
  482   HD12  LEU  64          2HD1      LEU  64  -3.312   7.613   2.032
  483   HD13  LEU  64          3HD1      LEU  64  -4.043   7.717   0.430
  484   HD21  LEU  64          1HD2      LEU  64  -6.764   8.911   3.019
  485   HD22  LEU  64          2HD2      LEU  64  -5.380   9.538   3.916
  486   HD23  LEU  64          3HD2      LEU  64  -5.510   7.809   3.588
  487    H    GLN  65           HN       GLN  65  -3.993  12.490   3.954
  488    HA   GLN  65           HA       GLN  65  -2.245  14.617   3.023
  489    HB2  GLN  65          2HB       GLN  65  -2.518  14.333   5.913
  490    HB3  GLN  65          3HB       GLN  65  -2.859  15.716   4.882
  491    HG2  GLN  65          2HG       GLN  65  -4.926  15.250   5.767
  492    HG3  GLN  65          3HG       GLN  65  -4.982  14.394   4.227
  493   HE21  GLN  65          1HE2      GLN  65  -3.024  12.420   5.467
  494   HE22  GLN  65          2HE2      GLN  65  -4.033  11.370   6.396
  495    H    GLU  66           HN       GLU  66  -0.249  15.052   4.418
  496    HA   GLU  66           HA       GLU  66   1.332  12.604   4.440
  497    HB2  GLU  66          2HB       GLU  66   1.883  15.480   4.139
  498    HB3  GLU  66          3HB       GLU  66   3.080  14.603   5.082
  499    HG2  GLU  66          2HG       GLU  66   3.868  13.489   3.300
  500    HG3  GLU  66          3HG       GLU  66   2.273  13.310   2.572
  501    H    ASN  67           HN       ASN  67   0.175  15.097   6.622
  502    HA   ASN  67           HA       ASN  67   1.682  14.061   8.865
  503    HB2  ASN  67          2HB       ASN  67   1.428  16.205   9.474
  504    HB3  ASN  67          3HB       ASN  67   0.170  16.463   8.268
  505   HD21  ASN  67          1HD2      ASN  67  -1.713  17.035   9.052
  506   HD22  ASN  67          2HD2      ASN  67  -2.329  16.649  10.618
  507    H    GLU  68           HN       GLU  68  -1.807  14.605   8.336
  508    HA   GLU  68           HA       GLU  68  -2.876  13.226  10.396
  509    HB2  GLU  68          2HB       GLU  68  -3.773  14.044   7.811
  510    HB3  GLU  68          3HB       GLU  68  -4.383  12.425   8.124
  511    HG2  GLU  68          2HG       GLU  68  -4.658  14.360  10.328
  512    HG3  GLU  68          3HG       GLU  68  -5.636  14.664   8.894
  513    H    ILE  69           HN       ILE  69  -1.726  11.784   7.366
  514    HA   ILE  69           HA       ILE  69  -2.418   9.122   8.023
  515    HB   ILE  69           HB       ILE  69  -0.493  10.305   6.042
  516   HG12  ILE  69          2HG1      ILE  69  -3.270   9.426   6.064
  517   HG13  ILE  69          3HG1      ILE  69  -2.424  10.438   4.899
  518   HG21  ILE  69          1HG2      ILE  69   0.495   8.213   6.813
  519   HG22  ILE  69          2HG2      ILE  69  -1.020   7.371   6.494
  520   HG23  ILE  69          3HG2      ILE  69  -0.096   8.060   5.159
  521   HD11  ILE  69          1HD1      ILE  69  -1.614   8.503   3.732
  522   HD12  ILE  69          2HD1      ILE  69  -2.297   7.434   4.958
  523   HD13  ILE  69          3HD1      ILE  69  -3.364   8.383   3.921
  524    H    GLU  70           HN       GLU  70   0.819  10.630   7.901
  525    HA   GLU  70           HA       GLU  70   2.264   8.594   9.055
  526    HB2  GLU  70          2HB       GLU  70   3.995  10.078   9.196
  527    HB3  GLU  70          3HB       GLU  70   2.938  10.994   8.131
  528    HG2  GLU  70          2HG       GLU  70   2.147  12.324   9.965
  529    HG3  GLU  70          3HG       GLU  70   3.041  11.335  11.118
  530    H    CYS  71           HN       CYS  71  -0.096  10.572  10.517
  531    HA   CYS  71           HA       CYS  71   0.857  10.366  13.212
  532    HB2  CYS  71          2HB       CYS  71  -0.547  12.143  13.186
  533    HB3  CYS  71          3HB       CYS  71  -1.483  11.510  11.837
  534    HG   CYS  71           HG       CYS  71  -1.836  10.249  14.989
  535    H    MET  72           HN       MET  72  -1.302   8.529  11.151
  536    HA   MET  72           HA       MET  72  -2.215   6.851  13.326
  537    HB2  MET  72          2HB       MET  72  -3.732   5.957  11.840
  538    HB3  MET  72          3HB       MET  72  -3.488   7.552  11.139
  539    HG2  MET  72          2HG       MET  72  -1.533   6.028   9.943
  540    HG3  MET  72          3HG       MET  72  -2.904   4.926  10.054
  541    HE1  MET  72          1HE       MET  72  -3.281   4.530   7.799
  542    HE2  MET  72          2HE       MET  72  -3.856   5.654   6.568
  543    HE3  MET  72          3HE       MET  72  -2.137   5.576   6.956
  544    H    VAL  73           HN       VAL  73   0.637   7.054  11.848
  545    HA   VAL  73           HA       VAL  73   1.143   4.170  12.115
  546    HB   VAL  73           HB       VAL  73   2.982   4.805  10.248
  547   HG11  VAL  73          1HG1      VAL  73   1.468   3.733   8.608
  548   HG12  VAL  73          2HG1      VAL  73   1.533   2.878  10.150
  549   HG13  VAL  73          3HG1      VAL  73   0.147   3.897   9.763
  550   HG21  VAL  73          1HG2      VAL  73   2.375   6.417   8.775
  551   HG22  VAL  73          2HG2      VAL  73   0.650   6.162   9.035
  552   HG23  VAL  73          3HG2      VAL  73   1.589   7.090  10.203
  553    H    ALA  74           HN       ALA  74   3.109   7.039  11.341
  554    HA   ALA  74           HA       ALA  74   5.130   6.197  13.231
  555    HB1  ALA  74          1HB       ALA  74   5.160   7.641  10.864
  556    HB2  ALA  74          2HB       ALA  74   5.532   8.834  12.109
  557    HB3  ALA  74          3HB       ALA  74   6.520   7.381  11.958
  558    H    ALA  75           HN       ALA  75   2.584   6.886  14.367
  559    HA   ALA  75           HA       ALA  75   2.123   9.325  15.390
  560    HB1  ALA  75          1HB       ALA  75   1.123   6.962  15.978
  561    HB2  ALA  75          2HB       ALA  75   2.179   7.118  17.384
  562    HB3  ALA  75          3HB       ALA  75   0.936   8.332  17.074
  Start of MODEL   15
    1    H1   ALA   1           HN       ALA   1 -22.262 -15.760   3.580
    2    HA   ALA   1           HA       ALA   1 -23.550 -16.226   1.669
    3    HB1  ALA   1          1HB       ALA   1 -24.850 -17.848   3.463
    4    HB2  ALA   1          2HB       ALA   1 -26.100 -16.692   2.999
    5    HB3  ALA   1          3HB       ALA   1 -25.274 -17.642   1.763
    6    H    LEU   2           HN       LEU   2 -24.704 -14.494   4.488
    7    HA   LEU   2           HA       LEU   2 -25.453 -12.261   2.756
    8    HB2  LEU   2          2HB       LEU   2 -27.553 -13.302   3.100
    9    HB3  LEU   2          3HB       LEU   2 -27.225 -13.554   4.813
   10    HG   LEU   2           HG       LEU   2 -27.553 -11.250   5.299
   11   HD11  LEU   2          1HD1      LEU   2 -27.932 -10.690   2.369
   12   HD12  LEU   2          2HD1      LEU   2 -26.398 -10.455   3.205
   13   HD13  LEU   2          3HD1      LEU   2 -27.818  -9.532   3.695
   14   HD21  LEU   2          1HD2      LEU   2 -29.856 -10.865   4.252
   15   HD22  LEU   2          2HD2      LEU   2 -29.631 -12.321   5.223
   16   HD23  LEU   2          3HD2      LEU   2 -29.615 -12.423   3.462
   17    H    ASP   3           HN       ASP   3 -23.549 -11.266   3.513
   18    HA   ASP   3           HA       ASP   3 -23.901  -9.871   6.019
   19    HB2  ASP   3          2HB       ASP   3 -21.852 -11.998   5.650
   20    HB3  ASP   3          3HB       ASP   3 -21.359 -10.537   6.503
   21    HA   PRO   4           HA       PRO   4 -21.963  -6.665   3.723
   22    HB2  PRO   4          2HB       PRO   4 -21.050  -5.115   5.757
   23    HB3  PRO   4          3HB       PRO   4 -22.760  -5.225   5.326
   24    HG2  PRO   4          2HG       PRO   4 -21.264  -6.620   7.512
   25    HG3  PRO   4          3HG       PRO   4 -22.864  -5.857   7.561
   26    HD2  PRO   4          2HD       PRO   4 -22.533  -8.535   7.325
   27    HD3  PRO   4          3HD       PRO   4 -23.899  -7.672   6.588
   28    H    LEU   5           HN       LEU   5 -20.318  -8.435   3.122
   29    HA   LEU   5           HA       LEU   5 -17.694  -7.779   4.287
   30    HB2  LEU   5          2HB       LEU   5 -18.104 -10.238   2.667
   31    HB3  LEU   5          3HB       LEU   5 -16.988  -9.939   3.998
   32    HG   LEU   5           HG       LEU   5 -19.873 -10.013   4.666
   33   HD11  LEU   5          1HD1      LEU   5 -19.649 -12.546   4.859
   34   HD12  LEU   5          2HD1      LEU   5 -18.312 -12.395   3.719
   35   HD13  LEU   5          3HD1      LEU   5 -19.932 -11.877   3.251
   36   HD21  LEU   5          1HD2      LEU   5 -17.256 -10.699   5.915
   37   HD22  LEU   5          2HD2      LEU   5 -18.720 -11.487   6.508
   38   HD23  LEU   5          3HD2      LEU   5 -18.588  -9.728   6.543
   39    H    VAL   6           HN       VAL   6 -15.856  -8.145   2.683
   40    HA   VAL   6           HA       VAL   6 -14.840  -7.791   0.654
   41    HB   VAL   6           HB       VAL   6 -17.509  -7.299  -0.636
   42   HG11  VAL   6          1HG1      VAL   6 -16.444  -7.673  -2.621
   43   HG12  VAL   6          2HG1      VAL   6 -15.100  -7.014  -1.688
   44   HG13  VAL   6          3HG1      VAL   6 -15.253  -8.759  -1.905
   45   HG21  VAL   6          1HG2      VAL   6 -16.305  -9.904   0.220
   46   HG22  VAL   6          2HG2      VAL   6 -17.967  -9.339   0.385
   47   HG23  VAL   6          3HG2      VAL   6 -17.352  -9.813  -1.198
   48    H    SER   7           HN       SER   7 -13.931  -5.887   1.406
   49    HA   SER   7           HA       SER   7 -15.289  -3.428   0.521
   50    HB2  SER   7          2HB       SER   7 -14.082  -4.093   3.147
   51    HB3  SER   7          3HB       SER   7 -13.747  -2.478   2.521
   52    HG   SER   7           HG       SER   7 -15.733  -1.935   2.928
   53    H    CYS   8           HN       CYS   8 -12.113  -3.755   2.003
   54    HA   CYS   8           HA       CYS   8 -10.654  -2.107   0.495
   55    HB2  CYS   8          2HB       CYS   8  -9.844  -3.636   2.366
   56    HB3  CYS   8          3HB       CYS   8  -9.597  -4.863   1.128
   57    H    LYS   9           HN       LYS   9  -9.348  -2.218  -1.388
   58    HA   LYS   9           HA       LYS   9 -10.195  -4.261  -3.337
   59    HB2  LYS   9          2HB       LYS   9  -9.449  -1.485  -4.188
   60    HB3  LYS   9          3HB       LYS   9 -10.432  -2.676  -5.030
   61    HG2  LYS   9          2HG       LYS   9 -12.301  -2.249  -3.690
   62    HG3  LYS   9          3HG       LYS   9 -11.342  -1.412  -2.468
   63    HD2  LYS   9          2HD       LYS   9 -10.832   0.323  -4.230
   64    HD3  LYS   9          3HD       LYS   9 -12.055  -0.459  -5.235
   65    HE2  LYS   9          2HE       LYS   9 -12.505   0.714  -2.491
   66    HE3  LYS   9          3HE       LYS   9 -12.968   1.462  -4.019
   67    HZ1  LYS   9          1HZ       LYS   9 -14.807   0.294  -2.886
   68    HZ2  LYS   9          2HZ       LYS   9 -13.976  -1.166  -3.078
   69    HZ3  LYS   9          3HZ       LYS   9 -14.500  -0.306  -4.437
   70    H    LEU  10           HN       LEU  10  -7.648  -2.761  -1.717
   71    HA   LEU  10           HA       LEU  10  -5.619  -3.028  -3.708
   72    HB2  LEU  10          2HB       LEU  10  -5.528  -2.683  -0.721
   73    HB3  LEU  10          3HB       LEU  10  -4.078  -2.795  -1.716
   74    HG   LEU  10           HG       LEU  10  -6.154  -0.703  -2.260
   75   HD11  LEU  10          1HD1      LEU  10  -5.270  -0.774   0.191
   76   HD12  LEU  10          2HD1      LEU  10  -5.316   0.753  -0.689
   77   HD13  LEU  10          3HD1      LEU  10  -3.796  -0.125  -0.527
   78   HD21  LEU  10          1HD2      LEU  10  -3.418   0.064  -2.606
   79   HD22  LEU  10          2HD2      LEU  10  -4.705  -0.051  -3.809
   80   HD23  LEU  10          3HD2      LEU  10  -3.716  -1.464  -3.436
   81    H    CYS  11           HN       CYS  11  -6.876  -5.072  -1.145
   82    HA   CYS  11           HA       CYS  11  -5.199  -7.265  -2.166
   83    HB2  CYS  11          2HB       CYS  11  -4.892  -8.122   0.071
   84    HB3  CYS  11          3HB       CYS  11  -4.371  -6.441   0.037
   85    H    LEU  12           HN       LEU  12  -8.256  -6.099  -1.710
   86    HA   LEU  12           HA       LEU  12 -10.348  -7.025  -1.504
   87    HB2  LEU  12          2HB       LEU  12  -8.881  -8.740  -3.476
   88    HB3  LEU  12          3HB       LEU  12 -10.575  -9.040  -3.095
   89    HG   LEU  12           HG       LEU  12 -10.200  -6.270  -3.752
   90   HD11  LEU  12          1HD1      LEU  12  -9.296  -8.218  -5.867
   91   HD12  LEU  12          2HD1      LEU  12  -8.247  -7.095  -5.003
   92   HD13  LEU  12          3HD1      LEU  12  -9.517  -6.479  -6.059
   93   HD21  LEU  12          1HD2      LEU  12 -11.684  -8.510  -5.125
   94   HD22  LEU  12          2HD2      LEU  12 -11.920  -6.785  -5.407
   95   HD23  LEU  12          3HD2      LEU  12 -12.317  -7.485  -3.837
   96    H    GLY  13           HN       GLY  13  -9.746  -7.589   0.796
   97    HA2  GLY  13          1HA       GLY  13  -9.945 -10.516   1.139
   98    HA3  GLY  13          2HA       GLY  13  -8.924  -9.532   2.176
   99    H    GLU  14           HN       GLU  14 -11.878  -8.102   1.197
  100    HA   GLU  14           HA       GLU  14 -13.780  -7.547   2.314
  101    HB2  GLU  14          2HB       GLU  14 -13.215 -10.198   3.639
  102    HB3  GLU  14          3HB       GLU  14 -14.658  -9.251   3.968
  103    HG2  GLU  14          2HG       GLU  14 -15.657  -9.944   2.110
  104    HG3  GLU  14          3HG       GLU  14 -14.226  -9.632   1.129
  105    H    TYR  15           HN       TYR  15 -12.695  -9.212   5.170
  106    HA   TYR  15           HA       TYR  15 -11.927  -8.498   7.194
  107    HB2  TYR  15          2HB       TYR  15 -11.304  -5.836   5.917
  108    HB3  TYR  15          3HB       TYR  15 -10.584  -6.533   7.364
  109    HD1  TYR  15          1HD       TYR  15 -10.456  -6.337   3.757
  110    HD2  TYR  15          2HD       TYR  15  -9.041  -8.489   7.144
  111    HE1  TYR  15          1HE       TYR  15  -8.651  -7.293   2.388
  112    HE2  TYR  15          2HE       TYR  15  -7.231  -9.449   5.785
  113    HH   TYR  15           HH       TYR  15  -6.285  -9.550   3.783
  114    HA   PRO  16           HA       PRO  16 -15.411  -6.492   8.961
  115    HB2  PRO  16          2HB       PRO  16 -14.386  -5.701  11.347
  116    HB3  PRO  16          3HB       PRO  16 -14.748  -7.389  10.970
  117    HG2  PRO  16          2HG       PRO  16 -12.123  -5.953  10.895
  118    HG3  PRO  16          3HG       PRO  16 -12.496  -7.570  11.518
  119    HD2  PRO  16          2HD       PRO  16 -11.371  -7.169   9.087
  120    HD3  PRO  16          3HD       PRO  16 -12.472  -8.522   9.418
  121    H    VAL  17           HN       VAL  17 -15.666  -4.367  10.555
  122    HA   VAL  17           HA       VAL  17 -14.842  -2.159   8.829
  123    HB   VAL  17           HB       VAL  17 -17.117  -2.677  10.578
  124   HG11  VAL  17          1HG1      VAL  17 -16.056  -1.071  12.035
  125   HG12  VAL  17          2HG1      VAL  17 -15.802   0.035  10.684
  126   HG13  VAL  17          3HG1      VAL  17 -17.439  -0.318  11.241
  127   HG21  VAL  17          1HG2      VAL  17 -17.059  -2.241   8.077
  128   HG22  VAL  17          2HG2      VAL  17 -18.275  -1.360   9.003
  129   HG23  VAL  17          3HG2      VAL  17 -16.800  -0.545   8.483
  130    H    GLU  18           HN       GLU  18 -14.156  -3.526  11.909
  131    HA   GLU  18           HA       GLU  18 -12.967  -1.100  12.967
  132    HB2  GLU  18          2HB       GLU  18 -12.396  -3.616  14.363
  133    HB3  GLU  18          3HB       GLU  18 -13.053  -2.107  14.982
  134    HG2  GLU  18          2HG       GLU  18 -15.195  -2.889  13.671
  135    HG3  GLU  18          3HG       GLU  18 -14.458  -4.477  13.874
  136    H    GLN  19           HN       GLN  19 -12.016  -3.056  10.633
  137    HA   GLN  19           HA       GLN  19  -9.189  -3.055  11.466
  138    HB2  GLN  19          2HB       GLN  19 -10.770  -4.968   9.787
  139    HB3  GLN  19          3HB       GLN  19  -9.037  -4.810   9.534
  140    HG2  GLN  19          2HG       GLN  19  -8.691  -5.330  11.932
  141    HG3  GLN  19          3HG       GLN  19 -10.424  -5.620  12.078
  142   HE21  GLN  19          1HE2      GLN  19  -7.975  -6.495   9.663
  143   HE22  GLN  19          2HE2      GLN  19  -8.311  -8.190   9.687
  144    H    MET  20           HN       MET  20 -11.409  -1.556   9.507
  145    HA   MET  20           HA       MET  20  -9.387  -0.860   7.486
  146    HB2  MET  20          2HB       MET  20 -12.101   0.051   6.937
  147    HB3  MET  20          3HB       MET  20 -10.996  -0.865   5.921
  148    HG2  MET  20          2HG       MET  20 -11.663  -2.808   7.590
  149    HG3  MET  20          3HG       MET  20 -13.105  -1.811   7.773
  150    HE1  MET  20          1HE       MET  20 -11.333  -2.208   3.905
  151    HE2  MET  20          2HE       MET  20 -10.582  -2.945   5.321
  152    HE3  MET  20          3HE       MET  20 -11.464  -3.948   4.166
  153    H    THR  21           HN       THR  21  -9.601   1.425   6.642
  154    HA   THR  21           HA       THR  21 -10.452   3.329   8.699
  155    HB   THR  21           HB       THR  21  -7.670   3.137   7.556
  156    HG1  THR  21          1HG       THR  21  -7.431   3.584  10.013
  157   HG21  THR  21          1HG2      THR  21  -8.855   5.473   9.059
  158   HG22  THR  21          2HG2      THR  21  -8.486   5.460   7.335
  159   HG23  THR  21          3HG2      THR  21  -7.186   5.312   8.516
  160    H    THR  22           HN       THR  22 -10.952   5.393   7.933
  161    HA   THR  22           HA       THR  22 -11.747   5.487   5.173
  162    HB   THR  22           HB       THR  22 -11.902   7.615   7.316
  163    HG1  THR  22          1HG       THR  22 -13.172   5.645   7.616
  164   HG21  THR  22          1HG2      THR  22 -11.940   8.539   5.025
  165   HG22  THR  22          2HG2      THR  22 -13.484   8.739   5.854
  166   HG23  THR  22          3HG2      THR  22 -13.292   7.476   4.638
  167    H    ILE  23           HN       ILE  23 -11.099   7.045   3.627
  168    HA   ILE  23           HA       ILE  23  -8.310   7.513   3.532
  169    HB   ILE  23           HB       ILE  23 -10.562   8.568   1.828
  170   HG12  ILE  23          2HG1      ILE  23 -10.117   6.149   1.681
  171   HG13  ILE  23          3HG1      ILE  23  -9.707   6.973   0.181
  172   HG21  ILE  23          1HG2      ILE  23  -8.089   8.758   0.473
  173   HG22  ILE  23          2HG2      ILE  23  -9.183  10.059   0.937
  174   HG23  ILE  23          3HG2      ILE  23  -7.899   9.554   2.035
  175   HD11  ILE  23          1HD1      ILE  23  -8.028   5.456   2.002
  176   HD12  ILE  23          2HD1      ILE  23  -7.785   5.864   0.304
  177   HD13  ILE  23          3HD1      ILE  23  -7.340   7.019   1.560
  178    H    ALA  24           HN       ALA  24 -10.547  10.145   2.883
  179    HA   ALA  24           HA       ALA  24 -10.391  11.753   5.046
  180    HB1  ALA  24          1HB       ALA  24  -8.181  12.000   5.392
  181    HB2  ALA  24          2HB       ALA  24  -7.765  11.582   3.730
  182    HB3  ALA  24          3HB       ALA  24  -8.317  13.211   4.116
  183    H    GLN  25           HN       GLN  25 -10.317  11.417   1.629
  184    HA   GLN  25           HA       GLN  25 -11.703  14.001   1.355
  185    HB2  GLN  25          2HB       GLN  25  -9.393  12.944  -0.096
  186    HB3  GLN  25          3HB       GLN  25 -10.687  13.488  -1.155
  187    HG2  GLN  25          2HG       GLN  25  -9.088  15.262  -0.754
  188    HG3  GLN  25          3HG       GLN  25 -10.664  15.672  -0.080
  189   HE21  GLN  25          1HE2      GLN  25 -10.336  16.843   1.669
  190   HE22  GLN  25          2HE2      GLN  25  -9.221  16.480   2.939
  191    H    CYS  26           HN       CYS  26 -11.171  10.921  -0.366
  192    HA   CYS  26           HA       CYS  26 -13.768  11.084  -1.616
  193    HB2  CYS  26          2HB       CYS  26 -13.148   8.880  -2.594
  194    HB3  CYS  26          3HB       CYS  26 -11.951  10.135  -2.896
  195    H    GLN  27           HN       GLN  27 -12.512   9.871   1.300
  196    HA   GLN  27           HA       GLN  27 -13.425   8.702   3.024
  197    HB2  GLN  27          2HB       GLN  27 -15.928   9.378   1.488
  198    HB3  GLN  27          3HB       GLN  27 -15.967   8.497   3.010
  199    HG2  GLN  27          2HG       GLN  27 -14.544  11.114   2.836
  200    HG3  GLN  27          3HG       GLN  27 -16.299  11.065   2.991
  201   HE21  GLN  27          1HE2      GLN  27 -13.661  11.537   4.718
  202   HE22  GLN  27          2HE2      GLN  27 -14.130  10.868   6.241
  203    H    CYS  28           HN       CYS  28 -12.172   7.092   1.372
  204    HA   CYS  28           HA       CYS  28 -13.973   4.930   0.578
  205    HB2  CYS  28          2HB       CYS  28 -11.071   5.520   0.026
  206    HB3  CYS  28          3HB       CYS  28 -11.775   3.946  -0.329
  207    H    ILE  29           HN       ILE  29 -12.745   2.667   0.908
  208    HA   ILE  29           HA       ILE  29 -11.958   2.531   3.745
  209    HB   ILE  29           HB       ILE  29 -14.323   1.638   3.018
  210   HG12  ILE  29          2HG1      ILE  29 -13.722  -0.416   4.668
  211   HG13  ILE  29          3HG1      ILE  29 -12.316   0.608   4.939
  212   HG21  ILE  29          1HG2      ILE  29 -14.395  -0.604   2.267
  213   HG22  ILE  29          2HG2      ILE  29 -13.277   0.239   1.195
  214   HG23  ILE  29          3HG2      ILE  29 -12.655  -0.805   2.474
  215   HD11  ILE  29          1HD1      ILE  29 -13.772   2.455   5.558
  216   HD12  ILE  29          2HD1      ILE  29 -15.187   1.444   5.265
  217   HD13  ILE  29          3HD1      ILE  29 -14.069   1.039   6.566
  218    H    PHE  30           HN       PHE  30 -10.127   1.469   4.168
  219    HA   PHE  30           HA       PHE  30  -9.154  -0.610   2.402
  220    HB2  PHE  30          2HB       PHE  30  -7.602   1.951   2.829
  221    HB3  PHE  30          3HB       PHE  30  -6.932   0.487   2.117
  222    HD1  PHE  30          1HD       PHE  30  -8.908   3.448   1.560
  223    HD2  PHE  30          2HD       PHE  30  -7.814  -0.332  -0.060
  224    HE1  PHE  30          1HE       PHE  30  -9.689   4.177  -0.656
  225    HE2  PHE  30          2HE       PHE  30  -8.593   0.390  -2.280
  226    HZ   PHE  30           HZ       PHE  30  -9.531   2.648  -2.580
  227    H    CYS  31           HN       CYS  31  -8.216  -2.163   3.559
  228    HA   CYS  31           HA       CYS  31  -8.085  -2.120   6.338
  229    HB2  CYS  31          2HB       CYS  31  -7.036  -4.243   6.204
  230    HB3  CYS  31          3HB       CYS  31  -8.102  -4.147   4.806
  231    H    THR  32           HN       THR  32  -6.634  -1.420   7.776
  232    HA   THR  32           HA       THR  32  -4.760   0.437   7.437
  233    HB   THR  32           HB       THR  32  -4.202  -1.889   9.278
  234    HG1  THR  32          1HG       THR  32  -6.168   0.118   9.375
  235   HG21  THR  32          1HG2      THR  32  -3.678   1.059   9.651
  236   HG22  THR  32          2HG2      THR  32  -2.482  -0.079   9.027
  237   HG23  THR  32          3HG2      THR  32  -3.112  -0.271  10.662
  238    H    LEU  33           HN       LEU  33  -3.987  -3.040   7.283
  239    HA   LEU  33           HA       LEU  33  -1.349  -3.074   6.795
  240    HB2  LEU  33          2HB       LEU  33  -3.599  -4.712   5.962
  241    HB3  LEU  33          3HB       LEU  33  -2.263  -4.775   4.814
  242    HG   LEU  33           HG       LEU  33  -1.150  -5.111   7.387
  243   HD11  LEU  33          1HD1      LEU  33  -3.721  -5.760   7.712
  244   HD12  LEU  33          2HD1      LEU  33  -2.407  -6.609   8.524
  245   HD13  LEU  33          3HD1      LEU  33  -3.124  -7.288   7.063
  246   HD21  LEU  33          1HD2      LEU  33  -1.593  -6.838   4.978
  247   HD22  LEU  33          2HD2      LEU  33  -0.817  -7.478   6.427
  248   HD23  LEU  33          3HD2      LEU  33  -0.097  -6.114   5.570
  249    H    CYS  34           HN       CYS  34  -3.601  -2.982   4.030
  250    HA   CYS  34           HA       CYS  34  -1.673  -2.185   2.159
  251    HB2  CYS  34          2HB       CYS  34  -4.648  -1.657   2.026
  252    HB3  CYS  34          3HB       CYS  34  -3.529  -1.736   0.669
  253    H    LEU  35           HN       LEU  35  -4.346  -0.185   3.424
  254    HA   LEU  35           HA       LEU  35  -3.601   2.252   2.468
  255    HB2  LEU  35          2HB       LEU  35  -5.603   1.563   3.941
  256    HB3  LEU  35          3HB       LEU  35  -4.556   1.982   5.296
  257    HG   LEU  35           HG       LEU  35  -4.452   4.273   4.582
  258   HD11  LEU  35          1HD1      LEU  35  -6.029   4.875   2.596
  259   HD12  LEU  35          2HD1      LEU  35  -5.741   3.204   2.113
  260   HD13  LEU  35          3HD1      LEU  35  -4.385   4.319   2.284
  261   HD21  LEU  35          1HD2      LEU  35  -7.280   4.173   4.186
  262   HD22  LEU  35          2HD2      LEU  35  -6.374   4.651   5.622
  263   HD23  LEU  35          3HD2      LEU  35  -6.814   2.960   5.377
  264    H    LYS  36           HN       LYS  36  -1.973   0.386   4.848
  265    HA   LYS  36           HA       LYS  36  -0.425   2.642   5.841
  266    HB2  LYS  36          2HB       LYS  36  -0.999   1.062   7.518
  267    HB3  LYS  36          3HB       LYS  36  -0.487  -0.293   6.522
  268    HG2  LYS  36          2HG       LYS  36   1.632   1.643   7.081
  269    HG3  LYS  36          3HG       LYS  36   0.983   0.841   8.512
  270    HD2  LYS  36          2HD       LYS  36   1.344  -1.091   6.436
  271    HD3  LYS  36          3HD       LYS  36   2.836  -0.168   6.636
  272    HE2  LYS  36          2HE       LYS  36   2.555  -0.588   9.137
  273    HE3  LYS  36          3HE       LYS  36   1.347  -1.789   8.682
  274    HZ1  LYS  36          1HZ       LYS  36   2.982  -3.221   8.345
  275    HZ2  LYS  36          2HZ       LYS  36   4.144  -2.049   8.715
  276    HZ3  LYS  36          3HZ       LYS  36   3.612  -2.237   7.121
  277    H    GLN  37           HN       GLN  37   0.576  -0.587   4.715
  278    HA   GLN  37           HA       GLN  37   3.168  -0.059   4.087
  279    HB2  GLN  37          2HB       GLN  37   1.464  -2.175   3.680
  280    HB3  GLN  37          3HB       GLN  37   1.866  -1.699   2.035
  281    HG2  GLN  37          2HG       GLN  37   4.070  -2.257   2.258
  282    HG3  GLN  37          3HG       GLN  37   4.072  -1.998   4.002
  283   HE21  GLN  37          1HE2      GLN  37   2.250  -3.546   5.023
  284   HE22  GLN  37          2HE2      GLN  37   2.483  -5.209   4.618
  285    H    TYR  38           HN       TYR  38   0.380   1.129   2.471
  286    HA   TYR  38           HA       TYR  38   1.753   1.799   0.019
  287    HB2  TYR  38          2HB       TYR  38  -0.397   1.623  -0.626
  288    HB3  TYR  38          3HB       TYR  38  -0.999   1.857   1.011
  289    HD1  TYR  38          1HD       TYR  38   0.987   4.122  -1.193
  290    HD2  TYR  38          2HD       TYR  38  -2.668   3.463   0.881
  291    HE1  TYR  38          1HE       TYR  38   0.242   6.387  -1.798
  292    HE2  TYR  38          2HE       TYR  38  -3.424   5.725   0.282
  293    HH   TYR  38           HH       TYR  38  -1.838   7.636  -2.048
  294    H    VAL  39           HN       VAL  39   0.209   3.698   2.616
  295    HA   VAL  39           HA       VAL  39   1.397   6.149   1.744
  296    HB   VAL  39           HB       VAL  39   0.432   7.148   3.722
  297   HG11  VAL  39          1HG1      VAL  39  -1.049   5.594   1.825
  298   HG12  VAL  39          2HG1      VAL  39  -1.906   5.630   3.366
  299   HG13  VAL  39          3HG1      VAL  39  -1.464   7.139   2.565
  300   HG21  VAL  39          1HG2      VAL  39   0.032   4.302   4.610
  301   HG22  VAL  39          2HG2      VAL  39   0.920   5.587   5.430
  302   HG23  VAL  39          3HG2      VAL  39  -0.839   5.658   5.326
  303    H    GLU  40           HN       GLU  40   1.914   4.047   4.575
  304    HA   GLU  40           HA       GLU  40   3.838   5.318   5.954
  305    HB2  GLU  40          2HB       GLU  40   2.938   2.710   5.836
  306    HB3  GLU  40          3HB       GLU  40   4.649   2.554   5.463
  307    HG2  GLU  40          2HG       GLU  40   4.008   4.282   7.752
  308    HG3  GLU  40          3HG       GLU  40   3.635   2.572   7.956
  309    H    LEU  41           HN       LEU  41   4.208   3.914   2.784
  310    HA   LEU  41           HA       LEU  41   7.084   4.233   2.765
  311    HB2  LEU  41          2HB       LEU  41   5.032   3.137   0.934
  312    HB3  LEU  41          3HB       LEU  41   6.508   3.757   0.198
  313    HG   LEU  41           HG       LEU  41   6.822   1.434   0.469
  314   HD11  LEU  41          1HD1      LEU  41   8.770   1.334   1.760
  315   HD12  LEU  41          2HD1      LEU  41   8.189   2.554   2.894
  316   HD13  LEU  41          3HD1      LEU  41   8.658   3.022   1.259
  317   HD21  LEU  41          1HD2      LEU  41   5.706   0.259   1.982
  318   HD22  LEU  41          2HD2      LEU  41   5.110   1.756   2.699
  319   HD23  LEU  41          3HD2      LEU  41   6.613   1.037   3.279
  320    H    LEU  42           HN       LEU  42   4.257   5.845   1.404
  321    HA   LEU  42           HA       LEU  42   5.908   7.819   0.056
  322    HB2  LEU  42          2HB       LEU  42   2.962   7.298   0.214
  323    HB3  LEU  42          3HB       LEU  42   3.583   8.809  -0.447
  324    HG   LEU  42           HG       LEU  42   4.646   6.281  -1.582
  325   HD11  LEU  42          1HD1      LEU  42   2.142   6.002  -1.309
  326   HD12  LEU  42          2HD1      LEU  42   2.779   5.852  -2.947
  327   HD13  LEU  42          3HD1      LEU  42   1.971   7.338  -2.448
  328   HD21  LEU  42          1HD2      LEU  42   5.555   7.964  -2.770
  329   HD22  LEU  42          2HD2      LEU  42   4.274   9.099  -2.345
  330   HD23  LEU  42          3HD2      LEU  42   4.019   7.921  -3.633
  331    H    ILE  43           HN       ILE  43   3.170   8.043   2.336
  332    HA   ILE  43           HA       ILE  43   3.280  10.616   3.101
  333    HB   ILE  43           HB       ILE  43   2.171   8.316   4.203
  334   HG12  ILE  43          2HG1      ILE  43   1.244  10.256   5.841
  335   HG13  ILE  43          3HG1      ILE  43   1.955  11.246   4.571
  336   HG21  ILE  43          1HG2      ILE  43   4.129   8.179   5.707
  337   HG22  ILE  43          2HG2      ILE  43   3.722   9.775   6.336
  338   HG23  ILE  43          3HG2      ILE  43   2.612   8.425   6.573
  339   HD11  ILE  43          1HD1      ILE  43   0.232  10.870   3.240
  340   HD12  ILE  43          2HD1      ILE  43   0.393   9.124   3.433
  341   HD13  ILE  43          3HD1      ILE  43  -0.560  10.055   4.588
  342    H    LYS  44           HN       LYS  44   5.694   8.220   3.760
  343    HA   LYS  44           HA       LYS  44   7.034   9.689   5.825
  344    HB2  LYS  44          2HB       LYS  44   7.227   7.101   4.656
  345    HB3  LYS  44          3HB       LYS  44   8.806   7.864   4.530
  346    HG2  LYS  44          2HG       LYS  44   8.563   6.545   6.580
  347    HG3  LYS  44          3HG       LYS  44   8.850   8.253   6.915
  348    HD2  LYS  44          2HD       LYS  44   7.107   7.994   8.326
  349    HD3  LYS  44          3HD       LYS  44   6.153   8.222   6.859
  350    HE2  LYS  44          2HE       LYS  44   5.364   6.140   6.952
  351    HE3  LYS  44          3HE       LYS  44   6.978   5.467   7.176
  352    HZ1  LYS  44          1HZ       LYS  44   5.268   6.610   9.318
  353    HZ2  LYS  44          2HZ       LYS  44   6.818   5.969   9.536
  354    HZ3  LYS  44          3HZ       LYS  44   5.546   4.963   9.051
  355    H    GLU  45           HN       GLU  45   7.528   9.207   2.350
  356    HA   GLU  45           HA       GLU  45   9.896  10.802   2.240
  357    HB2  GLU  45          2HB       GLU  45   8.568   9.052   0.514
  358    HB3  GLU  45          3HB       GLU  45   8.476  10.618  -0.281
  359    HG2  GLU  45          2HG       GLU  45  10.444   9.830  -1.119
  360    HG3  GLU  45          3HG       GLU  45  11.025  10.721   0.287
  361    H    GLY  46           HN       GLY  46   6.727  11.371   0.695
  362    HA2  GLY  46          1HA       GLY  46   5.503  13.305   0.447
  363    HA3  GLY  46          2HA       GLY  46   6.468  14.006   1.738
  364    H    LEU  47           HN       LEU  47   6.882  12.999  -1.659
  365    HA   LEU  47           HA       LEU  47   8.629  15.321  -2.058
  366    HB2  LEU  47          2HB       LEU  47   9.297  14.203  -4.145
  367    HB3  LEU  47          3HB       LEU  47   9.603  13.223  -2.712
  368    HG   LEU  47           HG       LEU  47   7.128  12.801  -4.349
  369   HD11  LEU  47          1HD1      LEU  47   9.014  12.730  -5.910
  370   HD12  LEU  47          2HD1      LEU  47   8.305  11.135  -5.665
  371   HD13  LEU  47          3HD1      LEU  47   9.824  11.555  -4.872
  372   HD21  LEU  47          1HD2      LEU  47   8.434  11.556  -2.090
  373   HD22  LEU  47          2HD2      LEU  47   8.175  10.406  -3.403
  374   HD23  LEU  47          3HD2      LEU  47   6.811  11.304  -2.734
  375    H    GLU  48           HN       GLU  48   5.620  13.876  -3.089
  376    HA   GLU  48           HA       GLU  48   4.395  16.202  -3.885
  377    HB2  GLU  48          2HB       GLU  48   4.502  15.646  -6.477
  378    HB3  GLU  48          3HB       GLU  48   5.681  16.699  -5.709
  379    HG2  GLU  48          2HG       GLU  48   7.356  15.130  -5.808
  380    HG3  GLU  48          3HG       GLU  48   6.228  13.776  -5.881
  381    H    THR  49           HN       THR  49   4.792  12.780  -4.273
  382    HA   THR  49           HA       THR  49   2.665  11.865  -5.633
  383    HB   THR  49           HB       THR  49   3.378  10.819  -2.887
  384    HG1  THR  49          1HG       THR  49   4.849  10.957  -5.137
  385   HG21  THR  49          1HG2      THR  49   1.961   9.149  -3.297
  386   HG22  THR  49          2HG2      THR  49   2.725   8.834  -4.856
  387   HG23  THR  49          3HG2      THR  49   1.419  10.013  -4.736
  388    H    ALA  50           HN       ALA  50   2.532  13.636  -2.649
  389    HA   ALA  50           HA       ALA  50   0.814  14.427  -1.380
  390    HB1  ALA  50          1HB       ALA  50  -1.376  14.758  -2.746
  391    HB2  ALA  50          2HB       ALA  50   0.061  15.697  -3.153
  392    HB3  ALA  50          3HB       ALA  50  -0.373  14.286  -4.118
  393    H    ILE  51           HN       ILE  51   1.124  11.385  -1.984
  394    HA   ILE  51           HA       ILE  51  -0.071   9.431  -1.649
  395    HB   ILE  51           HB       ILE  51  -0.647  11.036   0.842
  396   HG12  ILE  51          2HG1      ILE  51   1.279   9.856   1.770
  397   HG13  ILE  51          3HG1      ILE  51   1.484   8.966   0.265
  398   HG21  ILE  51          1HG2      ILE  51  -2.154   9.050   0.455
  399   HG22  ILE  51          2HG2      ILE  51  -0.714   8.041   0.576
  400   HG23  ILE  51          3HG2      ILE  51  -1.220   9.023   1.951
  401   HD11  ILE  51          1HD1      ILE  51   2.909  11.117   0.860
  402   HD12  ILE  51          2HD1      ILE  51   2.447  10.719  -0.795
  403   HD13  ILE  51          3HD1      ILE  51   1.528  11.920   0.112
  404    H    SER  52           HN       SER  52  -1.668   9.532  -3.268
  405    HA   SER  52           HA       SER  52  -4.291  10.554  -2.423
  406    HB2  SER  52          2HB       SER  52  -4.277   9.680  -5.156
  407    HB3  SER  52          3HB       SER  52  -4.506  11.309  -4.521
  408    HG   SER  52           HG       SER  52  -2.690  11.573  -5.610
  409    H    CYS  53           HN       CYS  53  -6.193   9.269  -2.975
  410    HA   CYS  53           HA       CYS  53  -6.426   6.873  -1.849
  411    HB2  CYS  53          2HB       CYS  53  -8.288   8.121  -2.930
  412    HB3  CYS  53          3HB       CYS  53  -7.743   7.520  -4.493
  413    HA   PRO  54           HA       PRO  54  -3.798   4.034  -3.984
  414    HB2  PRO  54          2HB       PRO  54  -4.792   1.747  -2.911
  415    HB3  PRO  54          3HB       PRO  54  -3.746   2.854  -2.014
  416    HG2  PRO  54          2HG       PRO  54  -6.727   2.587  -1.942
  417    HG3  PRO  54          3HG       PRO  54  -5.590   2.800  -0.597
  418    HD2  PRO  54          2HD       PRO  54  -7.043   4.846  -1.615
  419    HD3  PRO  54          3HD       PRO  54  -5.418   5.074  -0.940
  420    H    ASP  55           HN       ASP  55  -7.096   4.414  -4.482
  421    HA   ASP  55           HA       ASP  55  -7.375   2.179  -6.326
  422    HB2  ASP  55          2HB       ASP  55  -9.186   3.258  -4.703
  423    HB3  ASP  55          3HB       ASP  55  -9.456   4.301  -6.097
  424    H    ALA  56           HN       ALA  56  -6.765   2.332  -8.370
  425    HA   ALA  56           HA       ALA  56  -6.181   4.908  -9.550
  426    HB1  ALA  56          1HB       ALA  56  -5.675   2.071 -10.287
  427    HB2  ALA  56          2HB       ALA  56  -5.646   3.293 -11.560
  428    HB3  ALA  56          3HB       ALA  56  -4.555   3.430 -10.182
  429    H    ALA  57           HN       ALA  57  -8.974   4.227  -8.949
  430    HA   ALA  57           HA       ALA  57 -10.097   4.995 -11.493
  431    HB1  ALA  57          1HB       ALA  57 -10.013   2.279 -10.937
  432    HB2  ALA  57          2HB       ALA  57 -11.658   2.761 -10.523
  433    HB3  ALA  57          3HB       ALA  57 -11.027   3.080 -12.139
  434    H    CYS  58           HN       CYS  58  -9.843   5.818  -8.579
  435    HA   CYS  58           HA       CYS  58 -12.459   5.772  -7.463
  436    HB2  CYS  58          2HB       CYS  58 -10.264   6.126  -6.220
  437    HB3  CYS  58          3HB       CYS  58 -10.300   7.779  -6.823
  438    HA   PRO  59           HA       PRO  59 -14.269   8.935  -9.985
  439    HB2  PRO  59          2HB       PRO  59 -16.555   9.222  -8.546
  440    HB3  PRO  59          3HB       PRO  59 -16.264   7.853  -9.625
  441    HG2  PRO  59          2HG       PRO  59 -15.968   8.017  -6.651
  442    HG3  PRO  59          3HG       PRO  59 -16.672   6.721  -7.635
  443    HD2  PRO  59          2HD       PRO  59 -14.163   6.584  -6.629
  444    HD3  PRO  59          3HD       PRO  59 -14.613   5.840  -8.177
  445    H    LYS  60           HN       LYS  60 -13.191   9.245  -6.789
  446    HA   LYS  60           HA       LYS  60 -13.597  12.162  -6.895
  447    HB2  LYS  60          2HB       LYS  60 -13.447  10.536  -4.356
  448    HB3  LYS  60          3HB       LYS  60 -13.866  12.237  -4.515
  449    HG2  LYS  60          2HG       LYS  60 -15.841  11.384  -5.939
  450    HG3  LYS  60          3HG       LYS  60 -15.496   9.824  -5.190
  451    HD2  LYS  60          2HD       LYS  60 -16.271  10.477  -3.173
  452    HD3  LYS  60          3HD       LYS  60 -15.627  12.112  -3.341
  453    HE2  LYS  60          2HE       LYS  60 -17.694  12.814  -3.755
  454    HE3  LYS  60          3HE       LYS  60 -17.651  11.897  -5.261
  455    HZ1  LYS  60          1HZ       LYS  60 -18.372  10.573  -2.728
  456    HZ2  LYS  60          2HZ       LYS  60 -18.762  10.126  -4.312
  457    HZ3  LYS  60          3HZ       LYS  60 -19.532  11.449  -3.594
  458    H    GLN  61           HN       GLN  61 -11.453   9.509  -6.411
  459    HA   GLN  61           HA       GLN  61  -9.246   9.380  -5.766
  460    HB2  GLN  61          2HB       GLN  61  -9.110  11.787  -7.588
  461    HB3  GLN  61          3HB       GLN  61  -7.798  10.672  -7.225
  462    HG2  GLN  61          2HG       GLN  61  -9.255   8.859  -8.231
  463    HG3  GLN  61          3HG       GLN  61 -10.279  10.162  -8.833
  464   HE21  GLN  61          1HE2      GLN  61  -7.288   8.487  -9.162
  465   HE22  GLN  61          2HE2      GLN  61  -6.757   9.272 -10.607
  466    H    GLY  62           HN       GLY  62 -10.193  10.291  -3.592
  467    HA2  GLY  62          1HA       GLY  62  -9.469  12.964  -2.886
  468    HA3  GLY  62          2HA       GLY  62  -9.956  11.690  -1.777
  469    H    HIS  63           HN       HIS  63  -7.791  13.703  -1.600
  470    HA   HIS  63           HA       HIS  63  -5.379  12.071  -1.717
  471    HB2  HIS  63          2HB       HIS  63  -5.875  14.990  -1.149
  472    HB3  HIS  63          3HB       HIS  63  -4.298  14.244  -0.910
  473    HD1  HIS  63          1HD       HIS  63  -6.259  15.943  -3.398
  474    HD2  HIS  63          2HD       HIS  63  -3.319  13.006  -3.440
  475    HE1  HIS  63          1HE       HIS  63  -5.368  15.917  -5.749
  476    H    LEU  64           HN       LEU  64  -3.870  12.214   0.197
  477    HA   LEU  64           HA       LEU  64  -5.412  11.966   2.696
  478    HB2  LEU  64          2HB       LEU  64  -3.122  10.369   1.612
  479    HB3  LEU  64          3HB       LEU  64  -3.432  10.436   3.345
  480    HG   LEU  64           HG       LEU  64  -5.631   9.628   1.490
  481   HD11  LEU  64          1HD1      LEU  64  -4.745   7.231   2.093
  482   HD12  LEU  64          2HD1      LEU  64  -3.190   8.061   2.158
  483   HD13  LEU  64          3HD1      LEU  64  -4.145   8.092   0.676
  484   HD21  LEU  64          1HD2      LEU  64  -5.726   8.054   3.701
  485   HD22  LEU  64          2HD2      LEU  64  -6.570   9.594   3.530
  486   HD23  LEU  64          3HD2      LEU  64  -5.014   9.528   4.358
  487    H    GLN  65           HN       GLN  65  -4.164  12.389   4.683
  488    HA   GLN  65           HA       GLN  65  -2.476  14.738   4.306
  489    HB2  GLN  65          2HB       GLN  65  -2.949  14.063   7.067
  490    HB3  GLN  65          3HB       GLN  65  -3.431  15.501   6.175
  491    HG2  GLN  65          2HG       GLN  65  -5.454  14.668   6.869
  492    HG3  GLN  65          3HG       GLN  65  -5.317  13.986   5.249
  493   HE21  GLN  65          1HE2      GLN  65  -3.183  12.146   6.346
  494   HE22  GLN  65          2HE2      GLN  65  -4.073  10.884   7.120
  495    H    GLU  66           HN       GLU  66  -0.610  15.000   5.848
  496    HA   GLU  66           HA       GLU  66   1.026  12.591   5.714
  497    HB2  GLU  66          2HB       GLU  66   1.552  15.508   5.936
  498    HB3  GLU  66          3HB       GLU  66   2.736  14.424   6.653
  499    HG2  GLU  66          2HG       GLU  66   2.311  13.297   4.193
  500    HG3  GLU  66          3HG       GLU  66   2.194  15.023   3.856
  501    H    ASN  67           HN       ASN  67   0.137  15.059   8.124
  502    HA   ASN  67           HA       ASN  67   1.348  13.758  10.315
  503    HB2  ASN  67          2HB       ASN  67  -0.221  15.235  11.675
  504    HB3  ASN  67          3HB       ASN  67   0.864  16.067  10.565
  505   HD21  ASN  67          1HD2      ASN  67  -2.425  15.021  11.110
  506   HD22  ASN  67          2HD2      ASN  67  -3.162  16.115   9.995
  507    H    GLU  68           HN       GLU  68  -2.091  13.962   9.384
  508    HA   GLU  68           HA       GLU  68  -3.159  12.308  11.310
  509    HB2  GLU  68          2HB       GLU  68  -3.991  13.361   8.760
  510    HB3  GLU  68          3HB       GLU  68  -4.558  11.708   8.943
  511    HG2  GLU  68          2HG       GLU  68  -4.945  13.516  11.247
  512    HG3  GLU  68          3HG       GLU  68  -5.925  13.819   9.814
  513    H    ILE  69           HN       ILE  69  -2.156  11.310   8.035
  514    HA   ILE  69           HA       ILE  69  -2.547   8.573   8.367
  515    HB   ILE  69           HB       ILE  69  -0.707  10.135   6.578
  516   HG12  ILE  69          2HG1      ILE  69  -3.418   9.099   6.465
  517   HG13  ILE  69          3HG1      ILE  69  -2.624  10.272   5.419
  518   HG21  ILE  69          1HG2      ILE  69  -1.014   7.137   6.664
  519   HG22  ILE  69          2HG2      ILE  69  -0.181   8.042   5.402
  520   HG23  ILE  69          3HG2      ILE  69   0.443   8.051   7.052
  521   HD11  ILE  69          1HD1      ILE  69  -3.457   8.279   4.228
  522   HD12  ILE  69          2HD1      ILE  69  -1.717   8.517   4.059
  523   HD13  ILE  69          3HD1      ILE  69  -2.338   7.289   5.163
  524    H    GLU  70           HN       GLU  70   0.602  10.256   8.440
  525    HA   GLU  70           HA       GLU  70   2.126   8.151   9.380
  526    HB2  GLU  70          2HB       GLU  70   3.821   9.680   9.726
  527    HB3  GLU  70          3HB       GLU  70   2.793  10.557   8.602
  528    HG2  GLU  70          2HG       GLU  70   1.782  11.760  10.485
  529    HG3  GLU  70          3HG       GLU  70   2.852  10.902  11.592
  530    H    CYS  71           HN       CYS  71  -0.139  10.132  11.075
  531    HA   CYS  71           HA       CYS  71   0.833   9.617  13.709
  532    HB2  CYS  71          2HB       CYS  71  -0.499  11.464  13.804
  533    HB3  CYS  71          3HB       CYS  71  -1.545  10.905  12.505
  534    HG   CYS  71           HG       CYS  71  -3.145   9.322  14.041
  535    H    MET  72           HN       MET  72  -1.225   7.936  11.482
  536    HA   MET  72           HA       MET  72  -2.254   6.145  13.528
  537    HB2  MET  72          2HB       MET  72  -3.850   5.560  12.033
  538    HB3  MET  72          3HB       MET  72  -3.360   7.048  11.234
  539    HG2  MET  72          2HG       MET  72  -1.662   5.510  10.007
  540    HG3  MET  72          3HG       MET  72  -2.753   4.222  10.509
  541    HE1  MET  72          1HE       MET  72  -1.899   5.235   7.474
  542    HE2  MET  72          2HE       MET  72  -2.838   3.771   7.768
  543    HE3  MET  72          3HE       MET  72  -3.430   4.987   6.634
  544    H    VAL  73           HN       VAL  73   0.631   6.405  12.176
  545    HA   VAL  73           HA       VAL  73   1.099   3.511  12.259
  546    HB   VAL  73           HB       VAL  73   2.895   4.153  10.374
  547   HG11  VAL  73          1HG1      VAL  73   0.573   2.650  10.532
  548   HG12  VAL  73          2HG1      VAL  73   0.348   3.646   9.093
  549   HG13  VAL  73          3HG1      VAL  73   1.767   2.608   9.235
  550   HG21  VAL  73          1HG2      VAL  73   2.394   5.907   9.063
  551   HG22  VAL  73          2HG2      VAL  73   0.657   5.621   9.172
  552   HG23  VAL  73          3HG2      VAL  73   1.491   6.481  10.465
  553    H    ALA  74           HN       ALA  74   2.989   6.473  11.635
  554    HA   ALA  74           HA       ALA  74   5.054   5.525  13.453
  555    HB1  ALA  74          1HB       ALA  74   4.890   7.642  11.365
  556    HB2  ALA  74          2HB       ALA  74   6.102   7.795  12.637
  557    HB3  ALA  74          3HB       ALA  74   6.092   6.372  11.595
  558    H    ALA  75           HN       ALA  75   2.598   6.197  14.681
  559    HA   ALA  75           HA       ALA  75   2.308   8.736  15.697
  560    HB1  ALA  75          1HB       ALA  75   1.917   6.321  17.431
  561    HB2  ALA  75          2HB       ALA  75   0.984   7.817  17.387
  562    HB3  ALA  75          3HB       ALA  75   0.856   6.658  16.063
  Start of MODEL   16
    1    H1   ALA   1           HN       ALA   1 -27.815 -11.879   1.086
    2    HA   ALA   1           HA       ALA   1 -28.381 -10.296   3.459
    3    HB1  ALA   1          1HB       ALA   1 -26.709 -12.415   3.767
    4    HB2  ALA   1          2HB       ALA   1 -25.571 -11.127   3.365
    5    HB3  ALA   1          3HB       ALA   1 -26.659 -10.946   4.742
    6    H    LEU   2           HN       LEU   2 -26.118  -8.826   3.654
    7    HA   LEU   2           HA       LEU   2 -26.309  -7.112   1.389
    8    HB2  LEU   2          2HB       LEU   2 -24.845  -7.124   3.961
    9    HB3  LEU   2          3HB       LEU   2 -24.169  -6.138   2.667
   10    HG   LEU   2           HG       LEU   2 -26.743  -5.317   2.606
   11   HD11  LEU   2          1HD1      LEU   2 -26.247  -5.531   5.541
   12   HD12  LEU   2          2HD1      LEU   2 -27.027  -6.859   4.685
   13   HD13  LEU   2          3HD1      LEU   2 -27.756  -5.253   4.673
   14   HD21  LEU   2          1HD2      LEU   2 -24.839  -3.848   2.663
   15   HD22  LEU   2          2HD2      LEU   2 -24.500  -4.284   4.338
   16   HD23  LEU   2          3HD2      LEU   2 -25.961  -3.379   3.940
   17    H    ASP   3           HN       ASP   3 -23.360  -8.546   2.784
   18    HA   ASP   3           HA       ASP   3 -22.487  -9.874   0.494
   19    HB2  ASP   3          2HB       ASP   3 -21.886  -6.974   0.567
   20    HB3  ASP   3          3HB       ASP   3 -20.548  -8.033   0.131
   21    HA   PRO   4           HA       PRO   4 -19.594 -11.333   3.461
   22    HB2  PRO   4          2HB       PRO   4 -17.718 -12.403   1.816
   23    HB3  PRO   4          3HB       PRO   4 -19.301 -13.146   2.080
   24    HG2  PRO   4          2HG       PRO   4 -18.368 -11.431  -0.189
   25    HG3  PRO   4          3HG       PRO   4 -19.344 -12.912  -0.233
   26    HD2  PRO   4          2HD       PRO   4 -20.433 -10.442  -0.450
   27    HD3  PRO   4          3HD       PRO   4 -21.286 -11.798   0.315
   28    H    LEU   5           HN       LEU   5 -19.199  -8.868   3.798
   29    HA   LEU   5           HA       LEU   5 -17.746  -7.158   4.169
   30    HB2  LEU   5          2HB       LEU   5 -15.911  -9.531   4.078
   31    HB3  LEU   5          3HB       LEU   5 -15.298  -7.905   4.374
   32    HG   LEU   5           HG       LEU   5 -16.542  -7.742   6.418
   33   HD11  LEU   5          1HD1      LEU   5 -17.691 -10.442   5.720
   34   HD12  LEU   5          2HD1      LEU   5 -18.562  -8.908   5.727
   35   HD13  LEU   5          3HD1      LEU   5 -17.941  -9.575   7.236
   36   HD21  LEU   5          1HD2      LEU   5 -14.734 -10.005   5.926
   37   HD22  LEU   5          2HD2      LEU   5 -15.697 -10.126   7.399
   38   HD23  LEU   5          3HD2      LEU   5 -14.654  -8.727   7.138
   39    H    VAL   6           HN       VAL   6 -15.231  -8.761   2.379
   40    HA   VAL   6           HA       VAL   6 -13.955  -7.877   0.664
   41    HB   VAL   6           HB       VAL   6 -15.345  -7.824  -1.495
   42   HG11  VAL   6          1HG1      VAL   6 -15.731 -10.371  -1.305
   43   HG12  VAL   6          2HG1      VAL   6 -14.089  -9.748  -1.142
   44   HG13  VAL   6          3HG1      VAL   6 -15.008 -10.203   0.293
   45   HG21  VAL   6          1HG2      VAL   6 -17.556  -8.736  -1.418
   46   HG22  VAL   6          2HG2      VAL   6 -17.438  -9.013   0.321
   47   HG23  VAL   6          3HG2      VAL   6 -17.494  -7.366  -0.309
   48    H    SER   7           HN       SER   7 -13.589  -5.779   1.617
   49    HA   SER   7           HA       SER   7 -15.149  -3.628   0.343
   50    HB2  SER   7          2HB       SER   7 -13.492  -2.710   2.528
   51    HB3  SER   7          3HB       SER   7 -15.240  -2.584   2.326
   52    HG   SER   7           HG       SER   7 -14.888  -5.058   2.914
   53    H    CYS   8           HN       CYS   8 -11.886  -4.032   1.733
   54    HA   CYS   8           HA       CYS   8 -10.596  -2.070   0.303
   55    HB2  CYS   8          2HB       CYS   8  -9.660  -3.489   2.184
   56    HB3  CYS   8          3HB       CYS   8  -9.338  -4.731   0.979
   57    H    LYS   9           HN       LYS   9  -9.271  -2.080  -1.571
   58    HA   LYS   9           HA       LYS   9  -9.920  -4.200  -3.512
   59    HB2  LYS   9          2HB       LYS   9  -9.538  -1.296  -4.234
   60    HB3  LYS   9          3HB       LYS   9 -10.140  -2.592  -5.260
   61    HG2  LYS   9          2HG       LYS   9 -12.158  -2.744  -3.913
   62    HG3  LYS   9          3HG       LYS   9 -11.551  -1.479  -2.842
   63    HD2  LYS   9          2HD       LYS   9 -11.341  -0.200  -5.184
   64    HD3  LYS   9          3HD       LYS   9 -12.675  -1.286  -5.575
   65    HE2  LYS   9          2HE       LYS   9 -13.161  -0.209  -2.999
   66    HE3  LYS   9          3HE       LYS   9 -12.716   1.126  -4.061
   67    HZ1  LYS   9          1HZ       LYS   9 -14.444   0.512  -5.576
   68    HZ2  LYS   9          2HZ       LYS   9 -15.121   0.646  -4.032
   69    HZ3  LYS   9          3HZ       LYS   9 -14.811  -0.882  -4.689
   70    H    LEU  10           HN       LEU  10  -7.534  -3.009  -1.715
   71    HA   LEU  10           HA       LEU  10  -5.469  -2.926  -3.767
   72    HB2  LEU  10          2HB       LEU  10  -5.429  -2.494  -0.790
   73    HB3  LEU  10          3HB       LEU  10  -3.968  -2.517  -1.776
   74    HG   LEU  10           HG       LEU  10  -6.232  -0.586  -2.243
   75   HD11  LEU  10          1HD1      LEU  10  -3.719  -0.153  -0.633
   76   HD12  LEU  10          2HD1      LEU  10  -5.350  -0.279   0.023
   77   HD13  LEU  10          3HD1      LEU  10  -4.928   1.068  -1.034
   78   HD21  LEU  10          1HD2      LEU  10  -3.639   0.336  -2.990
   79   HD22  LEU  10          2HD2      LEU  10  -5.048   0.042  -4.009
   80   HD23  LEU  10          3HD2      LEU  10  -3.902  -1.260  -3.691
   81    H    CYS  11           HN       CYS  11  -6.890  -5.153  -1.601
   82    HA   CYS  11           HA       CYS  11  -4.864  -7.143  -2.327
   83    HB2  CYS  11          2HB       CYS  11  -4.868  -8.059  -0.048
   84    HB3  CYS  11          3HB       CYS  11  -4.303  -6.392  -0.062
   85    H    LEU  12           HN       LEU  12  -7.917  -6.285  -2.633
   86    HA   LEU  12           HA       LEU  12  -9.956  -7.327  -2.795
   87    HB2  LEU  12          2HB       LEU  12  -8.345  -9.636  -3.838
   88    HB3  LEU  12          3HB       LEU  12  -9.953  -9.111  -4.332
   89    HG   LEU  12           HG       LEU  12  -7.576  -7.351  -4.801
   90   HD11  LEU  12          1HD1      LEU  12  -7.859  -9.957  -5.865
   91   HD12  LEU  12          2HD1      LEU  12  -6.680  -8.718  -6.294
   92   HD13  LEU  12          3HD1      LEU  12  -8.216  -8.809  -7.155
   93   HD21  LEU  12          1HD2      LEU  12  -9.359  -6.119  -5.428
   94   HD22  LEU  12          2HD2      LEU  12 -10.389  -7.529  -5.673
   95   HD23  LEU  12          3HD2      LEU  12  -9.219  -7.066  -6.909
   96    H    GLY  13           HN       GLY  13  -9.103  -7.565  -0.210
   97    HA2  GLY  13          1HA       GLY  13  -9.520 -10.384   0.513
   98    HA3  GLY  13          2HA       GLY  13  -8.870  -9.141   1.573
   99    H    GLU  14           HN       GLU  14 -10.463 -10.034   3.093
  100    HA   GLU  14           HA       GLU  14 -12.985  -8.579   2.847
  101    HB2  GLU  14          2HB       GLU  14 -13.276 -11.287   3.979
  102    HB3  GLU  14          3HB       GLU  14 -14.366 -10.373   2.945
  103    HG2  GLU  14          2HG       GLU  14 -13.043 -10.936   1.000
  104    HG3  GLU  14          3HG       GLU  14 -11.877 -11.784   2.013
  105    H    TYR  15           HN       TYR  15 -12.719  -7.223   4.519
  106    HA   TYR  15           HA       TYR  15 -12.327  -8.416   7.174
  107    HB2  TYR  15          2HB       TYR  15 -11.137  -5.733   6.625
  108    HB3  TYR  15          3HB       TYR  15 -10.654  -6.954   7.797
  109    HD1  TYR  15          1HD       TYR  15  -9.105  -8.694   7.209
  110    HD2  TYR  15          2HD       TYR  15 -10.439  -5.918   4.274
  111    HE1  TYR  15          1HE       TYR  15  -7.324  -9.452   5.690
  112    HE2  TYR  15          2HE       TYR  15  -8.662  -6.668   2.747
  113    HH   TYR  15           HH       TYR  15  -6.670  -9.442   3.469
  114    HA   PRO  16           HA       PRO  16 -15.793  -6.015   8.398
  115    HB2  PRO  16          2HB       PRO  16 -15.218  -5.586  11.017
  116    HB3  PRO  16          3HB       PRO  16 -15.723  -7.159  10.389
  117    HG2  PRO  16          2HG       PRO  16 -12.970  -6.164  11.015
  118    HG3  PRO  16          3HG       PRO  16 -13.695  -7.745  11.366
  119    HD2  PRO  16          2HD       PRO  16 -12.017  -7.343   9.279
  120    HD3  PRO  16          3HD       PRO  16 -13.344  -8.522   9.225
  121    H    VAL  17           HN       VAL  17 -16.480  -3.911   8.954
  122    HA   VAL  17           HA       VAL  17 -14.764  -1.822   8.133
  123    HB   VAL  17           HB       VAL  17 -17.494  -2.089   8.526
  124   HG11  VAL  17          1HG1      VAL  17 -16.421   0.002  10.418
  125   HG12  VAL  17          2HG1      VAL  17 -18.117  -0.224   9.985
  126   HG13  VAL  17          3HG1      VAL  17 -17.258  -1.481  10.875
  127   HG21  VAL  17          1HG2      VAL  17 -16.315   0.615   8.108
  128   HG22  VAL  17          2HG2      VAL  17 -15.960  -0.658   6.940
  129   HG23  VAL  17          3HG2      VAL  17 -17.631  -0.186   7.250
  130    H    GLU  18           HN       GLU  18 -15.094  -3.408  11.107
  131    HA   GLU  18           HA       GLU  18 -14.178  -1.140  12.689
  132    HB2  GLU  18          2HB       GLU  18 -14.740  -3.991  13.526
  133    HB3  GLU  18          3HB       GLU  18 -14.397  -2.648  14.607
  134    HG2  GLU  18          2HG       GLU  18 -16.538  -1.820  12.998
  135    HG3  GLU  18          3HG       GLU  18 -16.891  -3.479  13.476
  136    H    GLN  19           HN       GLN  19 -12.585  -2.664  10.559
  137    HA   GLN  19           HA       GLN  19 -10.136  -2.811  12.137
  138    HB2  GLN  19          2HB       GLN  19 -11.263  -5.062  10.492
  139    HB3  GLN  19          3HB       GLN  19  -9.534  -4.923  10.782
  140    HG2  GLN  19          2HG       GLN  19 -10.392  -4.703  13.295
  141    HG3  GLN  19          3HG       GLN  19 -11.720  -5.651  12.630
  142   HE21  GLN  19          1HE2      GLN  19 -10.722  -7.108  14.337
  143   HE22  GLN  19          2HE2      GLN  19  -9.515  -8.214  13.786
  144    H    MET  20           HN       MET  20 -11.418  -1.092  10.011
  145    HA   MET  20           HA       MET  20  -9.121  -1.099   8.173
  146    HB2  MET  20          2HB       MET  20 -11.844  -0.253   7.240
  147    HB3  MET  20          3HB       MET  20 -10.455  -0.756   6.286
  148    HG2  MET  20          2HG       MET  20 -11.260  -2.900   7.992
  149    HG3  MET  20          3HG       MET  20 -12.654  -2.298   7.099
  150    HE1  MET  20          1HE       MET  20 -11.556  -2.705   3.395
  151    HE2  MET  20          2HE       MET  20 -12.949  -2.521   4.460
  152    HE3  MET  20          3HE       MET  20 -11.678  -1.298   4.454
  153    H    THR  21           HN       THR  21  -9.324   1.116   6.824
  154    HA   THR  21           HA       THR  21  -9.977   3.297   8.676
  155    HB   THR  21           HB       THR  21  -7.307   2.860   7.342
  156    HG1  THR  21          1HG       THR  21  -8.275   3.022   9.980
  157   HG21  THR  21          1HG2      THR  21  -8.661   5.374   8.092
  158   HG22  THR  21          2HG2      THR  21  -7.373   5.085   6.922
  159   HG23  THR  21          3HG2      THR  21  -6.994   5.206   8.640
  160    H    THR  22           HN       THR  22 -10.582   5.215   7.712
  161    HA   THR  22           HA       THR  22 -11.325   5.009   4.909
  162    HB   THR  22           HB       THR  22 -12.010   7.005   7.061
  163    HG1  THR  22          1HG       THR  22 -13.297   4.881   5.752
  164   HG21  THR  22          1HG2      THR  22 -12.748   7.078   4.134
  165   HG22  THR  22          2HG2      THR  22 -11.783   8.267   5.010
  166   HG23  THR  22          3HG2      THR  22 -13.495   8.070   5.384
  167    H    ILE  23           HN       ILE  23 -10.988   6.858   3.451
  168    HA   ILE  23           HA       ILE  23  -8.253   7.593   3.348
  169    HB   ILE  23           HB       ILE  23 -10.630   8.535   1.751
  170   HG12  ILE  23          2HG1      ILE  23  -9.872   6.164   1.491
  171   HG13  ILE  23          3HG1      ILE  23  -9.753   7.113   0.013
  172   HG21  ILE  23          1HG2      ILE  23  -8.210   9.059   0.383
  173   HG22  ILE  23          2HG2      ILE  23  -9.422  10.210   0.945
  174   HG23  ILE  23          3HG2      ILE  23  -8.076   9.765   1.994
  175   HD11  ILE  23          1HD1      ILE  23  -7.615   6.595  -0.157
  176   HD12  ILE  23          2HD1      ILE  23  -7.293   7.316   1.420
  177   HD13  ILE  23          3HD1      ILE  23  -7.746   5.616   1.303
  178    H    ALA  24           HN       ALA  24 -10.753  10.028   2.914
  179    HA   ALA  24           HA       ALA  24 -10.714  11.489   5.182
  180    HB1  ALA  24          1HB       ALA  24  -8.540  11.945   5.524
  181    HB2  ALA  24          2HB       ALA  24  -8.108  11.661   3.838
  182    HB3  ALA  24          3HB       ALA  24  -8.809  13.207   4.320
  183    H    GLN  25           HN       GLN  25 -10.156  11.787   1.708
  184    HA   GLN  25           HA       GLN  25 -11.887  14.153   1.638
  185    HB2  GLN  25          2HB       GLN  25  -9.599  13.251   0.085
  186    HB3  GLN  25          3HB       GLN  25 -10.952  13.706  -0.942
  187    HG2  GLN  25          2HG       GLN  25  -9.328  15.536  -0.457
  188    HG3  GLN  25          3HG       GLN  25 -11.005  15.901  -0.055
  189   HE21  GLN  25          1HE2      GLN  25  -7.814  15.535   1.115
  190   HE22  GLN  25          2HE2      GLN  25  -8.132  15.920   2.768
  191    H    CYS  26           HN       CYS  26 -11.384  11.129  -0.184
  192    HA   CYS  26           HA       CYS  26 -14.007  11.296  -1.368
  193    HB2  CYS  26          2HB       CYS  26 -13.379   9.004  -2.272
  194    HB3  CYS  26          3HB       CYS  26 -12.337  10.338  -2.754
  195    H    GLN  27           HN       GLN  27 -12.530   9.727   1.359
  196    HA   GLN  27           HA       GLN  27 -13.469   8.661   3.147
  197    HB2  GLN  27          2HB       GLN  27 -16.172   8.818   1.846
  198    HB3  GLN  27          3HB       GLN  27 -15.777   8.781   3.559
  199    HG2  GLN  27          2HG       GLN  27 -14.606  11.075   2.257
  200    HG3  GLN  27          3HG       GLN  27 -16.352  11.014   2.023
  201   HE21  GLN  27          1HE2      GLN  27 -13.952  12.080   4.006
  202   HE22  GLN  27          2HE2      GLN  27 -14.854  12.289   5.464
  203    H    CYS  28           HN       CYS  28 -12.272   7.154   1.263
  204    HA   CYS  28           HA       CYS  28 -14.035   4.990   0.465
  205    HB2  CYS  28          2HB       CYS  28 -11.110   5.571   0.036
  206    HB3  CYS  28          3HB       CYS  28 -11.814   4.014  -0.390
  207    H    ILE  29           HN       ILE  29 -12.667   2.731   0.746
  208    HA   ILE  29           HA       ILE  29 -11.986   2.501   3.597
  209    HB   ILE  29           HB       ILE  29 -14.377   1.607   2.605
  210   HG12  ILE  29          2HG1      ILE  29 -12.965   0.182   4.850
  211   HG13  ILE  29          3HG1      ILE  29 -13.443   1.868   4.999
  212   HG21  ILE  29          1HG2      ILE  29 -14.254  -0.829   2.505
  213   HG22  ILE  29          2HG2      ILE  29 -13.271  -0.089   1.243
  214   HG23  ILE  29          3HG2      ILE  29 -12.501  -0.753   2.683
  215   HD11  ILE  29          1HD1      ILE  29 -15.070  -0.572   5.052
  216   HD12  ILE  29          2HD1      ILE  29 -15.317   0.982   5.849
  217   HD13  ILE  29          3HD1      ILE  29 -15.757   0.780   4.153
  218    H    PHE  30           HN       PHE  30 -10.131   1.470   3.934
  219    HA   PHE  30           HA       PHE  30  -9.281  -0.689   2.200
  220    HB2  PHE  30          2HB       PHE  30  -7.642   1.839   2.479
  221    HB3  PHE  30          3HB       PHE  30  -7.065   0.342   1.754
  222    HD1  PHE  30          1HD       PHE  30  -8.794   3.413   1.209
  223    HD2  PHE  30          2HD       PHE  30  -8.282  -0.534  -0.298
  224    HE1  PHE  30          1HE       PHE  30  -9.682   4.133  -0.969
  225    HE2  PHE  30          2HE       PHE  30  -9.169   0.180  -2.478
  226    HZ   PHE  30           HZ       PHE  30  -9.870   2.516  -2.817
  227    H    CYS  31           HN       CYS  31  -8.184  -2.195   3.307
  228    HA   CYS  31           HA       CYS  31  -8.000  -2.136   6.084
  229    HB2  CYS  31          2HB       CYS  31  -6.860  -4.211   5.935
  230    HB3  CYS  31          3HB       CYS  31  -7.958  -4.169   4.558
  231    H    THR  32           HN       THR  32  -6.634  -1.195   7.443
  232    HA   THR  32           HA       THR  32  -4.761   0.654   6.923
  233    HB   THR  32           HB       THR  32  -4.076  -1.294   9.089
  234    HG1  THR  32          1HG       THR  32  -6.425   0.279   8.896
  235   HG21  THR  32          1HG2      THR  32  -4.089   1.703   8.789
  236   HG22  THR  32          2HG2      THR  32  -2.704   0.637   9.025
  237   HG23  THR  32          3HG2      THR  32  -3.849   0.900  10.340
  238    H    LEU  33           HN       LEU  33  -4.060  -2.825   7.194
  239    HA   LEU  33           HA       LEU  33  -1.360  -2.878   6.873
  240    HB2  LEU  33          2HB       LEU  33  -3.515  -4.673   5.830
  241    HB3  LEU  33          3HB       LEU  33  -1.826  -4.994   5.442
  242    HG   LEU  33           HG       LEU  33  -2.456  -4.616   8.305
  243   HD11  LEU  33          1HD1      LEU  33  -4.325  -5.929   7.979
  244   HD12  LEU  33          2HD1      LEU  33  -3.083  -7.137   8.305
  245   HD13  LEU  33          3HD1      LEU  33  -3.595  -6.825   6.646
  246   HD21  LEU  33          1HD2      LEU  33  -1.000  -6.821   8.186
  247   HD22  LEU  33          2HD2      LEU  33  -0.273  -5.220   8.031
  248   HD23  LEU  33          3HD2      LEU  33  -0.603  -6.183   6.589
  249    H    CYS  34           HN       CYS  34  -3.768  -2.506   4.302
  250    HA   CYS  34           HA       CYS  34  -1.800  -2.375   2.218
  251    HB2  CYS  34          2HB       CYS  34  -4.768  -1.938   2.355
  252    HB3  CYS  34          3HB       CYS  34  -3.868  -1.481   0.912
  253    H    LEU  35           HN       LEU  35  -4.140   0.042   3.415
  254    HA   LEU  35           HA       LEU  35  -2.994   2.241   2.136
  255    HB2  LEU  35          2HB       LEU  35  -5.239   1.913   3.481
  256    HB3  LEU  35          3HB       LEU  35  -4.281   2.585   4.799
  257    HG   LEU  35           HG       LEU  35  -3.787   4.522   3.180
  258   HD11  LEU  35          1HD1      LEU  35  -5.007   2.998   1.341
  259   HD12  LEU  35          2HD1      LEU  35  -4.956   4.759   1.263
  260   HD13  LEU  35          3HD1      LEU  35  -6.384   3.946   1.903
  261   HD21  LEU  35          1HD2      LEU  35  -5.929   5.622   3.783
  262   HD22  LEU  35          2HD2      LEU  35  -5.147   4.812   5.140
  263   HD23  LEU  35          3HD2      LEU  35  -6.531   4.062   4.343
  264    H    LYS  36           HN       LYS  36  -1.769   0.400   4.668
  265    HA   LYS  36           HA       LYS  36  -0.216   2.566   5.844
  266    HB2  LYS  36          2HB       LYS  36  -1.125   0.929   7.376
  267    HB3  LYS  36          3HB       LYS  36  -0.374  -0.384   6.481
  268    HG2  LYS  36          2HG       LYS  36   1.783   1.154   7.083
  269    HG3  LYS  36          3HG       LYS  36   0.755   1.415   8.494
  270    HD2  LYS  36          2HD       LYS  36   0.591  -1.314   8.029
  271    HD3  LYS  36          3HD       LYS  36   2.284  -0.924   7.719
  272    HE2  LYS  36          2HE       LYS  36   1.952   0.458   9.973
  273    HE3  LYS  36          3HE       LYS  36   0.721  -0.776  10.235
  274    HZ1  LYS  36          1HZ       LYS  36   3.407  -1.602   9.386
  275    HZ2  LYS  36          2HZ       LYS  36   2.272  -2.438  10.321
  276    HZ3  LYS  36          3HZ       LYS  36   3.159  -1.169  11.003
  277    H    GLN  37           HN       GLN  37   0.542  -0.652   4.492
  278    HA   GLN  37           HA       GLN  37   3.281  -0.251   4.207
  279    HB2  GLN  37          2HB       GLN  37   1.452  -2.281   3.606
  280    HB3  GLN  37          3HB       GLN  37   2.223  -1.898   2.073
  281    HG2  GLN  37          2HG       GLN  37   4.015  -3.047   2.654
  282    HG3  GLN  37          3HG       GLN  37   4.229  -2.039   4.085
  283   HE21  GLN  37          1HE2      GLN  37   2.951  -2.643   5.994
  284   HE22  GLN  37          2HE2      GLN  37   2.663  -4.320   6.293
  285    H    TYR  38           HN       TYR  38   0.756   1.239   2.553
  286    HA   TYR  38           HA       TYR  38   2.355   1.775   0.164
  287    HB2  TYR  38          2HB       TYR  38   0.285   1.481  -0.700
  288    HB3  TYR  38          3HB       TYR  38  -0.512   1.837   0.828
  289    HD1  TYR  38          1HD       TYR  38   1.520   3.693  -1.711
  290    HD2  TYR  38          2HD       TYR  38  -1.907   3.663   0.809
  291    HE1  TYR  38          1HE       TYR  38   0.875   5.906  -2.572
  292    HE2  TYR  38          2HE       TYR  38  -2.562   5.875  -0.045
  293    HH   TYR  38           HH       TYR  38  -2.203   7.318  -1.887
  294    H    VAL  39           HN       VAL  39   0.552   3.584   2.648
  295    HA   VAL  39           HA       VAL  39   1.676   6.100   1.875
  296    HB   VAL  39           HB       VAL  39   0.453   7.069   3.634
  297   HG11  VAL  39          1HG1      VAL  39  -1.197   6.507   2.161
  298   HG12  VAL  39          2HG1      VAL  39  -0.882   4.776   2.294
  299   HG13  VAL  39          3HG1      VAL  39  -1.757   5.615   3.575
  300   HG21  VAL  39          1HG2      VAL  39   1.241   5.730   5.473
  301   HG22  VAL  39          2HG2      VAL  39  -0.523   5.736   5.487
  302   HG23  VAL  39          3HG2      VAL  39   0.348   4.326   4.886
  303    H    GLU  40           HN       GLU  40   2.163   3.904   4.630
  304    HA   GLU  40           HA       GLU  40   3.927   5.255   6.172
  305    HB2  GLU  40          2HB       GLU  40   3.081   2.798   6.321
  306    HB3  GLU  40          3HB       GLU  40   4.557   2.412   5.446
  307    HG2  GLU  40          2HG       GLU  40   5.162   4.145   7.642
  308    HG3  GLU  40          3HG       GLU  40   4.228   2.762   8.207
  309    H    LEU  41           HN       LEU  41   4.632   3.713   3.085
  310    HA   LEU  41           HA       LEU  41   7.450   4.207   3.214
  311    HB2  LEU  41          2HB       LEU  41   5.570   3.307   1.062
  312    HB3  LEU  41          3HB       LEU  41   7.249   3.695   0.696
  313    HG   LEU  41           HG       LEU  41   6.728   1.255   1.031
  314   HD11  LEU  41          1HD1      LEU  41   8.739   2.336   2.989
  315   HD12  LEU  41          2HD1      LEU  41   8.995   2.329   1.245
  316   HD13  LEU  41          3HD1      LEU  41   8.785   0.807   2.111
  317   HD21  LEU  41          1HD2      LEU  41   6.715   1.868   3.964
  318   HD22  LEU  41          2HD2      LEU  41   6.239   0.387   3.132
  319   HD23  LEU  41          3HD2      LEU  41   5.213   1.819   3.040
  320    H    LEU  42           HN       LEU  42   4.657   5.904   1.981
  321    HA   LEU  42           HA       LEU  42   6.285   7.878   0.606
  322    HB2  LEU  42          2HB       LEU  42   3.309   7.637   1.004
  323    HB3  LEU  42          3HB       LEU  42   4.085   8.932   0.095
  324    HG   LEU  42           HG       LEU  42   4.726   6.181  -0.766
  325   HD11  LEU  42          1HD1      LEU  42   2.697   5.564  -1.559
  326   HD12  LEU  42          2HD1      LEU  42   2.148   7.226  -1.773
  327   HD13  LEU  42          3HD1      LEU  42   2.144   6.495  -0.168
  328   HD21  LEU  42          1HD2      LEU  42   5.428   7.339  -2.520
  329   HD22  LEU  42          2HD2      LEU  42   4.859   8.831  -1.768
  330   HD23  LEU  42          3HD2      LEU  42   3.784   7.905  -2.817
  331    H    ILE  43           HN       ILE  43   3.686   8.103   3.043
  332    HA   ILE  43           HA       ILE  43   3.919  10.637   3.894
  333    HB   ILE  43           HB       ILE  43   3.055   8.179   5.130
  334   HG12  ILE  43          2HG1      ILE  43   1.437   9.768   6.214
  335   HG13  ILE  43          3HG1      ILE  43   2.329  11.095   5.476
  336   HG21  ILE  43          1HG2      ILE  43   4.761   8.462   6.762
  337   HG22  ILE  43          2HG2      ILE  43   4.422  10.186   6.908
  338   HG23  ILE  43          3HG2      ILE  43   3.251   9.004   7.494
  339   HD11  ILE  43          1HD1      ILE  43   1.609  10.567   3.352
  340   HD12  ILE  43          2HD1      ILE  43   1.250   8.892   3.778
  341   HD13  ILE  43          3HD1      ILE  43   0.195  10.190   4.336
  342    H    LYS  44           HN       LYS  44   6.258   8.109   4.425
  343    HA   LYS  44           HA       LYS  44   7.783   9.583   6.370
  344    HB2  LYS  44          2HB       LYS  44   7.813   6.924   5.215
  345    HB3  LYS  44          3HB       LYS  44   9.433   7.607   5.280
  346    HG2  LYS  44          2HG       LYS  44   8.837   6.279   7.274
  347    HG3  LYS  44          3HG       LYS  44   9.257   7.953   7.646
  348    HD2  LYS  44          2HD       LYS  44   7.364   7.735   8.910
  349    HD3  LYS  44          3HD       LYS  44   6.650   8.295   7.395
  350    HE2  LYS  44          2HE       LYS  44   5.506   6.400   7.154
  351    HE3  LYS  44          3HE       LYS  44   6.956   5.427   7.396
  352    HZ1  LYS  44          1HZ       LYS  44   6.274   6.414   9.882
  353    HZ2  LYS  44          2HZ       LYS  44   6.107   4.823   9.334
  354    HZ3  LYS  44          3HZ       LYS  44   4.817   5.906   9.187
  355    H    GLU  45           HN       GLU  45   8.056   8.861   2.915
  356    HA   GLU  45           HA       GLU  45  10.549  10.188   2.567
  357    HB2  GLU  45          2HB       GLU  45   8.874   8.580   1.003
  358    HB3  GLU  45          3HB       GLU  45   8.935  10.125   0.166
  359    HG2  GLU  45          2HG       GLU  45  10.837   9.444  -0.735
  360    HG3  GLU  45          3HG       GLU  45  11.568   9.633   0.858
  361    H    GLY  46           HN       GLY  46   7.171  11.151   2.155
  362    HA2  GLY  46          1HA       GLY  46   6.221  13.197   1.679
  363    HA3  GLY  46          2HA       GLY  46   7.419  13.785   2.822
  364    H    LEU  47           HN       LEU  47   7.179  12.791  -0.592
  365    HA   LEU  47           HA       LEU  47   9.186  14.825  -1.258
  366    HB2  LEU  47          2HB       LEU  47   9.448  13.678  -3.361
  367    HB3  LEU  47          3HB       LEU  47   9.606  12.537  -2.028
  368    HG   LEU  47           HG       LEU  47   7.033  12.848  -3.549
  369   HD11  LEU  47          1HD1      LEU  47   9.110  12.275  -4.984
  370   HD12  LEU  47          2HD1      LEU  47   7.662  11.278  -5.128
  371   HD13  LEU  47          3HD1      LEU  47   9.031  10.711  -4.170
  372   HD21  LEU  47          1HD2      LEU  47   6.379  11.463  -1.930
  373   HD22  LEU  47          2HD2      LEU  47   8.034  11.187  -1.385
  374   HD23  LEU  47          3HD2      LEU  47   7.373  10.238  -2.718
  375    H    GLU  48           HN       GLU  48   5.941  13.714  -2.136
  376    HA   GLU  48           HA       GLU  48   4.722  16.108  -2.460
  377    HB2  GLU  48          2HB       GLU  48   4.820  16.312  -5.048
  378    HB3  GLU  48          3HB       GLU  48   6.130  16.979  -4.085
  379    HG2  GLU  48          2HG       GLU  48   7.631  15.422  -4.785
  380    HG3  GLU  48          3HG       GLU  48   6.401  14.184  -5.032
  381    H    THR  49           HN       THR  49   5.135  12.857  -3.496
  382    HA   THR  49           HA       THR  49   3.135  12.163  -5.113
  383    HB   THR  49           HB       THR  49   3.630  10.772  -2.473
  384    HG1  THR  49          1HG       THR  49   4.812  10.336  -5.033
  385   HG21  THR  49          1HG2      THR  49   2.953   9.113  -4.755
  386   HG22  THR  49          2HG2      THR  49   1.672  10.264  -4.374
  387   HG23  THR  49          3HG2      THR  49   2.249   9.146  -3.139
  388    H    ALA  50           HN       ALA  50   2.710  13.375  -1.857
  389    HA   ALA  50           HA       ALA  50   0.881  14.138  -0.737
  390    HB1  ALA  50          1HB       ALA  50   0.505  15.028  -3.219
  391    HB2  ALA  50          2HB       ALA  50  -0.897  13.964  -3.099
  392    HB3  ALA  50          3HB       ALA  50  -0.680  15.271  -1.935
  393    H    ILE  51           HN       ILE  51   1.210  11.144  -1.855
  394    HA   ILE  51           HA       ILE  51   0.059   9.160  -1.704
  395    HB   ILE  51           HB       ILE  51  -0.705  10.455   0.915
  396   HG12  ILE  51          2HG1      ILE  51   1.232   9.261   1.817
  397   HG13  ILE  51          3HG1      ILE  51   1.577   8.590   0.227
  398   HG21  ILE  51          1HG2      ILE  51  -1.943   8.319   0.012
  399   HG22  ILE  51          2HG2      ILE  51  -0.475   7.510   0.558
  400   HG23  ILE  51          3HG2      ILE  51  -1.448   8.436   1.700
  401   HD11  ILE  51          1HD1      ILE  51   1.445  11.536   0.454
  402   HD12  ILE  51          2HD1      ILE  51   2.830  10.718   1.179
  403   HD13  ILE  51          3HD1      ILE  51   2.485  10.516  -0.539
  404    H    SER  52           HN       SER  52  -1.413   9.802  -3.457
  405    HA   SER  52           HA       SER  52  -4.043  10.752  -2.733
  406    HB2  SER  52          2HB       SER  52  -2.883  11.312  -4.908
  407    HB3  SER  52          3HB       SER  52  -3.157   9.641  -5.403
  408    HG   SER  52           HG       SER  52  -4.884  11.740  -5.358
  409    H    CYS  53           HN       CYS  53  -5.999   9.582  -3.092
  410    HA   CYS  53           HA       CYS  53  -6.361   7.239  -1.878
  411    HB2  CYS  53          2HB       CYS  53  -8.219   8.518  -2.802
  412    HB3  CYS  53          3HB       CYS  53  -7.747   8.064  -4.436
  413    HA   PRO  54           HA       PRO  54  -4.101   4.134  -4.057
  414    HB2  PRO  54          2HB       PRO  54  -5.261   1.961  -2.913
  415    HB3  PRO  54          3HB       PRO  54  -4.088   2.980  -2.069
  416    HG2  PRO  54          2HG       PRO  54  -7.075   2.989  -1.893
  417    HG3  PRO  54          3HG       PRO  54  -5.877   3.115  -0.592
  418    HD2  PRO  54          2HD       PRO  54  -7.173   5.271  -1.594
  419    HD3  PRO  54          3HD       PRO  54  -5.511   5.357  -0.977
  420    H    ASP  55           HN       ASP  55  -7.604   4.218  -3.992
  421    HA   ASP  55           HA       ASP  55  -8.272   2.176  -5.715
  422    HB2  ASP  55          2HB       ASP  55  -9.696   4.072  -4.478
  423    HB3  ASP  55          3HB       ASP  55  -9.685   4.765  -6.098
  424    H    ALA  56           HN       ALA  56  -8.739   2.121  -7.980
  425    HA   ALA  56           HA       ALA  56  -6.903   3.811  -9.534
  426    HB1  ALA  56          1HB       ALA  56  -7.241   1.054  -9.485
  427    HB2  ALA  56          2HB       ALA  56  -8.009   1.570 -10.987
  428    HB3  ALA  56          3HB       ALA  56  -6.326   1.988 -10.670
  429    H    ALA  57           HN       ALA  57 -10.018   3.846  -8.695
  430    HA   ALA  57           HA       ALA  57 -10.787   5.458 -10.937
  431    HB1  ALA  57          1HB       ALA  57 -11.305   2.741 -11.191
  432    HB2  ALA  57          2HB       ALA  57 -12.845   3.443 -10.693
  433    HB3  ALA  57          3HB       ALA  57 -12.024   4.048 -12.132
  434    H    CYS  58           HN       CYS  58 -10.523   5.829  -8.118
  435    HA   CYS  58           HA       CYS  58 -12.796   5.657  -6.590
  436    HB2  CYS  58          2HB       CYS  58 -10.617   6.505  -5.780
  437    HB3  CYS  58          3HB       CYS  58 -10.884   8.001  -6.671
  438    HA   PRO  59           HA       PRO  59 -15.797   8.127  -8.690
  439    HB2  PRO  59          2HB       PRO  59 -17.577   8.347  -6.651
  440    HB3  PRO  59          3HB       PRO  59 -17.368   6.863  -7.589
  441    HG2  PRO  59          2HG       PRO  59 -16.255   7.579  -4.904
  442    HG3  PRO  59          3HG       PRO  59 -16.968   6.049  -5.448
  443    HD2  PRO  59          2HD       PRO  59 -14.292   6.429  -5.276
  444    HD3  PRO  59          3HD       PRO  59 -15.031   5.374  -6.498
  445    H    LYS  60           HN       LYS  60 -14.092   9.092  -5.859
  446    HA   LYS  60           HA       LYS  60 -14.935  11.883  -6.294
  447    HB2  LYS  60          2HB       LYS  60 -14.109  10.529  -3.720
  448    HB3  LYS  60          3HB       LYS  60 -14.356  12.262  -3.890
  449    HG2  LYS  60          2HG       LYS  60 -16.583  10.527  -4.752
  450    HG3  LYS  60          3HG       LYS  60 -16.246  10.587  -3.021
  451    HD2  LYS  60          2HD       LYS  60 -16.305  13.094  -3.202
  452    HD3  LYS  60          3HD       LYS  60 -16.898  12.890  -4.852
  453    HE2  LYS  60          2HE       LYS  60 -18.809  11.610  -3.986
  454    HE3  LYS  60          3HE       LYS  60 -18.220  11.860  -2.343
  455    HZ1  LYS  60          1HZ       LYS  60 -18.445  14.269  -2.716
  456    HZ2  LYS  60          2HZ       LYS  60 -19.923  13.453  -2.827
  457    HZ3  LYS  60          3HZ       LYS  60 -19.130  13.961  -4.233
  458    H    GLN  61           HN       GLN  61 -12.404   9.682  -6.442
  459    HA   GLN  61           HA       GLN  61 -10.129   9.851  -6.597
  460    HB2  GLN  61          2HB       GLN  61 -11.085  12.354  -7.978
  461    HB3  GLN  61          3HB       GLN  61  -9.398  11.863  -7.976
  462    HG2  GLN  61          2HG       GLN  61 -10.763   9.590  -8.771
  463    HG3  GLN  61          3HG       GLN  61 -11.603  10.912  -9.581
  464   HE21  GLN  61          1HE2      GLN  61 -10.708   9.720 -11.468
  465   HE22  GLN  61          2HE2      GLN  61  -9.130  10.162 -12.018
  466    H    GLY  62           HN       GLY  62 -10.676  10.360  -4.077
  467    HA2  GLY  62          1HA       GLY  62  -9.699  12.970  -3.273
  468    HA3  GLY  62          2HA       GLY  62 -10.224  11.676  -2.206
  469    H    HIS  63           HN       HIS  63  -8.003  13.096  -1.550
  470    HA   HIS  63           HA       HIS  63  -5.858  11.133  -2.010
  471    HB2  HIS  63          2HB       HIS  63  -4.487  12.698  -2.828
  472    HB3  HIS  63          3HB       HIS  63  -5.847  13.818  -2.843
  473    HD1  HIS  63          1HD       HIS  63  -6.156  14.506   0.074
  474    HD2  HIS  63          2HD       HIS  63  -2.454  14.139  -1.776
  475    HE1  HIS  63          1HE       HIS  63  -4.561  15.843   1.488
  476    H    LEU  64           HN       LEU  64  -4.099  11.347  -0.302
  477    HA   LEU  64           HA       LEU  64  -5.388  11.735   2.315
  478    HB2  LEU  64          2HB       LEU  64  -3.140   9.921   1.462
  479    HB3  LEU  64          3HB       LEU  64  -3.598  10.182   3.145
  480    HG   LEU  64           HG       LEU  64  -5.731   9.280   1.295
  481   HD11  LEU  64          1HD1      LEU  64  -4.222   7.745   0.477
  482   HD12  LEU  64          2HD1      LEU  64  -4.891   6.883   1.862
  483   HD13  LEU  64          3HD1      LEU  64  -3.317   7.666   1.989
  484   HD21  LEU  64          1HD2      LEU  64  -5.562   7.760   3.655
  485   HD22  LEU  64          2HD2      LEU  64  -6.718   9.036   3.267
  486   HD23  LEU  64          3HD2      LEU  64  -5.217   9.430   4.108
  487    H    GLN  65           HN       GLN  65  -4.003  12.475   4.080
  488    HA   GLN  65           HA       GLN  65  -2.246  14.607   3.167
  489    HB2  GLN  65          2HB       GLN  65  -2.546  14.341   6.052
  490    HB3  GLN  65          3HB       GLN  65  -2.893  15.714   5.009
  491    HG2  GLN  65          2HG       GLN  65  -4.959  15.233   5.895
  492    HG3  GLN  65          3HG       GLN  65  -5.005  14.378   4.354
  493   HE21  GLN  65          1HE2      GLN  65  -3.032  12.422   5.611
  494   HE22  GLN  65          2HE2      GLN  65  -4.039  11.363   6.532
  495    H    GLU  66           HN       GLU  66  -0.297  15.031   4.686
  496    HA   GLU  66           HA       GLU  66   1.302  12.595   4.660
  497    HB2  GLU  66          2HB       GLU  66   1.847  15.491   4.528
  498    HB3  GLU  66          3HB       GLU  66   3.025  14.552   5.435
  499    HG2  GLU  66          2HG       GLU  66   3.896  13.658   3.593
  500    HG3  GLU  66          3HG       GLU  66   2.313  13.332   2.892
  501    H    ASN  67           HN       ASN  67   0.214  15.091   6.909
  502    HA   ASN  67           HA       ASN  67   1.595  13.930   9.151
  503    HB2  ASN  67          2HB       ASN  67  -0.038  15.603  10.380
  504    HB3  ASN  67          3HB       ASN  67   1.352  16.200   9.477
  505   HD21  ASN  67          1HD2      ASN  67  -1.932  16.459   9.930
  506   HD22  ASN  67          2HD2      ASN  67  -2.332  17.342   8.500
  507    H    GLU  68           HN       GLU  68  -1.881  14.542   8.623
  508    HA   GLU  68           HA       GLU  68  -3.008  13.086  10.574
  509    HB2  GLU  68          2HB       GLU  68  -3.829  13.972   7.986
  510    HB3  GLU  68          3HB       GLU  68  -4.448  12.346   8.238
  511    HG2  GLU  68          2HG       GLU  68  -4.787  14.231  10.479
  512    HG3  GLU  68          3HG       GLU  68  -5.727  14.561   9.025
  513    H    ILE  69           HN       ILE  69  -1.701  11.737   7.573
  514    HA   ILE  69           HA       ILE  69  -2.422   9.049   8.154
  515    HB   ILE  69           HB       ILE  69  -0.492  10.281   6.207
  516   HG12  ILE  69          2HG1      ILE  69  -3.269   9.393   6.194
  517   HG13  ILE  69          3HG1      ILE  69  -2.421  10.440   5.061
  518   HG21  ILE  69          1HG2      ILE  69  -1.024   7.336   6.587
  519   HG22  ILE  69          2HG2      ILE  69  -0.087   8.057   5.279
  520   HG23  ILE  69          3HG2      ILE  69   0.489   8.171   6.941
  521   HD11  ILE  69          1HD1      ILE  69  -3.345   8.407   4.021
  522   HD12  ILE  69          2HD1      ILE  69  -1.594   8.534   3.853
  523   HD13  ILE  69          3HD1      ILE  69  -2.288   7.435   5.044
  524    H    GLU  70           HN       GLU  70   0.805  10.575   8.064
  525    HA   GLU  70           HA       GLU  70   2.275   8.544   9.173
  526    HB2  GLU  70          2HB       GLU  70   3.973  10.065   9.428
  527    HB3  GLU  70          3HB       GLU  70   2.932  10.962   8.331
  528    HG2  GLU  70          2HG       GLU  70   2.039  12.254  10.146
  529    HG3  GLU  70          3HG       GLU  70   2.919  11.280  11.322
  530    H    CYS  71           HN       CYS  71  -0.116  10.457  10.694
  531    HA   CYS  71           HA       CYS  71   0.806  10.176  13.382
  532    HB2  CYS  71          2HB       CYS  71  -1.039  11.768  12.202
  533    HB3  CYS  71          3HB       CYS  71  -2.090  10.549  12.911
  534    HG   CYS  71           HG       CYS  71  -0.251  12.930  14.416
  535    H    MET  72           HN       MET  72  -1.338   8.356  11.274
  536    HA   MET  72           HA       MET  72  -2.145   6.558  13.394
  537    HB2  MET  72          2HB       MET  72  -3.681   5.695  11.913
  538    HB3  MET  72          3HB       MET  72  -3.488   7.320  11.266
  539    HG2  MET  72          2HG       MET  72  -1.548   5.973   9.925
  540    HG3  MET  72          3HG       MET  72  -2.784   4.730  10.104
  541    HE1  MET  72          1HE       MET  72  -3.272   4.509   7.479
  542    HE2  MET  72          2HE       MET  72  -3.341   5.923   6.427
  543    HE3  MET  72          3HE       MET  72  -1.863   5.558   7.320
  544    H    VAL  73           HN       VAL  73   0.683   6.904  11.978
  545    HA   VAL  73           HA       VAL  73   1.255   4.023  12.035
  546    HB   VAL  73           HB       VAL  73   3.080   4.856  10.214
  547   HG11  VAL  73          1HG1      VAL  73   0.355   4.006   9.300
  548   HG12  VAL  73          2HG1      VAL  73   1.937   3.530   8.679
  549   HG13  VAL  73          3HG1      VAL  73   1.379   2.919  10.238
  550   HG21  VAL  73          1HG2      VAL  73   0.668   6.137   9.077
  551   HG22  VAL  73          2HG2      VAL  73   1.553   7.056  10.296
  552   HG23  VAL  73          3HG2      VAL  73   2.375   6.511   8.834
  553    H    ALA  74           HN       ALA  74   3.158   6.975  11.440
  554    HA   ALA  74           HA       ALA  74   5.168   6.067  13.322
  555    HB1  ALA  74          1HB       ALA  74   5.060   7.922  11.091
  556    HB2  ALA  74          2HB       ALA  74   5.927   8.582  12.479
  557    HB3  ALA  74          3HB       ALA  74   6.433   7.048  11.771
  558    H    ALA  75           HN       ALA  75   2.560   6.796  14.372
  559    HA   ALA  75           HA       ALA  75   2.337   9.304  15.476
  560    HB1  ALA  75          1HB       ALA  75   0.550   8.385  16.415
  561    HB2  ALA  75          2HB       ALA  75   1.093   6.811  15.833
  562    HB3  ALA  75          3HB       ALA  75   1.561   7.367  17.439
  Start of MODEL   17
    1    H1   ALA   1           HN       ALA   1 -21.835 -21.103   7.987
    2    HA   ALA   1           HA       ALA   1 -21.271 -22.103   6.015
    3    HB1  ALA   1          1HB       ALA   1 -22.950 -21.910   4.220
    4    HB2  ALA   1          2HB       ALA   1 -23.675 -22.218   5.799
    5    HB3  ALA   1          3HB       ALA   1 -23.720 -20.595   5.109
    6    H    LEU   2           HN       LEU   2 -19.448 -21.543   5.028
    7    HA   LEU   2           HA       LEU   2 -17.867 -20.314   3.929
    8    HB2  LEU   2          2HB       LEU   2 -20.121 -19.268   2.252
    9    HB3  LEU   2          3HB       LEU   2 -18.470 -19.648   1.767
   10    HG   LEU   2           HG       LEU   2 -20.247 -21.857   2.696
   11   HD11  LEU   2          1HD1      LEU   2 -20.729 -20.172   0.366
   12   HD12  LEU   2          2HD1      LEU   2 -21.771 -21.365   1.140
   13   HD13  LEU   2          3HD1      LEU   2 -20.554 -21.882  -0.026
   14   HD21  LEU   2          1HD2      LEU   2 -18.343 -21.914   0.397
   15   HD22  LEU   2          2HD2      LEU   2 -18.820 -23.210   1.494
   16   HD23  LEU   2          3HD2      LEU   2 -17.723 -21.944   2.048
   17    H    ASP   3           HN       ASP   3 -17.875 -18.972   5.988
   18    HA   ASP   3           HA       ASP   3 -19.040 -16.659   6.576
   19    HB2  ASP   3          2HB       ASP   3 -16.702 -17.782   7.347
   20    HB3  ASP   3          3HB       ASP   3 -16.096 -16.371   6.485
   21    HA   PRO   4           HA       PRO   4 -18.624 -14.566   2.563
   22    HB2  PRO   4          2HB       PRO   4 -20.759 -12.936   2.963
   23    HB3  PRO   4          3HB       PRO   4 -20.915 -14.600   2.386
   24    HG2  PRO   4          2HG       PRO   4 -21.275 -13.511   5.151
   25    HG3  PRO   4          3HG       PRO   4 -22.262 -14.698   4.279
   26    HD2  PRO   4          2HD       PRO   4 -20.432 -15.413   6.142
   27    HD3  PRO   4          3HD       PRO   4 -20.810 -16.428   4.736
   28    H    LEU   5           HN       LEU   5 -16.623 -13.760   3.783
   29    HA   LEU   5           HA       LEU   5 -17.039 -10.949   4.563
   30    HB2  LEU   5          2HB       LEU   5 -15.270 -13.064   5.690
   31    HB3  LEU   5          3HB       LEU   5 -14.733 -11.387   5.742
   32    HG   LEU   5           HG       LEU   5 -17.306 -12.396   6.947
   33   HD11  LEU   5          1HD1      LEU   5 -16.277 -12.708   8.939
   34   HD12  LEU   5          2HD1      LEU   5 -15.058 -11.471   8.630
   35   HD13  LEU   5          3HD1      LEU   5 -14.903 -13.065   7.892
   36   HD21  LEU   5          1HD2      LEU   5 -17.842 -10.252   7.120
   37   HD22  LEU   5          2HD2      LEU   5 -16.328  -9.782   6.348
   38   HD23  LEU   5          3HD2      LEU   5 -16.399  -9.988   8.099
   39    H    VAL   6           HN       VAL   6 -15.859  -9.424   3.543
   40    HA   VAL   6           HA       VAL   6 -13.366  -9.682   2.376
   41    HB   VAL   6           HB       VAL   6 -14.190 -11.259   0.799
   42   HG11  VAL   6          1HG1      VAL   6 -16.285 -11.330   0.045
   43   HG12  VAL   6          2HG1      VAL   6 -16.631  -9.995   1.145
   44   HG13  VAL   6          3HG1      VAL   6 -16.209  -9.668  -0.536
   45   HG21  VAL   6          1HG2      VAL   6 -14.152  -8.580  -0.585
   46   HG22  VAL   6          2HG2      VAL   6 -12.717  -9.473  -0.081
   47   HG23  VAL   6          3HG2      VAL   6 -13.791 -10.148  -1.305
   48    H    SER   7           HN       SER   7 -12.848  -7.617   2.706
   49    HA   SER   7           HA       SER   7 -14.588  -5.551   1.532
   50    HB2  SER   7          2HB       SER   7 -12.923  -5.073   3.996
   51    HB3  SER   7          3HB       SER   7 -14.275  -4.122   3.382
   52    HG   SER   7           HG       SER   7 -15.467  -5.282   4.649
   53    H    CYS   8           HN       CYS   8 -12.739  -3.450   2.330
   54    HA   CYS   8           HA       CYS   8 -11.024  -2.269   1.413
   55    HB2  CYS   8          2HB       CYS   8  -9.538  -3.643   2.623
   56    HB3  CYS   8          3HB       CYS   8  -9.839  -5.031   1.582
   57    H    LYS   9           HN       LYS   9  -9.740  -1.898  -0.564
   58    HA   LYS   9           HA       LYS   9 -10.702  -3.401  -2.894
   59    HB2  LYS   9          2HB       LYS   9 -10.429  -0.530  -3.392
   60    HB3  LYS   9          3HB       LYS   9 -11.704  -1.642  -3.877
   61    HG2  LYS   9          2HG       LYS   9 -12.805  -1.410  -1.775
   62    HG3  LYS   9          3HG       LYS   9 -11.453  -0.492  -1.108
   63    HD2  LYS   9          2HD       LYS   9 -11.884   1.325  -2.648
   64    HD3  LYS   9          3HD       LYS   9 -13.164   0.396  -3.430
   65    HE2  LYS   9          2HE       LYS   9 -13.249   1.041  -0.500
   66    HE3  LYS   9          3HE       LYS   9 -13.841   2.176  -1.711
   67    HZ1  LYS   9          1HZ       LYS   9 -15.002  -0.180  -2.412
   68    HZ2  LYS   9          2HZ       LYS   9 -15.750   1.072  -1.556
   69    HZ3  LYS   9          3HZ       LYS   9 -15.052  -0.223  -0.721
   70    H    LEU  10           HN       LEU  10  -8.270  -3.880  -1.856
   71    HA   LEU  10           HA       LEU  10  -6.507  -2.829  -3.927
   72    HB2  LEU  10          2HB       LEU  10  -6.016  -2.597  -0.974
   73    HB3  LEU  10          3HB       LEU  10  -4.698  -2.581  -2.144
   74    HG   LEU  10           HG       LEU  10  -6.970  -0.612  -2.250
   75   HD11  LEU  10          1HD1      LEU  10  -4.299  -0.074  -0.990
   76   HD12  LEU  10          2HD1      LEU  10  -5.694  -0.600  -0.048
   77   HD13  LEU  10          3HD1      LEU  10  -5.758   0.915  -0.948
   78   HD21  LEU  10          1HD2      LEU  10  -5.813   0.415  -3.893
   79   HD22  LEU  10          2HD2      LEU  10  -5.122  -1.193  -4.117
   80   HD23  LEU  10          3HD2      LEU  10  -4.246   0.022  -3.184
   81    H    CYS  11           HN       CYS  11  -7.079  -5.118  -1.318
   82    HA   CYS  11           HA       CYS  11  -5.335  -7.039  -2.715
   83    HB2  CYS  11          2HB       CYS  11  -4.702  -8.006  -0.602
   84    HB3  CYS  11          3HB       CYS  11  -4.409  -6.271  -0.520
   85    H    LEU  12           HN       LEU  12  -8.437  -6.300  -1.623
   86    HA   LEU  12           HA       LEU  12 -10.392  -7.460  -1.453
   87    HB2  LEU  12          2HB       LEU  12  -9.306  -9.547  -3.277
   88    HB3  LEU  12          3HB       LEU  12 -10.899  -8.792  -3.255
   89    HG   LEU  12           HG       LEU  12 -10.073  -7.866  -5.161
   90   HD11  LEU  12          1HD1      LEU  12  -9.882  -5.658  -4.754
   91   HD12  LEU  12          2HD1      LEU  12  -8.575  -5.872  -3.592
   92   HD13  LEU  12          3HD1      LEU  12 -10.245  -6.150  -3.098
   93   HD21  LEU  12          1HD2      LEU  12  -7.371  -7.145  -4.612
   94   HD22  LEU  12          2HD2      LEU  12  -7.994  -8.285  -5.806
   95   HD23  LEU  12          3HD2      LEU  12  -7.610  -8.836  -4.174
   96    H    GLY  13           HN       GLY  13  -9.382  -7.985   0.771
   97    HA2  GLY  13          1HA       GLY  13  -9.027 -10.901   1.042
   98    HA3  GLY  13          2HA       GLY  13  -8.433  -9.706   2.185
   99    H    GLU  14           HN       GLU  14  -9.697  -9.101   3.861
  100    HA   GLU  14           HA       GLU  14 -12.438  -9.029   4.023
  101    HB2  GLU  14          2HB       GLU  14 -12.626 -11.241   5.489
  102    HB3  GLU  14          3HB       GLU  14 -12.903 -11.246   3.753
  103    HG2  GLU  14          2HG       GLU  14 -10.923 -12.309   3.297
  104    HG3  GLU  14          3HG       GLU  14 -10.154 -11.745   4.779
  105    H    TYR  15           HN       TYR  15 -12.718  -7.720   5.692
  106    HA   TYR  15           HA       TYR  15 -11.623  -8.319   8.282
  107    HB2  TYR  15          2HB       TYR  15 -10.858  -5.595   7.380
  108    HB3  TYR  15          3HB       TYR  15 -10.046  -6.680   8.505
  109    HD1  TYR  15          1HD       TYR  15  -8.509  -8.399   7.685
  110    HD2  TYR  15          2HD       TYR  15 -10.382  -5.666   5.014
  111    HE1  TYR  15          1HE       TYR  15  -6.894  -9.012   5.934
  112    HE2  TYR  15          2HE       TYR  15  -8.772  -6.272   3.256
  113    HH   TYR  15           HH       TYR  15  -5.940  -7.880   3.832
  114    HA   PRO  16           HA       PRO  16 -15.200  -6.160   9.623
  115    HB2  PRO  16          2HB       PRO  16 -14.381  -5.188  12.023
  116    HB3  PRO  16          3HB       PRO  16 -14.714  -6.902  11.742
  117    HG2  PRO  16          2HG       PRO  16 -12.088  -5.465  11.785
  118    HG3  PRO  16          3HG       PRO  16 -12.517  -7.034  12.493
  119    HD2  PRO  16          2HD       PRO  16 -11.187  -6.810  10.145
  120    HD3  PRO  16          3HD       PRO  16 -12.315  -8.139  10.481
  121    H    VAL  17           HN       VAL  17 -16.098  -4.068  10.068
  122    HA   VAL  17           HA       VAL  17 -14.929  -1.976   8.583
  123    HB   VAL  17           HB       VAL  17 -17.440  -2.462   9.516
  124   HG11  VAL  17          1HG1      VAL  17 -16.595  -1.575  11.763
  125   HG12  VAL  17          2HG1      VAL  17 -16.609   0.013  10.995
  126   HG13  VAL  17          3HG1      VAL  17 -18.104  -0.912  11.136
  127   HG21  VAL  17          1HG2      VAL  17 -16.866   0.360   8.852
  128   HG22  VAL  17          2HG2      VAL  17 -16.327  -0.849   7.688
  129   HG23  VAL  17          3HG2      VAL  17 -18.029  -0.760   8.141
  130    H    GLU  18           HN       GLU  18 -14.123  -3.106  11.595
  131    HA   GLU  18           HA       GLU  18 -13.292  -0.481  12.602
  132    HB2  GLU  18          2HB       GLU  18 -14.374  -1.598  14.333
  133    HB3  GLU  18          3HB       GLU  18 -13.705  -3.160  13.877
  134    HG2  GLU  18          2HG       GLU  18 -12.727  -2.396  15.946
  135    HG3  GLU  18          3HG       GLU  18 -11.506  -2.448  14.676
  136    H    GLN  19           HN       GLN  19 -12.095  -3.058  10.849
  137    HA   GLN  19           HA       GLN  19  -9.347  -2.683  11.801
  138    HB2  GLN  19          2HB       GLN  19 -10.788  -4.863  10.391
  139    HB3  GLN  19          3HB       GLN  19  -9.093  -4.637   9.979
  140    HG2  GLN  19          2HG       GLN  19  -8.424  -4.982  12.245
  141    HG3  GLN  19          3HG       GLN  19 -10.100  -4.986  12.790
  142   HE21  GLN  19          1HE2      GLN  19  -8.306  -6.610  10.192
  143   HE22  GLN  19          2HE2      GLN  19  -8.830  -8.205  10.595
  144    H    MET  20           HN       MET  20 -11.420  -1.536   9.462
  145    HA   MET  20           HA       MET  20  -9.307  -1.117   7.477
  146    HB2  MET  20          2HB       MET  20 -12.036  -0.081   6.980
  147    HB3  MET  20          3HB       MET  20 -10.931  -0.912   5.893
  148    HG2  MET  20          2HG       MET  20 -11.523  -2.922   7.573
  149    HG3  MET  20          3HG       MET  20 -13.016  -1.990   7.667
  150    HE1  MET  20          1HE       MET  20 -10.429  -3.670   5.463
  151    HE2  MET  20          2HE       MET  20 -11.247  -3.983   3.932
  152    HE3  MET  20          3HE       MET  20 -10.690  -2.353   4.318
  153    H    THR  21           HN       THR  21  -9.456   1.119   6.369
  154    HA   THR  21           HA       THR  21  -9.881   3.229   8.373
  155    HB   THR  21           HB       THR  21  -7.406   2.807   6.700
  156    HG1  THR  21          1HG       THR  21  -6.886   1.979   8.590
  157   HG21  THR  21          1HG2      THR  21  -6.633   4.994   7.439
  158   HG22  THR  21          2HG2      THR  21  -8.163   5.271   8.273
  159   HG23  THR  21          3HG2      THR  21  -8.126   5.156   6.514
  160    H    THR  22           HN       THR  22 -10.881   5.000   7.622
  161    HA   THR  22           HA       THR  22 -11.821   5.013   4.900
  162    HB   THR  22           HB       THR  22 -12.247   6.964   7.167
  163    HG1  THR  22          1HG       THR  22 -13.232   4.754   7.147
  164   HG21  THR  22          1HG2      THR  22 -12.459   8.206   5.130
  165   HG22  THR  22          2HG2      THR  22 -14.086   7.854   5.714
  166   HG23  THR  22          3HG2      THR  22 -13.405   6.920   4.382
  167    H    ILE  23           HN       ILE  23 -11.697   6.990   3.553
  168    HA   ILE  23           HA       ILE  23  -8.984   8.116   3.678
  169    HB   ILE  23           HB       ILE  23 -10.871   7.996   1.322
  170   HG12  ILE  23          2HG1      ILE  23 -10.067   5.771   1.989
  171   HG13  ILE  23          3HG1      ILE  23  -9.363   6.267   0.453
  172   HG21  ILE  23          1HG2      ILE  23  -8.186   9.191   1.751
  173   HG22  ILE  23          2HG2      ILE  23  -8.524   8.441   0.192
  174   HG23  ILE  23          3HG2      ILE  23  -9.537   9.763   0.772
  175   HD11  ILE  23          1HD1      ILE  23  -7.559   5.370   1.553
  176   HD12  ILE  23          2HD1      ILE  23  -7.392   7.085   1.931
  177   HD13  ILE  23          3HD1      ILE  23  -8.075   5.981   3.124
  178    H    ALA  24           HN       ALA  24  -9.071   9.970   4.810
  179    HA   ALA  24           HA       ALA  24 -11.248  11.721   4.976
  180    HB1  ALA  24          1HB       ALA  24  -9.052  13.322   5.424
  181    HB2  ALA  24          2HB       ALA  24  -9.894  12.352   6.633
  182    HB3  ALA  24          3HB       ALA  24  -8.466  11.707   5.825
  183    H    GLN  25           HN       GLN  25 -11.860  11.780   2.676
  184    HA   GLN  25           HA       GLN  25 -11.475  14.196   1.476
  185    HB2  GLN  25          2HB       GLN  25  -9.176  12.505   1.090
  186    HB3  GLN  25          3HB       GLN  25  -9.936  12.847  -0.458
  187    HG2  GLN  25          2HG       GLN  25  -9.053  14.904   1.554
  188    HG3  GLN  25          3HG       GLN  25  -8.189  14.462   0.081
  189   HE21  GLN  25          1HE2      GLN  25 -10.396  16.554   1.439
  190   HE22  GLN  25          2HE2      GLN  25 -11.055  17.226  -0.009
  191    H    CYS  26           HN       CYS  26 -11.294  10.840   0.274
  192    HA   CYS  26           HA       CYS  26 -13.548  11.417  -1.509
  193    HB2  CYS  26          2HB       CYS  26 -12.925   9.295  -2.627
  194    HB3  CYS  26          3HB       CYS  26 -11.601  10.456  -2.596
  195    H    GLN  27           HN       GLN  27 -12.651   9.583   1.288
  196    HA   GLN  27           HA       GLN  27 -13.953   8.473   2.806
  197    HB2  GLN  27          2HB       GLN  27 -16.335   8.814   1.001
  198    HB3  GLN  27          3HB       GLN  27 -16.306   8.619   2.748
  199    HG2  GLN  27          2HG       GLN  27 -15.029  11.008   1.502
  200    HG3  GLN  27          3HG       GLN  27 -16.779  10.945   1.701
  201   HE21  GLN  27          1HE2      GLN  27 -13.946  11.875   3.108
  202   HE22  GLN  27          2HE2      GLN  27 -14.466  11.978   4.752
  203    H    CYS  28           HN       CYS  28 -12.460   6.875   1.516
  204    HA   CYS  28           HA       CYS  28 -14.142   4.791   0.294
  205    HB2  CYS  28          2HB       CYS  28 -11.229   5.479  -0.037
  206    HB3  CYS  28          3HB       CYS  28 -11.868   3.913  -0.525
  207    H    ILE  29           HN       ILE  29 -12.682   2.577   0.551
  208    HA   ILE  29           HA       ILE  29 -12.081   2.290   3.413
  209    HB   ILE  29           HB       ILE  29 -14.407   1.332   2.312
  210   HG12  ILE  29          2HG1      ILE  29 -12.995  -0.020   4.609
  211   HG13  ILE  29          3HG1      ILE  29 -13.637   1.614   4.738
  212   HG21  ILE  29          1HG2      ILE  29 -14.182  -1.099   2.198
  213   HG22  ILE  29          2HG2      ILE  29 -13.187  -0.306   0.978
  214   HG23  ILE  29          3HG2      ILE  29 -12.442  -0.952   2.439
  215   HD11  ILE  29          1HD1      ILE  29 -15.745   0.896   4.926
  216   HD12  ILE  29          2HD1      ILE  29 -15.534  -0.361   3.707
  217   HD13  ILE  29          3HD1      ILE  29 -14.997  -0.640   5.363
  218    H    PHE  30           HN       PHE  30 -10.211   1.297   3.785
  219    HA   PHE  30           HA       PHE  30  -9.233  -0.769   2.006
  220    HB2  PHE  30          2HB       PHE  30  -7.667   1.782   2.442
  221    HB3  PHE  30          3HB       PHE  30  -7.048   0.337   1.652
  222    HD1  PHE  30          1HD       PHE  30  -7.974  -0.370  -0.529
  223    HD2  PHE  30          2HD       PHE  30  -9.052   3.322   1.293
  224    HE1  PHE  30          1HE       PHE  30  -8.830   0.442  -2.689
  225    HE2  PHE  30          2HE       PHE  30  -9.910   4.140  -0.862
  226    HZ   PHE  30           HZ       PHE  30  -9.801   2.699  -2.857
  227    H    CYS  31           HN       CYS  31  -8.286  -2.316   3.162
  228    HA   CYS  31           HA       CYS  31  -8.112  -2.258   5.940
  229    HB2  CYS  31          2HB       CYS  31  -7.063  -4.382   5.799
  230    HB3  CYS  31          3HB       CYS  31  -8.151  -4.295   4.417
  231    H    THR  32           HN       THR  32  -6.685  -1.443   7.324
  232    HA   THR  32           HA       THR  32  -4.788   0.371   6.903
  233    HB   THR  32           HB       THR  32  -4.207  -1.849   8.860
  234    HG1  THR  32          1HG       THR  32  -6.241   0.110   8.878
  235   HG21  THR  32          1HG2      THR  32  -3.741   1.136   8.921
  236   HG22  THR  32          2HG2      THR  32  -2.513  -0.110   8.694
  237   HG23  THR  32          3HG2      THR  32  -3.365   0.019  10.233
  238    H    LEU  33           HN       LEU  33  -4.115  -3.124   6.830
  239    HA   LEU  33           HA       LEU  33  -1.441  -3.185   6.381
  240    HB2  LEU  33          2HB       LEU  33  -3.696  -4.840   5.377
  241    HB3  LEU  33          3HB       LEU  33  -2.099  -5.102   4.678
  242    HG   LEU  33           HG       LEU  33  -2.825  -6.605   6.616
  243   HD11  LEU  33          1HD1      LEU  33  -0.622  -6.868   6.070
  244   HD12  LEU  33          2HD1      LEU  33  -0.462  -6.229   7.705
  245   HD13  LEU  33          3HD1      LEU  33  -0.240  -5.163   6.318
  246   HD21  LEU  33          1HD2      LEU  33  -2.303  -4.024   8.073
  247   HD22  LEU  33          2HD2      LEU  33  -2.236  -5.604   8.855
  248   HD23  LEU  33          3HD2      LEU  33  -3.744  -5.038   8.136
  249    H    CYS  34           HN       CYS  34  -3.916  -2.733   3.863
  250    HA   CYS  34           HA       CYS  34  -1.978  -2.281   1.803
  251    HB2  CYS  34          2HB       CYS  34  -4.965  -1.819   1.889
  252    HB3  CYS  34          3HB       CYS  34  -3.975  -1.613   0.448
  253    H    LEU  35           HN       LEU  35  -4.483  -0.130   3.162
  254    HA   LEU  35           HA       LEU  35  -3.608   2.240   2.067
  255    HB2  LEU  35          2HB       LEU  35  -5.578   1.509   3.804
  256    HB3  LEU  35          3HB       LEU  35  -4.533   2.479   4.839
  257    HG   LEU  35           HG       LEU  35  -5.666   3.455   2.222
  258   HD11  LEU  35          1HD1      LEU  35  -7.058   2.970   4.613
  259   HD12  LEU  35          2HD1      LEU  35  -7.607   3.880   3.205
  260   HD13  LEU  35          3HD1      LEU  35  -6.797   4.713   4.532
  261   HD21  LEU  35          1HD2      LEU  35  -3.963   4.902   2.610
  262   HD22  LEU  35          2HD2      LEU  35  -3.942   4.591   4.346
  263   HD23  LEU  35          3HD2      LEU  35  -5.173   5.650   3.654
  264    H    LYS  36           HN       LYS  36  -2.072   0.336   4.434
  265    HA   LYS  36           HA       LYS  36  -0.477   2.542   5.477
  266    HB2  LYS  36          2HB       LYS  36  -1.237   0.872   7.072
  267    HB3  LYS  36          3HB       LYS  36  -0.486  -0.410   6.132
  268    HG2  LYS  36          2HG       LYS  36   1.351   1.721   6.934
  269    HG3  LYS  36          3HG       LYS  36   0.637   0.825   8.277
  270    HD2  LYS  36          2HD       LYS  36   1.282  -1.232   6.699
  271    HD3  LYS  36          3HD       LYS  36   2.507  -0.079   6.162
  272    HE2  LYS  36          2HE       LYS  36   3.372   0.145   8.368
  273    HE3  LYS  36          3HE       LYS  36   2.014  -0.742   9.058
  274    HZ1  LYS  36          1HZ       LYS  36   4.454  -1.751   8.105
  275    HZ2  LYS  36          2HZ       LYS  36   3.211  -2.380   7.147
  276    HZ3  LYS  36          3HZ       LYS  36   3.176  -2.593   8.824
  277    H    GLN  37           HN       GLN  37   0.421  -0.720   4.355
  278    HA   GLN  37           HA       GLN  37   3.028  -0.387   3.798
  279    HB2  GLN  37          2HB       GLN  37   0.947  -2.130   2.836
  280    HB3  GLN  37          3HB       GLN  37   2.072  -1.761   1.534
  281    HG2  GLN  37          2HG       GLN  37   3.811  -2.830   2.540
  282    HG3  GLN  37          3HG       GLN  37   3.199  -2.534   4.166
  283   HE21  GLN  37          1HE2      GLN  37   0.890  -3.617   4.402
  284   HE22  GLN  37          2HE2      GLN  37   0.862  -5.289   3.972
  285    H    TYR  38           HN       TYR  38   0.404   1.089   2.088
  286    HA   TYR  38           HA       TYR  38   2.012   1.886  -0.175
  287    HB2  TYR  38          2HB       TYR  38  -0.129   1.730  -0.932
  288    HB3  TYR  38          3HB       TYR  38  -0.825   2.125   0.635
  289    HD1  TYR  38          1HD       TYR  38  -2.243   3.932   0.424
  290    HD2  TYR  38          2HD       TYR  38   1.460   3.981  -1.672
  291    HE1  TYR  38          1HE       TYR  38  -2.725   6.212  -0.361
  292    HE2  TYR  38          2HE       TYR  38   0.989   6.263  -2.461
  293    HH   TYR  38           HH       TYR  38  -2.031   7.922  -1.591
  294    H    VAL  39           HN       VAL  39   0.099   3.836   2.116
  295    HA   VAL  39           HA       VAL  39   1.486   6.226   1.636
  296    HB   VAL  39           HB       VAL  39   0.367   7.139   3.540
  297   HG11  VAL  39          1HG1      VAL  39  -1.468   5.052   2.374
  298   HG12  VAL  39          2HG1      VAL  39  -1.922   6.614   3.059
  299   HG13  VAL  39          3HG1      VAL  39  -1.009   6.542   1.550
  300   HG21  VAL  39          1HG2      VAL  39  -0.893   5.643   5.112
  301   HG22  VAL  39          2HG2      VAL  39  -0.042   4.277   4.389
  302   HG23  VAL  39          3HG2      VAL  39   0.864   5.535   5.231
  303    H    GLU  40           HN       GLU  40   1.806   3.884   4.298
  304    HA   GLU  40           HA       GLU  40   3.586   4.957   5.963
  305    HB2  GLU  40          2HB       GLU  40   2.759   2.474   5.688
  306    HB3  GLU  40          3HB       GLU  40   4.314   2.259   4.896
  307    HG2  GLU  40          2HG       GLU  40   4.653   3.682   7.362
  308    HG3  GLU  40          3HG       GLU  40   3.760   2.187   7.634
  309    H    LEU  41           HN       LEU  41   4.479   3.587   2.809
  310    HA   LEU  41           HA       LEU  41   7.240   4.249   3.052
  311    HB2  LEU  41          2HB       LEU  41   5.459   3.164   0.962
  312    HB3  LEU  41          3HB       LEU  41   6.909   3.989   0.395
  313    HG   LEU  41           HG       LEU  41   7.503   1.730   0.484
  314   HD11  LEU  41          1HD1      LEU  41   9.016   3.390   1.710
  315   HD12  LEU  41          2HD1      LEU  41   9.279   1.670   1.995
  316   HD13  LEU  41          3HD1      LEU  41   8.419   2.639   3.190
  317   HD21  LEU  41          1HD2      LEU  41   6.840   1.154   3.270
  318   HD22  LEU  41          2HD2      LEU  41   6.585   0.186   1.818
  319   HD23  LEU  41          3HD2      LEU  41   5.433   1.451   2.249
  320    H    LEU  42           HN       LEU  42   4.457   5.780   1.506
  321    HA   LEU  42           HA       LEU  42   6.001   7.914   0.370
  322    HB2  LEU  42          2HB       LEU  42   3.052   7.453   0.719
  323    HB3  LEU  42          3HB       LEU  42   3.701   8.930   0.011
  324    HG   LEU  42           HG       LEU  42   4.911   7.069  -1.534
  325   HD11  LEU  42          1HD1      LEU  42   3.960   5.099  -0.854
  326   HD12  LEU  42          2HD1      LEU  42   2.837   5.579  -2.127
  327   HD13  LEU  42          3HD1      LEU  42   2.423   5.857  -0.436
  328   HD21  LEU  42          1HD2      LEU  42   3.177   7.581  -3.201
  329   HD22  LEU  42          2HD2      LEU  42   3.723   9.021  -2.339
  330   HD23  LEU  42          3HD2      LEU  42   2.176   8.279  -1.927
  331    H    ILE  43           HN       ILE  43   3.372   8.009   2.781
  332    HA   ILE  43           HA       ILE  43   3.578  10.509   3.736
  333    HB   ILE  43           HB       ILE  43   2.621   8.041   4.804
  334   HG12  ILE  43          2HG1      ILE  43   1.191   9.699   6.144
  335   HG13  ILE  43          3HG1      ILE  43   2.084  10.964   5.308
  336   HG21  ILE  43          1HG2      ILE  43   4.043   9.797   6.798
  337   HG22  ILE  43          2HG2      ILE  43   2.904   8.519   7.214
  338   HG23  ILE  43          3HG2      ILE  43   4.420   8.119   6.408
  339   HD11  ILE  43          1HD1      ILE  43   0.826  10.750   3.500
  340   HD12  ILE  43          2HD1      ILE  43   1.071   9.005   3.454
  341   HD13  ILE  43          3HD1      ILE  43  -0.218   9.687   4.444
  342    H    LYS  44           HN       LYS  44   5.926   7.983   4.184
  343    HA   LYS  44           HA       LYS  44   7.391   9.293   6.267
  344    HB2  LYS  44          2HB       LYS  44   7.529   6.795   4.815
  345    HB3  LYS  44          3HB       LYS  44   9.123   7.527   4.946
  346    HG2  LYS  44          2HG       LYS  44   8.564   5.949   6.781
  347    HG3  LYS  44          3HG       LYS  44   8.986   7.574   7.328
  348    HD2  LYS  44          2HD       LYS  44   7.106   7.408   8.550
  349    HD3  LYS  44          3HD       LYS  44   6.291   7.791   7.033
  350    HE2  LYS  44          2HE       LYS  44   5.207   5.859   7.219
  351    HE3  LYS  44          3HE       LYS  44   6.743   5.039   6.945
  352    HZ1  LYS  44          1HZ       LYS  44   5.948   4.160   8.933
  353    HZ2  LYS  44          2HZ       LYS  44   5.425   5.658   9.517
  354    HZ3  LYS  44          3HZ       LYS  44   7.079   5.312   9.438
  355    H    GLU  45           HN       GLU  45   7.753   8.992   2.755
  356    HA   GLU  45           HA       GLU  45  10.141  10.597   2.705
  357    HB2  GLU  45          2HB       GLU  45   9.060   8.758   0.995
  358    HB3  GLU  45          3HB       GLU  45   8.659  10.266   0.187
  359    HG2  GLU  45          2HG       GLU  45  10.713  10.403  -0.607
  360    HG3  GLU  45          3HG       GLU  45  11.360  10.420   1.033
  361    H    GLY  46           HN       GLY  46   6.822  11.046   1.471
  362    HA2  GLY  46          1HA       GLY  46   5.632  12.953   0.999
  363    HA3  GLY  46          2HA       GLY  46   6.465  13.639   2.386
  364    H    LEU  47           HN       LEU  47   7.261  12.759  -0.979
  365    HA   LEU  47           HA       LEU  47   9.020  15.067  -1.160
  366    HB2  LEU  47          2HB       LEU  47   9.586  14.167  -3.381
  367    HB3  LEU  47          3HB       LEU  47   9.837  13.006  -2.079
  368    HG   LEU  47           HG       LEU  47   7.301  12.934  -3.662
  369   HD11  LEU  47          1HD1      LEU  47   9.633  11.308  -4.542
  370   HD12  LEU  47          2HD1      LEU  47   9.496  12.975  -5.101
  371   HD13  LEU  47          3HD1      LEU  47   8.208  11.822  -5.445
  372   HD21  LEU  47          1HD2      LEU  47   8.620  11.341  -1.659
  373   HD22  LEU  47          2HD2      LEU  47   8.312  10.387  -3.110
  374   HD23  LEU  47          3HD2      LEU  47   6.981  11.210  -2.297
  375    H    GLU  48           HN       GLU  48   5.905  13.989  -2.312
  376    HA   GLU  48           HA       GLU  48   4.756  16.397  -2.752
  377    HB2  GLU  48          2HB       GLU  48   4.977  16.529  -5.341
  378    HB3  GLU  48          3HB       GLU  48   6.251  17.200  -4.333
  379    HG2  GLU  48          2HG       GLU  48   7.764  15.642  -4.957
  380    HG3  GLU  48          3HG       GLU  48   6.552  14.376  -5.144
  381    H    THR  49           HN       THR  49   5.140  13.111  -3.681
  382    HA   THR  49           HA       THR  49   3.190  12.433  -5.375
  383    HB   THR  49           HB       THR  49   3.742  11.105  -2.718
  384    HG1  THR  49          1HG       THR  49   4.768   9.602  -4.350
  385   HG21  THR  49          1HG2      THR  49   2.774   9.164  -4.419
  386   HG22  THR  49          2HG2      THR  49   1.711  10.536  -4.733
  387   HG23  THR  49          3HG2      THR  49   1.883   9.910  -3.093
  388    H    ALA  50           HN       ALA  50   2.678  13.746  -2.181
  389    HA   ALA  50           HA       ALA  50   0.826  14.612  -1.174
  390    HB1  ALA  50          1HB       ALA  50  -1.259  14.585  -2.937
  391    HB2  ALA  50          2HB       ALA  50  -0.071  15.881  -2.784
  392    HB3  ALA  50          3HB       ALA  50   0.137  14.635  -4.014
  393    H    ILE  51           HN       ILE  51   1.188  11.532  -2.089
  394    HA   ILE  51           HA       ILE  51   0.018   9.564  -1.830
  395    HB   ILE  51           HB       ILE  51  -0.516  11.002   0.771
  396   HG12  ILE  51          2HG1      ILE  51   1.376   9.634   1.584
  397   HG13  ILE  51          3HG1      ILE  51   1.581   8.972  -0.034
  398   HG21  ILE  51          1HG2      ILE  51  -1.085   8.903   1.749
  399   HG22  ILE  51          2HG2      ILE  51  -2.089   9.110   0.314
  400   HG23  ILE  51          3HG2      ILE  51  -0.688   8.039   0.265
  401   HD11  ILE  51          1HD1      ILE  51   3.031  10.987   0.855
  402   HD12  ILE  51          2HD1      ILE  51   2.537  10.869  -0.835
  403   HD13  ILE  51          3HD1      ILE  51   1.651  11.918   0.272
  404    H    SER  52           HN       SER  52  -1.614   9.620  -3.360
  405    HA   SER  52           HA       SER  52  -4.200  10.734  -2.529
  406    HB2  SER  52          2HB       SER  52  -3.176  11.362  -4.769
  407    HB3  SER  52          3HB       SER  52  -3.473   9.698  -5.273
  408    HG   SER  52           HG       SER  52  -5.199  11.041  -5.874
  409    H    CYS  53           HN       CYS  53  -6.148   9.474  -3.028
  410    HA   CYS  53           HA       CYS  53  -6.443   7.155  -1.751
  411    HB2  CYS  53          2HB       CYS  53  -8.313   8.323  -2.816
  412    HB3  CYS  53          3HB       CYS  53  -7.755   7.798  -4.401
  413    HA   PRO  54           HA       PRO  54  -3.931   4.107  -3.725
  414    HB2  PRO  54          2HB       PRO  54  -5.022   1.915  -2.555
  415    HB3  PRO  54          3HB       PRO  54  -3.940   3.022  -1.701
  416    HG2  PRO  54          2HG       PRO  54  -6.930   2.875  -1.646
  417    HG3  PRO  54          3HG       PRO  54  -5.797   3.108  -0.303
  418    HD2  PRO  54          2HD       PRO  54  -7.160   5.158  -1.431
  419    HD3  PRO  54          3HD       PRO  54  -5.531   5.354  -0.751
  420    H    ASP  55           HN       ASP  55  -7.075   4.748  -4.448
  421    HA   ASP  55           HA       ASP  55  -7.301   2.470  -6.302
  422    HB2  ASP  55          2HB       ASP  55  -9.167   2.573  -4.749
  423    HB3  ASP  55          3HB       ASP  55  -9.453   4.262  -5.159
  424    H    ALA  56           HN       ALA  56  -6.226   3.203  -8.077
  425    HA   ALA  56           HA       ALA  56  -6.246   5.817  -9.074
  426    HB1  ALA  56          1HB       ALA  56  -4.540   4.503  -9.917
  427    HB2  ALA  56          2HB       ALA  56  -5.616   3.152 -10.274
  428    HB3  ALA  56          3HB       ALA  56  -5.649   4.597 -11.286
  429    H    ALA  57           HN       ALA  57  -8.749   3.589  -8.966
  430    HA   ALA  57           HA       ALA  57 -10.137   4.864 -11.230
  431    HB1  ALA  57          1HB       ALA  57  -9.743   2.250 -10.974
  432    HB2  ALA  57          2HB       ALA  57 -11.219   2.384 -10.019
  433    HB3  ALA  57          3HB       ALA  57 -11.206   2.914 -11.700
  434    H    CYS  58           HN       CYS  58  -9.849   5.889  -8.461
  435    HA   CYS  58           HA       CYS  58 -12.376   5.562  -7.158
  436    HB2  CYS  58          2HB       CYS  58 -10.289   6.126  -5.940
  437    HB3  CYS  58          3HB       CYS  58 -10.273   7.696  -6.738
  438    HA   PRO  59           HA       PRO  59 -14.701   8.454  -9.556
  439    HB2  PRO  59          2HB       PRO  59 -16.786   8.749  -7.842
  440    HB3  PRO  59          3HB       PRO  59 -16.558   7.307  -8.839
  441    HG2  PRO  59          2HG       PRO  59 -15.879   7.745  -5.957
  442    HG3  PRO  59          3HG       PRO  59 -16.627   6.334  -6.729
  443    HD2  PRO  59          2HD       PRO  59 -14.002   6.413  -6.071
  444    HD3  PRO  59          3HD       PRO  59 -14.606   5.514  -7.477
  445    H    LYS  60           HN       LYS  60 -13.265   9.090  -6.543
  446    HA   LYS  60           HA       LYS  60 -13.832  11.966  -6.844
  447    HB2  LYS  60          2HB       LYS  60 -13.488  10.402  -4.281
  448    HB3  LYS  60          3HB       LYS  60 -13.594  12.154  -4.373
  449    HG2  LYS  60          2HG       LYS  60 -15.810  10.952  -5.748
  450    HG3  LYS  60          3HG       LYS  60 -15.690  10.330  -4.100
  451    HD2  LYS  60          2HD       LYS  60 -15.951  12.438  -3.153
  452    HD3  LYS  60          3HD       LYS  60 -15.475  13.270  -4.635
  453    HE2  LYS  60          2HE       LYS  60 -17.640  12.058  -5.566
  454    HE3  LYS  60          3HE       LYS  60 -18.094  12.094  -3.863
  455    HZ1  LYS  60          1HZ       LYS  60 -18.935  14.066  -4.715
  456    HZ2  LYS  60          2HZ       LYS  60 -17.577  14.363  -5.678
  457    HZ3  LYS  60          3HZ       LYS  60 -17.482  14.557  -4.001
  458    H    GLN  61           HN       GLN  61 -11.511   9.488  -6.603
  459    HA   GLN  61           HA       GLN  61  -9.234   9.496  -6.181
  460    HB2  GLN  61          2HB       GLN  61  -9.827  11.486  -8.337
  461    HB3  GLN  61          3HB       GLN  61  -8.166  11.259  -7.805
  462    HG2  GLN  61          2HG       GLN  61  -8.806   8.710  -8.180
  463    HG3  GLN  61          3HG       GLN  61  -9.945   9.438  -9.311
  464   HE21  GLN  61          1HE2      GLN  61  -8.794   8.414 -11.007
  465   HE22  GLN  61          2HE2      GLN  61  -7.308   9.074 -11.591
  466    H    GLY  62           HN       GLY  62 -10.215  10.672  -4.014
  467    HA2  GLY  62          1HA       GLY  62  -9.340  13.355  -3.603
  468    HA3  GLY  62          2HA       GLY  62  -9.838  12.223  -2.355
  469    H    HIS  63           HN       HIS  63  -7.848  13.840  -1.684
  470    HA   HIS  63           HA       HIS  63  -5.387  12.262  -2.036
  471    HB2  HIS  63          2HB       HIS  63  -5.811  15.190  -1.452
  472    HB3  HIS  63          3HB       HIS  63  -4.252  14.401  -1.227
  473    HD1  HIS  63          1HD       HIS  63  -6.166  16.185  -3.684
  474    HD2  HIS  63          2HD       HIS  63  -3.335  13.145  -3.778
  475    HE1  HIS  63          1HE       HIS  63  -5.292  16.151  -6.043
  476    H    LEU  64           HN       LEU  64  -3.889  12.343  -0.119
  477    HA   LEU  64           HA       LEU  64  -5.445  12.143   2.376
  478    HB2  LEU  64          2HB       LEU  64  -3.190  10.479   1.312
  479    HB3  LEU  64          3HB       LEU  64  -3.549  10.534   3.037
  480    HG   LEU  64           HG       LEU  64  -5.713   9.819   1.105
  481   HD11  LEU  64          1HD1      LEU  64  -3.359   8.154   1.856
  482   HD12  LEU  64          2HD1      LEU  64  -4.232   8.251   0.326
  483   HD13  LEU  64          3HD1      LEU  64  -4.941   7.389   1.692
  484   HD21  LEU  64          1HD2      LEU  64  -5.861   8.228   3.338
  485   HD22  LEU  64          2HD2      LEU  64  -6.752   9.727   3.080
  486   HD23  LEU  64          3HD2      LEU  64  -5.234   9.746   3.979
  487    H    GLN  65           HN       GLN  65  -4.236  12.568   4.362
  488    HA   GLN  65           HA       GLN  65  -2.516  14.879   4.024
  489    HB2  GLN  65          2HB       GLN  65  -2.902  14.002   6.766
  490    HB3  GLN  65          3HB       GLN  65  -3.318  15.535   6.011
  491    HG2  GLN  65          2HG       GLN  65  -5.372  14.760   6.678
  492    HG3  GLN  65          3HG       GLN  65  -5.304  14.211   5.005
  493   HE21  GLN  65          1HE2      GLN  65  -3.257  12.170   5.901
  494   HE22  GLN  65          2HE2      GLN  65  -4.203  10.899   6.587
  495    H    GLU  66           HN       GLU  66  -0.529  15.103   5.317
  496    HA   GLU  66           HA       GLU  66   1.059  12.670   5.112
  497    HB2  GLU  66          2HB       GLU  66   1.571  15.523   4.918
  498    HB3  GLU  66          3HB       GLU  66   2.722  14.730   5.983
  499    HG2  GLU  66          2HG       GLU  66   2.518  13.068   3.753
  500    HG3  GLU  66          3HG       GLU  66   2.564  14.709   3.115
  501    H    ASN  67           HN       ASN  67  -0.260  14.817   7.508
  502    HA   ASN  67           HA       ASN  67   1.324  13.651   9.650
  503    HB2  ASN  67          2HB       ASN  67  -0.810  15.312  10.613
  504    HB3  ASN  67          3HB       ASN  67   0.927  15.597  10.680
  505   HD21  ASN  67          1HD2      ASN  67  -2.013  16.188   8.938
  506   HD22  ASN  67          2HD2      ASN  67  -1.403  17.450   7.928
  507    H    GLU  68           HN       GLU  68  -2.158  14.060   8.976
  508    HA   GLU  68           HA       GLU  68  -3.219  12.501  10.950
  509    HB2  GLU  68          2HB       GLU  68  -4.094  13.497   8.402
  510    HB3  GLU  68          3HB       GLU  68  -4.699  11.861   8.629
  511    HG2  GLU  68          2HG       GLU  68  -4.987  13.711  10.913
  512    HG3  GLU  68          3HG       GLU  68  -5.985  14.030   9.496
  513    H    ILE  69           HN       ILE  69  -2.143  11.360   7.755
  514    HA   ILE  69           HA       ILE  69  -2.707   8.641   8.181
  515    HB   ILE  69           HB       ILE  69  -0.772  10.022   6.335
  516   HG12  ILE  69          2HG1      ILE  69  -3.568   9.143   6.235
  517   HG13  ILE  69          3HG1      ILE  69  -2.733  10.352   5.267
  518   HG21  ILE  69          1HG2      ILE  69  -0.466   7.856   5.207
  519   HG22  ILE  69          2HG2      ILE  69   0.178   7.854   6.848
  520   HG23  ILE  69          3HG2      ILE  69  -1.364   7.071   6.506
  521   HD11  ILE  69          1HD1      ILE  69  -3.583   8.546   3.888
  522   HD12  ILE  69          2HD1      ILE  69  -1.820   8.590   3.854
  523   HD13  ILE  69          3HD1      ILE  69  -2.653   7.378   4.827
  524    H    GLU  70           HN       GLU  70   0.553  10.079   8.024
  525    HA   GLU  70           HA       GLU  70   2.018   8.031   9.041
  526    HB2  GLU  70          2HB       GLU  70   3.727   9.533   9.370
  527    HB3  GLU  70          3HB       GLU  70   2.682  10.473   8.312
  528    HG2  GLU  70          2HG       GLU  70   1.784  11.676  10.200
  529    HG3  GLU  70          3HG       GLU  70   2.713  10.676  11.314
  530    H    CYS  71           HN       CYS  71  -0.268   9.965  10.742
  531    HA   CYS  71           HA       CYS  71   0.681   9.525  13.379
  532    HB2  CYS  71          2HB       CYS  71  -1.027  11.267  12.548
  533    HB3  CYS  71          3HB       CYS  71  -2.210   9.970  12.668
  534    HG   CYS  71           HG       CYS  71  -1.612  12.018  14.937
  535    H    MET  72           HN       MET  72  -1.644   7.831  11.320
  536    HA   MET  72           HA       MET  72  -2.302   5.905  13.353
  537    HB2  MET  72          2HB       MET  72  -3.880   5.101  11.889
  538    HB3  MET  72          3HB       MET  72  -3.702   6.741  11.281
  539    HG2  MET  72          2HG       MET  72  -1.831   5.530   9.807
  540    HG3  MET  72          3HG       MET  72  -2.919   4.170  10.069
  541    HE1  MET  72          1HE       MET  72  -2.587   5.131   6.921
  542    HE2  MET  72          2HE       MET  72  -3.345   3.779   7.765
  543    HE3  MET  72          3HE       MET  72  -4.295   4.775   6.660
  544    H    VAL  73           HN       VAL  73   0.473   6.347  11.837
  545    HA   VAL  73           HA       VAL  73   1.101   3.479  11.820
  546    HB   VAL  73           HB       VAL  73   2.783   4.303   9.889
  547   HG11  VAL  73          1HG1      VAL  73   1.387   2.342   9.745
  548   HG12  VAL  73          2HG1      VAL  73  -0.051   3.339   9.519
  549   HG13  VAL  73          3HG1      VAL  73   1.199   3.298   8.275
  550   HG21  VAL  73          1HG2      VAL  73   2.083   6.036   8.635
  551   HG22  VAL  73          2HG2      VAL  73   0.378   5.640   8.851
  552   HG23  VAL  73          3HG2      VAL  73   1.245   6.523  10.108
  553    H    ALA  74           HN       ALA  74   2.906   6.465  11.107
  554    HA   ALA  74           HA       ALA  74   5.002   5.606  12.939
  555    HB1  ALA  74          1HB       ALA  74   6.122   6.376  11.138
  556    HB2  ALA  74          2HB       ALA  74   4.822   7.468  10.661
  557    HB3  ALA  74          3HB       ALA  74   5.931   7.928  11.953
  558    H    ALA  75           HN       ALA  75   2.677   6.256  14.276
  559    HA   ALA  75           HA       ALA  75   2.127   8.753  15.133
  560    HB1  ALA  75          1HB       ALA  75   2.050   7.533  17.520
  561    HB2  ALA  75          2HB       ALA  75   0.835   7.286  16.267
  562    HB3  ALA  75          3HB       ALA  75   2.143   6.120  16.469
  Start of MODEL   18
    1    H1   ALA   1           HN       ALA   1 -24.184 -16.785  -4.989
    2    HA   ALA   1           HA       ALA   1 -24.844 -14.643  -5.384
    3    HB1  ALA   1          1HB       ALA   1 -27.131 -15.990  -4.353
    4    HB2  ALA   1          2HB       ALA   1 -27.122 -14.336  -3.737
    5    HB3  ALA   1          3HB       ALA   1 -27.059 -14.630  -5.476
    6    H    LEU   2           HN       LEU   2 -25.472 -15.399  -1.954
    7    HA   LEU   2           HA       LEU   2 -25.198 -12.945  -0.813
    8    HB2  LEU   2          2HB       LEU   2 -24.375 -15.669   0.100
    9    HB3  LEU   2          3HB       LEU   2 -24.012 -14.262   1.097
   10    HG   LEU   2           HG       LEU   2 -26.005 -15.182   1.956
   11   HD11  LEU   2          1HD1      LEU   2 -26.977 -12.986   0.149
   12   HD12  LEU   2          2HD1      LEU   2 -25.939 -12.688   1.542
   13   HD13  LEU   2          3HD1      LEU   2 -27.536 -13.399   1.770
   14   HD21  LEU   2          1HD2      LEU   2 -27.189 -15.142  -0.814
   15   HD22  LEU   2          2HD2      LEU   2 -27.915 -15.798   0.653
   16   HD23  LEU   2          3HD2      LEU   2 -26.498 -16.576  -0.054
   17    H    ASP   3           HN       ASP   3 -23.305 -12.139   0.533
   18    HA   ASP   3           HA       ASP   3 -20.649 -12.738  -0.191
   19    HB2  ASP   3          2HB       ASP   3 -21.296 -11.741  -2.341
   20    HB3  ASP   3          3HB       ASP   3 -21.807 -10.273  -1.510
   21    HA   PRO   4           HA       PRO   4 -21.321 -10.239   3.647
   22    HB2  PRO   4          2HB       PRO   4 -19.848 -11.873   5.237
   23    HB3  PRO   4          3HB       PRO   4 -21.562 -12.146   4.905
   24    HG2  PRO   4          2HG       PRO   4 -19.163 -13.430   3.657
   25    HG3  PRO   4          3HG       PRO   4 -20.682 -14.175   4.188
   26    HD2  PRO   4          2HD       PRO   4 -20.174 -13.595   1.593
   27    HD3  PRO   4          3HD       PRO   4 -21.808 -13.536   2.282
   28    H    LEU   5           HN       LEU   5 -18.325 -11.900   4.182
   29    HA   LEU   5           HA       LEU   5 -16.774  -9.722   4.716
   30    HB2  LEU   5          2HB       LEU   5 -16.240 -12.486   3.857
   31    HB3  LEU   5          3HB       LEU   5 -14.918 -11.348   3.605
   32    HG   LEU   5           HG       LEU   5 -14.844 -10.848   5.966
   33   HD11  LEU   5          1HD1      LEU   5 -17.383 -11.232   6.202
   34   HD12  LEU   5          2HD1      LEU   5 -16.333 -11.638   7.558
   35   HD13  LEU   5          3HD1      LEU   5 -16.942 -12.912   6.503
   36   HD21  LEU   5          1HD2      LEU   5 -14.476 -13.514   4.885
   37   HD22  LEU   5          2HD2      LEU   5 -14.772 -13.534   6.623
   38   HD23  LEU   5          3HD2      LEU   5 -13.442 -12.579   5.965
   39    H    VAL   6           HN       VAL   6 -15.888  -8.105   3.602
   40    HA   VAL   6           HA       VAL   6 -14.649  -8.059   1.207
   41    HB   VAL   6           HB       VAL   6 -17.533  -8.335   0.797
   42   HG11  VAL   6          1HG1      VAL   6 -17.446  -6.778  -1.220
   43   HG12  VAL   6          2HG1      VAL   6 -17.608  -6.026   0.369
   44   HG13  VAL   6          3HG1      VAL   6 -16.043  -6.042  -0.446
   45   HG21  VAL   6          1HG2      VAL   6 -15.902  -8.407  -1.569
   46   HG22  VAL   6          2HG2      VAL   6 -15.137  -9.321  -0.267
   47   HG23  VAL   6          3HG2      VAL   6 -16.780  -9.714  -0.776
   48    H    SER   7           HN       SER   7 -13.929  -6.032   0.702
   49    HA   SER   7           HA       SER   7 -15.238  -3.618   1.176
   50    HB2  SER   7          2HB       SER   7 -14.070  -4.796   3.553
   51    HB3  SER   7          3HB       SER   7 -13.325  -3.240   3.187
   52    HG   SER   7           HG       SER   7 -15.623  -3.639   4.353
   53    H    CYS   8           HN       CYS   8 -11.933  -4.206   2.253
   54    HA   CYS   8           HA       CYS   8 -10.724  -2.242   0.767
   55    HB2  CYS   8          2HB       CYS   8  -9.694  -3.648   2.605
   56    HB3  CYS   8          3HB       CYS   8  -9.410  -4.889   1.388
   57    H    LYS   9           HN       LYS   9  -9.343  -2.331  -1.120
   58    HA   LYS   9           HA       LYS   9 -10.217  -4.351  -3.081
   59    HB2  LYS   9          2HB       LYS   9  -9.360  -1.624  -3.955
   60    HB3  LYS   9          3HB       LYS   9 -10.458  -2.754  -4.738
   61    HG2  LYS   9          2HG       LYS   9 -11.690  -2.099  -2.325
   62    HG3  LYS   9          3HG       LYS   9 -11.035  -0.582  -2.946
   63    HD2  LYS   9          2HD       LYS   9 -12.276  -0.721  -4.923
   64    HD3  LYS   9          3HD       LYS   9 -12.589  -2.445  -4.711
   65    HE2  LYS   9          2HE       LYS   9 -14.104  -2.017  -2.913
   66    HE3  LYS   9          3HE       LYS   9 -13.659  -0.312  -2.873
   67    HZ1  LYS   9          1HZ       LYS   9 -14.624  -1.214  -5.433
   68    HZ2  LYS   9          2HZ       LYS   9 -15.041   0.163  -4.546
   69    HZ3  LYS   9          3HZ       LYS   9 -15.775  -1.321  -4.198
   70    H    LEU  10           HN       LEU  10  -7.605  -2.449  -1.774
   71    HA   LEU  10           HA       LEU  10  -5.601  -2.876  -3.632
   72    HB2  LEU  10          2HB       LEU  10  -5.580  -2.578  -0.654
   73    HB3  LEU  10          3HB       LEU  10  -4.084  -2.874  -1.536
   74    HG   LEU  10           HG       LEU  10  -5.854  -0.584  -2.299
   75   HD11  LEU  10          1HD1      LEU  10  -3.637  -0.115  -0.387
   76   HD12  LEU  10          2HD1      LEU  10  -5.153  -0.746   0.254
   77   HD13  LEU  10          3HD1      LEU  10  -5.138   0.781  -0.629
   78   HD21  LEU  10          1HD2      LEU  10  -3.279  -1.611  -3.047
   79   HD22  LEU  10          2HD2      LEU  10  -3.122   0.032  -2.424
   80   HD23  LEU  10          3HD2      LEU  10  -4.215  -0.302  -3.769
   81    H    CYS  11           HN       CYS  11  -6.390  -4.899  -0.805
   82    HA   CYS  11           HA       CYS  11  -4.753  -7.050  -1.937
   83    HB2  CYS  11          2HB       CYS  11  -4.904  -8.093   0.267
   84    HB3  CYS  11          3HB       CYS  11  -4.338  -6.432   0.412
   85    H    LEU  12           HN       LEU  12  -7.816  -6.037  -2.217
   86    HA   LEU  12           HA       LEU  12  -9.852  -6.997  -2.618
   87    HB2  LEU  12          2HB       LEU  12  -7.899  -8.908  -3.859
   88    HB3  LEU  12          3HB       LEU  12  -9.640  -9.139  -4.003
   89    HG   LEU  12           HG       LEU  12  -8.518  -6.511  -4.821
   90   HD11  LEU  12          1HD1      LEU  12  -7.406  -7.209  -6.638
   91   HD12  LEU  12          2HD1      LEU  12  -8.530  -8.534  -6.943
   92   HD13  LEU  12          3HD1      LEU  12  -7.246  -8.725  -5.749
   93   HD21  LEU  12          1HD2      LEU  12 -10.986  -7.344  -4.817
   94   HD22  LEU  12          2HD2      LEU  12 -10.514  -8.170  -6.302
   95   HD23  LEU  12          3HD2      LEU  12 -10.374  -6.414  -6.184
   96    H    GLY  13           HN       GLY  13  -9.209  -7.408  -0.016
   97    HA2  GLY  13          1HA       GLY  13  -9.736 -10.253   0.511
   98    HA3  GLY  13          2HA       GLY  13  -9.121  -9.095   1.681
   99    H    GLU  14           HN       GLU  14 -10.521  -8.088   3.006
  100    HA   GLU  14           HA       GLU  14 -13.182  -7.456   2.443
  101    HB2  GLU  14          2HB       GLU  14 -14.092  -9.245   4.176
  102    HB3  GLU  14          3HB       GLU  14 -13.988  -9.596   2.457
  103    HG2  GLU  14          2HG       GLU  14 -11.565 -10.228   3.971
  104    HG3  GLU  14          3HG       GLU  14 -12.987 -11.161   4.433
  105    H    TYR  15           HN       TYR  15 -12.194  -9.072   5.418
  106    HA   TYR  15           HA       TYR  15 -11.948  -8.324   7.553
  107    HB2  TYR  15          2HB       TYR  15 -11.086  -5.673   6.412
  108    HB3  TYR  15          3HB       TYR  15 -10.569  -6.436   7.910
  109    HD1  TYR  15          1HD       TYR  15 -10.257  -6.531   4.235
  110    HD2  TYR  15          2HD       TYR  15  -8.773  -8.007   7.939
  111    HE1  TYR  15          1HE       TYR  15  -8.313  -7.484   3.069
  112    HE2  TYR  15          2HE       TYR  15  -6.824  -8.963   6.785
  113    HH   TYR  15           HH       TYR  15  -6.027  -9.565   4.707
  114    HA   PRO  16           HA       PRO  16 -15.640  -6.226   8.670
  115    HB2  PRO  16          2HB       PRO  16 -15.019  -5.420  11.187
  116    HB3  PRO  16          3HB       PRO  16 -15.350  -7.105  10.773
  117    HG2  PRO  16          2HG       PRO  16 -12.719  -5.725  11.131
  118    HG3  PRO  16          3HG       PRO  16 -13.228  -7.325  11.700
  119    HD2  PRO  16          2HD       PRO  16 -11.696  -6.983   9.494
  120    HD3  PRO  16          3HD       PRO  16 -12.868  -8.308   9.646
  121    H    VAL  17           HN       VAL  17 -16.123  -4.073  10.161
  122    HA   VAL  17           HA       VAL  17 -15.039  -1.908   8.548
  123    HB   VAL  17           HB       VAL  17 -17.422  -2.260  10.277
  124   HG11  VAL  17          1HG1      VAL  17 -17.763   0.180  10.440
  125   HG12  VAL  17          2HG1      VAL  17 -16.381  -0.380  11.383
  126   HG13  VAL  17          3HG1      VAL  17 -16.125   0.426   9.834
  127   HG21  VAL  17          1HG2      VAL  17 -18.544  -1.203   8.451
  128   HG22  VAL  17          2HG2      VAL  17 -17.017  -0.664   7.751
  129   HG23  VAL  17          3HG2      VAL  17 -17.419  -2.381   7.777
  130    H    GLU  18           HN       GLU  18 -14.412  -3.351  11.529
  131    HA   GLU  18           HA       GLU  18 -13.358  -0.905  12.734
  132    HB2  GLU  18          2HB       GLU  18 -14.189  -3.550  13.724
  133    HB3  GLU  18          3HB       GLU  18 -12.748  -2.900  14.494
  134    HG2  GLU  18          2HG       GLU  18 -14.438  -2.128  15.853
  135    HG3  GLU  18          3HG       GLU  18 -14.148  -0.754  14.786
  136    H    GLN  19           HN       GLN  19 -12.314  -3.227  10.637
  137    HA   GLN  19           HA       GLN  19  -9.537  -3.109  11.604
  138    HB2  GLN  19          2HB       GLN  19 -11.056  -5.115   9.989
  139    HB3  GLN  19          3HB       GLN  19  -9.318  -4.975   9.757
  140    HG2  GLN  19          2HG       GLN  19  -8.877  -5.559  12.006
  141    HG3  GLN  19          3HG       GLN  19 -10.574  -5.390  12.452
  142   HE21  GLN  19          1HE2      GLN  19  -9.197  -6.980   9.624
  143   HE22  GLN  19          2HE2      GLN  19  -9.781  -8.561  10.003
  144    H    MET  20           HN       MET  20 -11.387  -1.335   9.743
  145    HA   MET  20           HA       MET  20  -9.317  -0.946   7.682
  146    HB2  MET  20          2HB       MET  20 -11.943   0.112   6.989
  147    HB3  MET  20          3HB       MET  20 -10.858  -0.906   6.049
  148    HG2  MET  20          2HG       MET  20 -11.702  -2.769   7.687
  149    HG3  MET  20          3HG       MET  20 -13.064  -1.671   7.887
  150    HE1  MET  20          1HE       MET  20 -10.641  -2.884   5.399
  151    HE2  MET  20          2HE       MET  20 -11.571  -3.999   4.399
  152    HE3  MET  20          3HE       MET  20 -11.416  -2.307   3.924
  153    H    THR  21           HN       THR  21  -9.507   1.348   6.711
  154    HA   THR  21           HA       THR  21 -10.205   3.331   8.752
  155    HB   THR  21           HB       THR  21  -7.488   3.047   7.468
  156    HG1  THR  21          1HG       THR  21  -8.242   2.074   9.630
  157   HG21  THR  21          1HG2      THR  21  -8.247   5.391   7.319
  158   HG22  THR  21          2HG2      THR  21  -6.898   5.196   8.437
  159   HG23  THR  21          3HG2      THR  21  -8.537   5.391   9.058
  160    H    THR  22           HN       THR  22 -11.099   5.135   7.939
  161    HA   THR  22           HA       THR  22 -11.839   5.257   5.216
  162    HB   THR  22           HB       THR  22 -11.920   7.467   7.280
  163    HG1  THR  22          1HG       THR  22 -13.855   6.657   7.852
  164   HG21  THR  22          1HG2      THR  22 -12.207   8.481   5.167
  165   HG22  THR  22          2HG2      THR  22 -13.839   8.246   5.793
  166   HG23  THR  22          3HG2      THR  22 -13.196   7.147   4.574
  167    H    ILE  23           HN       ILE  23 -11.358   7.003   3.707
  168    HA   ILE  23           HA       ILE  23  -8.536   7.427   3.475
  169    HB   ILE  23           HB       ILE  23 -10.859   8.402   1.816
  170   HG12  ILE  23          2HG1      ILE  23 -10.466   6.020   1.633
  171   HG13  ILE  23          3HG1      ILE  23  -9.911   6.802   0.157
  172   HG21  ILE  23          1HG2      ILE  23  -9.532   9.888   0.843
  173   HG22  ILE  23          2HG2      ILE  23  -8.212   9.437   1.921
  174   HG23  ILE  23          3HG2      ILE  23  -8.424   8.594   0.386
  175   HD11  ILE  23          1HD1      ILE  23  -8.257   5.248   0.656
  176   HD12  ILE  23          2HD1      ILE  23  -7.598   6.776   1.240
  177   HD13  ILE  23          3HD1      ILE  23  -8.291   5.623   2.378
  178    H    ALA  24           HN       ALA  24 -10.876   9.987   2.864
  179    HA   ALA  24           HA       ALA  24 -10.663  11.643   4.984
  180    HB1  ALA  24          1HB       ALA  24  -8.119  11.603   3.462
  181    HB2  ALA  24          2HB       ALA  24  -8.704  13.164   4.036
  182    HB3  ALA  24          3HB       ALA  24  -8.408  11.858   5.183
  183    H    GLN  25           HN       GLN  25 -10.350  11.475   1.492
  184    HA   GLN  25           HA       GLN  25 -11.949  13.938   1.264
  185    HB2  GLN  25          2HB       GLN  25  -9.697  12.862  -0.277
  186    HB3  GLN  25          3HB       GLN  25 -11.034  13.422  -1.273
  187    HG2  GLN  25          2HG       GLN  25  -9.692  15.067   0.860
  188    HG3  GLN  25          3HG       GLN  25  -9.299  15.136  -0.857
  189   HE21  GLN  25          1HE2      GLN  25 -11.127  16.466   1.570
  190   HE22  GLN  25          2HE2      GLN  25 -12.292  17.306   0.609
  191    H    CYS  26           HN       CYS  26 -11.463  10.793  -0.345
  192    HA   CYS  26           HA       CYS  26 -14.090  10.917  -1.545
  193    HB2  CYS  26          2HB       CYS  26 -13.493   8.679  -2.460
  194    HB3  CYS  26          3HB       CYS  26 -12.308   9.925  -2.841
  195    H    GLN  27           HN       GLN  27 -12.549   9.375   1.183
  196    HA   GLN  27           HA       GLN  27 -13.470   8.392   3.032
  197    HB2  GLN  27          2HB       GLN  27 -16.191   8.544   1.761
  198    HB3  GLN  27          3HB       GLN  27 -15.782   8.515   3.471
  199    HG2  GLN  27          2HG       GLN  27 -14.810  10.791   1.829
  200    HG3  GLN  27          3HG       GLN  27 -16.519  10.730   2.258
  201   HE21  GLN  27          1HE2      GLN  27 -13.258  10.895   3.502
  202   HE22  GLN  27          2HE2      GLN  27 -13.678  11.497   5.067
  203    H    CYS  28           HN       CYS  28 -12.318   6.833   1.154
  204    HA   CYS  28           HA       CYS  28 -14.102   4.651   0.463
  205    HB2  CYS  28          2HB       CYS  28 -11.186   5.208  -0.047
  206    HB3  CYS  28          3HB       CYS  28 -11.905   3.644  -0.415
  207    H    ILE  29           HN       ILE  29 -12.872   2.379   0.803
  208    HA   ILE  29           HA       ILE  29 -12.153   2.232   3.657
  209    HB   ILE  29           HB       ILE  29 -14.491   1.285   2.724
  210   HG12  ILE  29          2HG1      ILE  29 -14.367  -0.358   4.675
  211   HG13  ILE  29          3HG1      ILE  29 -12.701   0.169   4.883
  212   HG21  ILE  29          1HG2      ILE  29 -12.626  -1.078   2.567
  213   HG22  ILE  29          2HG2      ILE  29 -14.374  -1.092   2.339
  214   HG23  ILE  29          3HG2      ILE  29 -13.340  -0.262   1.176
  215   HD11  ILE  29          1HD1      ILE  29 -13.806   1.505   6.378
  216   HD12  ILE  29          2HD1      ILE  29 -13.762   2.544   4.954
  217   HD13  ILE  29          3HD1      ILE  29 -15.234   1.658   5.353
  218    H    PHE  30           HN       PHE  30 -10.263   1.297   4.058
  219    HA   PHE  30           HA       PHE  30  -9.274  -0.854   2.392
  220    HB2  PHE  30          2HB       PHE  30  -7.750   1.745   2.662
  221    HB3  PHE  30          3HB       PHE  30  -7.095   0.261   1.977
  222    HD1  PHE  30          1HD       PHE  30  -8.129  -0.667  -0.114
  223    HD2  PHE  30          2HD       PHE  30  -9.030   3.221   1.367
  224    HE1  PHE  30          1HE       PHE  30  -8.992  -0.026  -2.328
  225    HE2  PHE  30          2HE       PHE  30  -9.895   3.866  -0.844
  226    HZ   PHE  30           HZ       PHE  30  -9.877   2.242  -2.695
  227    H    CYS  31           HN       CYS  31  -8.272  -2.318   3.613
  228    HA   CYS  31           HA       CYS  31  -8.095  -2.119   6.384
  229    HB2  CYS  31          2HB       CYS  31  -6.990  -4.219   6.345
  230    HB3  CYS  31          3HB       CYS  31  -8.086  -4.229   4.967
  231    H    THR  32           HN       THR  32  -6.693  -1.186   7.717
  232    HA   THR  32           HA       THR  32  -4.834   0.643   7.190
  233    HB   THR  32           HB       THR  32  -4.138  -1.408   9.276
  234    HG1  THR  32          1HG       THR  32  -6.165   0.588   9.496
  235   HG21  THR  32          1HG2      THR  32  -2.709   0.622   8.872
  236   HG22  THR  32          2HG2      THR  32  -3.340   0.473  10.513
  237   HG23  THR  32          3HG2      THR  32  -4.081   1.605   9.383
  238    H    LEU  33           HN       LEU  33  -4.148  -2.842   7.238
  239    HA   LEU  33           HA       LEU  33  -1.473  -2.955   6.881
  240    HB2  LEU  33          2HB       LEU  33  -3.721  -4.556   5.794
  241    HB3  LEU  33          3HB       LEU  33  -2.121  -4.831   5.108
  242    HG   LEU  33           HG       LEU  33  -3.120  -6.176   7.224
  243   HD11  LEU  33          1HD1      LEU  33  -1.047  -7.135   7.366
  244   HD12  LEU  33          2HD1      LEU  33  -0.200  -5.595   7.229
  245   HD13  LEU  33          3HD1      LEU  33  -0.919  -6.334   5.800
  246   HD21  LEU  33          1HD2      LEU  33  -3.068  -3.976   8.509
  247   HD22  LEU  33          2HD2      LEU  33  -1.312  -4.138   8.492
  248   HD23  LEU  33          3HD2      LEU  33  -2.304  -5.370   9.273
  249    H    CYS  34           HN       CYS  34  -3.680  -2.892   4.076
  250    HA   CYS  34           HA       CYS  34  -1.653  -2.266   2.216
  251    HB2  CYS  34          2HB       CYS  34  -4.610  -1.706   1.925
  252    HB3  CYS  34          3HB       CYS  34  -3.436  -1.922   0.629
  253    H    LEU  35           HN       LEU  35  -4.308  -0.195   3.405
  254    HA   LEU  35           HA       LEU  35  -3.514   2.190   2.292
  255    HB2  LEU  35          2HB       LEU  35  -5.599   1.620   3.673
  256    HB3  LEU  35          3HB       LEU  35  -4.621   2.042   5.078
  257    HG   LEU  35           HG       LEU  35  -4.290   4.308   4.032
  258   HD11  LEU  35          1HD1      LEU  35  -6.439   3.286   2.182
  259   HD12  LEU  35          2HD1      LEU  35  -4.806   3.784   1.739
  260   HD13  LEU  35          3HD1      LEU  35  -5.960   4.977   2.338
  261   HD21  LEU  35          1HD2      LEU  35  -6.327   5.159   4.873
  262   HD22  LEU  35          2HD2      LEU  35  -5.970   3.717   5.826
  263   HD23  LEU  35          3HD2      LEU  35  -7.181   3.651   4.543
  264    H    LYS  36           HN       LYS  36  -1.956   0.406   4.748
  265    HA   LYS  36           HA       LYS  36  -0.464   2.699   5.754
  266    HB2  LYS  36          2HB       LYS  36  -1.151   1.115   7.422
  267    HB3  LYS  36          3HB       LYS  36  -0.471  -0.225   6.509
  268    HG2  LYS  36          2HG       LYS  36   1.503   1.815   7.124
  269    HG3  LYS  36          3HG       LYS  36   0.749   1.134   8.568
  270    HD2  LYS  36          2HD       LYS  36   1.200  -1.118   7.149
  271    HD3  LYS  36          3HD       LYS  36   2.545  -0.119   6.592
  272    HE2  LYS  36          2HE       LYS  36   2.379   0.217   9.385
  273    HE3  LYS  36          3HE       LYS  36   2.229  -1.511   9.075
  274    HZ1  LYS  36          1HZ       LYS  36   4.400  -1.595   8.742
  275    HZ2  LYS  36          2HZ       LYS  36   4.541   0.068   9.014
  276    HZ3  LYS  36          3HZ       LYS  36   4.270  -0.512   7.449
  277    H    GLN  37           HN       GLN  37   0.341  -0.501   4.391
  278    HA   GLN  37           HA       GLN  37   3.047  -0.002   3.951
  279    HB2  GLN  37          2HB       GLN  37   1.090  -2.002   3.122
  280    HB3  GLN  37          3HB       GLN  37   2.335  -1.727   1.910
  281    HG2  GLN  37          2HG       GLN  37   3.914  -2.733   3.127
  282    HG3  GLN  37          3HG       GLN  37   3.363  -1.999   4.631
  283   HE21  GLN  37          1HE2      GLN  37   2.994  -3.557   6.036
  284   HE22  GLN  37          2HE2      GLN  37   2.130  -5.020   5.727
  285    H    TYR  38           HN       TYR  38   0.377   1.383   2.443
  286    HA   TYR  38           HA       TYR  38   1.778   1.930  -0.058
  287    HB2  TYR  38          2HB       TYR  38  -0.330   1.724  -0.807
  288    HB3  TYR  38          3HB       TYR  38  -1.003   1.884   0.810
  289    HD1  TYR  38          1HD       TYR  38  -2.658   3.489   0.822
  290    HD2  TYR  38          2HD       TYR  38   0.885   4.225  -1.413
  291    HE1  TYR  38          1HE       TYR  38  -3.488   5.734   0.258
  292    HE2  TYR  38          2HE       TYR  38   0.066   6.473  -1.982
  293    HH   TYR  38           HH       TYR  38  -2.154   7.632  -2.162
  294    H    VAL  39           HN       VAL  39   0.289   3.711   2.634
  295    HA   VAL  39           HA       VAL  39   1.379   6.226   1.721
  296    HB   VAL  39           HB       VAL  39   0.317   7.219   3.641
  297   HG11  VAL  39          1HG1      VAL  39  -1.909   5.477   3.184
  298   HG12  VAL  39          2HG1      VAL  39  -1.636   7.115   2.589
  299   HG13  VAL  39          3HG1      VAL  39  -1.034   5.732   1.674
  300   HG21  VAL  39          1HG2      VAL  39   0.821   5.697   5.385
  301   HG22  VAL  39          2HG2      VAL  39  -0.936   5.736   5.255
  302   HG23  VAL  39          3HG2      VAL  39  -0.033   4.381   4.580
  303    H    GLU  40           HN       GLU  40   1.849   4.118   4.555
  304    HA   GLU  40           HA       GLU  40   3.662   5.380   6.049
  305    HB2  GLU  40          2HB       GLU  40   2.867   2.915   6.143
  306    HB3  GLU  40          3HB       GLU  40   4.304   2.574   5.187
  307    HG2  GLU  40          2HG       GLU  40   5.044   4.220   7.387
  308    HG3  GLU  40          3HG       GLU  40   4.084   2.869   7.983
  309    H    LEU  41           HN       LEU  41   4.369   3.898   2.921
  310    HA   LEU  41           HA       LEU  41   7.164   4.428   2.994
  311    HB2  LEU  41          2HB       LEU  41   5.213   3.633   0.874
  312    HB3  LEU  41          3HB       LEU  41   6.842   4.132   0.424
  313    HG   LEU  41           HG       LEU  41   6.701   1.720   0.526
  314   HD11  LEU  41          1HD1      LEU  41   8.208   2.453   2.997
  315   HD12  LEU  41          2HD1      LEU  41   8.716   3.091   1.434
  316   HD13  LEU  41          3HD1      LEU  41   8.652   1.348   1.695
  317   HD21  LEU  41          1HD2      LEU  41   5.784   0.516   2.209
  318   HD22  LEU  41          2HD2      LEU  41   4.864   2.002   2.447
  319   HD23  LEU  41          3HD2      LEU  41   6.275   1.667   3.452
  320    H    LEU  42           HN       LEU  42   4.397   6.075   1.507
  321    HA   LEU  42           HA       LEU  42   6.012   8.176   0.406
  322    HB2  LEU  42          2HB       LEU  42   3.028   7.993   0.795
  323    HB3  LEU  42          3HB       LEU  42   3.861   9.229  -0.146
  324    HG   LEU  42           HG       LEU  42   4.170   6.339  -0.860
  325   HD11  LEU  42          1HD1      LEU  42   2.253   6.542  -2.369
  326   HD12  LEU  42          2HD1      LEU  42   1.880   8.120  -1.679
  327   HD13  LEU  42          3HD1      LEU  42   1.771   6.673  -0.677
  328   HD21  LEU  42          1HD2      LEU  42   4.140   8.859  -2.516
  329   HD22  LEU  42          2HD2      LEU  42   4.563   7.237  -3.064
  330   HD23  LEU  42          3HD2      LEU  42   5.595   8.072  -1.902
  331    H    ILE  43           HN       ILE  43   3.450   8.197   2.893
  332    HA   ILE  43           HA       ILE  43   3.599  10.695   3.864
  333    HB   ILE  43           HB       ILE  43   2.837   8.160   4.973
  334   HG12  ILE  43          2HG1      ILE  43   1.286   9.685   6.284
  335   HG13  ILE  43          3HG1      ILE  43   2.098  11.040   5.507
  336   HG21  ILE  43          1HG2      ILE  43   4.156  10.067   6.901
  337   HG22  ILE  43          2HG2      ILE  43   3.158   8.688   7.359
  338   HG23  ILE  43          3HG2      ILE  43   4.683   8.429   6.514
  339   HD11  ILE  43          1HD1      ILE  43  -0.116   9.739   4.567
  340   HD12  ILE  43          2HD1      ILE  43   0.957  10.768   3.618
  341   HD13  ILE  43          3HD1      ILE  43   1.188   9.020   3.622
  342    H    LYS  44           HN       LYS  44   6.073   8.270   4.157
  343    HA   LYS  44           HA       LYS  44   7.584   9.690   6.156
  344    HB2  LYS  44          2HB       LYS  44   7.685   7.109   4.863
  345    HB3  LYS  44          3HB       LYS  44   9.275   7.861   4.859
  346    HG2  LYS  44          2HG       LYS  44   8.901   6.425   6.818
  347    HG3  LYS  44          3HG       LYS  44   9.219   8.106   7.255
  348    HD2  LYS  44          2HD       LYS  44   7.421   7.709   8.603
  349    HD3  LYS  44          3HD       LYS  44   6.572   8.241   7.149
  350    HE2  LYS  44          2HE       LYS  44   5.508   6.296   7.064
  351    HE3  LYS  44          3HE       LYS  44   7.052   5.459   6.899
  352    HZ1  LYS  44          1HZ       LYS  44   6.886   6.052   9.557
  353    HZ2  LYS  44          2HZ       LYS  44   6.584   4.545   8.853
  354    HZ3  LYS  44          3HZ       LYS  44   5.304   5.609   9.155
  355    H    GLU  45           HN       GLU  45   7.786   9.195   2.655
  356    HA   GLU  45           HA       GLU  45  10.203  10.636   2.301
  357    HB2  GLU  45          2HB       GLU  45   8.686   9.031   0.708
  358    HB3  GLU  45          3HB       GLU  45   8.300  10.614   0.049
  359    HG2  GLU  45          2HG       GLU  45  10.506  11.031  -0.571
  360    HG3  GLU  45          3HG       GLU  45  11.138   9.768   0.486
  361    H    GLY  46           HN       GLY  46   6.981  11.584   1.099
  362    HA2  GLY  46          1HA       GLY  46   5.886  13.633   1.443
  363    HA3  GLY  46          2HA       GLY  46   7.343  14.260   2.200
  364    H    LEU  47           HN       LEU  47   8.823  13.094  -0.240
  365    HA   LEU  47           HA       LEU  47   9.394  15.347  -1.615
  366    HB2  LEU  47          2HB       LEU  47  10.359  14.042  -3.248
  367    HB3  LEU  47          3HB       LEU  47  10.289  12.935  -1.878
  368    HG   LEU  47           HG       LEU  47   8.230  12.956  -4.075
  369   HD11  LEU  47          1HD1      LEU  47  10.270  10.827  -3.983
  370   HD12  LEU  47          2HD1      LEU  47  10.800  12.398  -4.583
  371   HD13  LEU  47          3HD1      LEU  47   9.455  11.564  -5.361
  372   HD21  LEU  47          1HD2      LEU  47   8.825  10.508  -2.587
  373   HD22  LEU  47          2HD2      LEU  47   7.273  11.234  -3.010
  374   HD23  LEU  47          3HD2      LEU  47   8.162  11.811  -1.600
  375    H    GLU  48           HN       GLU  48   6.726  13.127  -2.363
  376    HA   GLU  48           HA       GLU  48   5.000  15.153  -3.253
  377    HB2  GLU  48          2HB       GLU  48   5.015  14.935  -5.612
  378    HB3  GLU  48          3HB       GLU  48   6.694  15.147  -5.136
  379    HG2  GLU  48          2HG       GLU  48   7.292  13.160  -5.938
  380    HG3  GLU  48          3HG       GLU  48   5.885  12.354  -5.247
  381    H    THR  49           HN       THR  49   3.791  13.485  -5.374
  382    HA   THR  49           HA       THR  49   2.499  11.593  -5.654
  383    HB   THR  49           HB       THR  49   3.059  10.700  -2.841
  384    HG1  THR  49          1HG       THR  49   5.085  10.415  -3.347
  385   HG21  THR  49          1HG2      THR  49   1.704   9.636  -5.111
  386   HG22  THR  49          2HG2      THR  49   1.905   8.918  -3.513
  387   HG23  THR  49          3HG2      THR  49   3.105   8.622  -4.770
  388    H    ALA  50           HN       ALA  50   2.384  13.563  -2.789
  389    HA   ALA  50           HA       ALA  50   0.671  14.341  -1.498
  390    HB1  ALA  50          1HB       ALA  50  -0.444  14.231  -4.257
  391    HB2  ALA  50          2HB       ALA  50  -1.520  14.636  -2.920
  392    HB3  ALA  50          3HB       ALA  50  -0.095  15.625  -3.234
  393    H    ILE  51           HN       ILE  51   0.982  11.312  -1.984
  394    HA   ILE  51           HA       ILE  51  -0.219   9.363  -1.635
  395    HB   ILE  51           HB       ILE  51  -0.941  11.031   0.777
  396   HG12  ILE  51          2HG1      ILE  51   0.984   9.886   1.820
  397   HG13  ILE  51          3HG1      ILE  51   1.326   9.085   0.291
  398   HG21  ILE  51          1HG2      ILE  51  -1.413   8.988   1.927
  399   HG22  ILE  51          2HG2      ILE  51  -2.364   9.011   0.444
  400   HG23  ILE  51          3HG2      ILE  51  -0.902   8.028   0.539
  401   HD11  ILE  51          1HD1      ILE  51   2.544  11.321   1.084
  402   HD12  ILE  51          2HD1      ILE  51   2.266  10.921  -0.612
  403   HD13  ILE  51          3HD1      ILE  51   1.176  12.028   0.223
  404    H    SER  52           HN       SER  52  -1.733   9.509  -3.366
  405    HA   SER  52           HA       SER  52  -4.388  10.538  -2.674
  406    HB2  SER  52          2HB       SER  52  -3.061  10.972  -4.925
  407    HB3  SER  52          3HB       SER  52  -3.763   9.418  -5.374
  408    HG   SER  52           HG       SER  52  -5.349  10.726  -5.940
  409    H    CYS  53           HN       CYS  53  -6.273   9.257  -3.006
  410    HA   CYS  53           HA       CYS  53  -6.475   6.885  -1.812
  411    HB2  CYS  53          2HB       CYS  53  -8.413   8.080  -2.711
  412    HB3  CYS  53          3HB       CYS  53  -7.951   7.625  -4.348
  413    HA   PRO  54           HA       PRO  54  -4.070   3.942  -4.061
  414    HB2  PRO  54          2HB       PRO  54  -5.075   1.695  -2.917
  415    HB3  PRO  54          3HB       PRO  54  -3.949   2.775  -2.086
  416    HG2  PRO  54          2HG       PRO  54  -6.929   2.601  -1.854
  417    HG3  PRO  54          3HG       PRO  54  -5.716   2.789  -0.574
  418    HD2  PRO  54          2HD       PRO  54  -7.158   4.871  -1.531
  419    HD3  PRO  54          3HD       PRO  54  -5.492   5.053  -0.944
  420    H    ASP  55           HN       ASP  55  -7.257   4.584  -4.562
  421    HA   ASP  55           HA       ASP  55  -7.595   2.372  -6.476
  422    HB2  ASP  55          2HB       ASP  55  -9.318   2.766  -4.601
  423    HB3  ASP  55          3HB       ASP  55  -9.811   4.178  -5.531
  424    H    ALA  56           HN       ALA  56  -6.357   3.356  -8.115
  425    HA   ALA  56           HA       ALA  56  -6.538   5.938  -9.068
  426    HB1  ALA  56          1HB       ALA  56  -4.861   4.329  -9.824
  427    HB2  ALA  56          2HB       ALA  56  -6.106   3.438 -10.701
  428    HB3  ALA  56          3HB       ALA  56  -5.689   5.082 -11.187
  429    H    ALA  57           HN       ALA  57  -8.916   3.502  -9.158
  430    HA   ALA  57           HA       ALA  57 -10.382   4.816 -11.333
  431    HB1  ALA  57          1HB       ALA  57 -11.541   2.863 -11.668
  432    HB2  ALA  57          2HB       ALA  57  -9.995   2.238 -11.096
  433    HB3  ALA  57          3HB       ALA  57 -11.367   2.342  -9.993
  434    H    CYS  58           HN       CYS  58 -10.049   5.892  -8.572
  435    HA   CYS  58           HA       CYS  58 -12.611   5.640  -7.297
  436    HB2  CYS  58          2HB       CYS  58 -10.414   6.109  -6.117
  437    HB3  CYS  58          3HB       CYS  58 -10.516   7.746  -6.758
  438    HA   PRO  59           HA       PRO  59 -14.715   8.696  -9.699
  439    HB2  PRO  59          2HB       PRO  59 -16.842   9.042  -8.048
  440    HB3  PRO  59          3HB       PRO  59 -16.647   7.619  -9.078
  441    HG2  PRO  59          2HG       PRO  59 -16.046   7.944  -6.164
  442    HG3  PRO  59          3HG       PRO  59 -16.833   6.593  -6.999
  443    HD2  PRO  59          2HD       PRO  59 -14.231   6.530  -6.254
  444    HD3  PRO  59          3HD       PRO  59 -14.829   5.699  -7.704
  445    H    LYS  60           HN       LYS  60 -13.538   9.163  -6.499
  446    HA   LYS  60           HA       LYS  60 -13.788  12.079  -6.839
  447    HB2  LYS  60          2HB       LYS  60 -14.202  10.392  -4.388
  448    HB3  LYS  60          3HB       LYS  60 -13.724  12.080  -4.245
  449    HG2  LYS  60          2HG       LYS  60 -15.736  12.616  -5.697
  450    HG3  LYS  60          3HG       LYS  60 -16.249  10.952  -5.409
  451    HD2  LYS  60          2HD       LYS  60 -16.294  11.340  -3.022
  452    HD3  LYS  60          3HD       LYS  60 -15.654  12.970  -3.246
  453    HE2  LYS  60          2HE       LYS  60 -17.997  13.180  -2.909
  454    HE3  LYS  60          3HE       LYS  60 -17.692  13.474  -4.621
  455    HZ1  LYS  60          1HZ       LYS  60 -18.200  10.970  -4.845
  456    HZ2  LYS  60          2HZ       LYS  60 -19.487  12.052  -4.660
  457    HZ3  LYS  60          3HZ       LYS  60 -18.951  11.141  -3.339
  458    H    GLN  61           HN       GLN  61 -11.757   9.418  -6.423
  459    HA   GLN  61           HA       GLN  61  -9.572   9.178  -5.696
  460    HB2  GLN  61          2HB       GLN  61  -9.169  11.647  -7.373
  461    HB3  GLN  61          3HB       GLN  61  -8.086  10.274  -7.178
  462    HG2  GLN  61          2HG       GLN  61  -9.765   8.860  -8.340
  463    HG3  GLN  61          3HG       GLN  61 -10.711  10.317  -8.645
  464   HE21  GLN  61          1HE2      GLN  61  -7.529   8.875  -9.160
  465   HE22  GLN  61          2HE2      GLN  61  -7.217   9.664 -10.664
  466    H    GLY  62           HN       GLY  62 -10.544  10.108  -3.523
  467    HA2  GLY  62          1HA       GLY  62  -9.775  12.724  -2.734
  468    HA3  GLY  62          2HA       GLY  62 -10.224  11.411  -1.656
  469    H    HIS  63           HN       HIS  63  -8.008  13.491  -1.680
  470    HA   HIS  63           HA       HIS  63  -5.635  11.802  -1.754
  471    HB2  HIS  63          2HB       HIS  63  -6.021  14.764  -1.314
  472    HB3  HIS  63          3HB       HIS  63  -4.455  13.968  -1.195
  473    HD1  HIS  63          1HD       HIS  63  -6.783  15.440  -3.598
  474    HD2  HIS  63          2HD       HIS  63  -3.567  12.812  -3.709
  475    HE1  HIS  63          1HE       HIS  63  -6.072  15.346  -6.009
  476    H    LEU  64           HN       LEU  64  -4.064  12.024   0.091
  477    HA   LEU  64           HA       LEU  64  -5.513  12.028   2.657
  478    HB2  LEU  64          2HB       LEU  64  -3.260  10.278   1.705
  479    HB3  LEU  64          3HB       LEU  64  -3.729  10.401   3.399
  480    HG   LEU  64           HG       LEU  64  -5.866   9.693   1.476
  481   HD11  LEU  64          1HD1      LEU  64  -5.005   7.235   1.883
  482   HD12  LEU  64          2HD1      LEU  64  -3.439   8.041   1.940
  483   HD13  LEU  64          3HD1      LEU  64  -4.452   8.187   0.505
  484   HD21  LEU  64          1HD2      LEU  64  -5.575   9.774   4.219
  485   HD22  LEU  64          2HD2      LEU  64  -5.454   8.056   3.842
  486   HD23  LEU  64          3HD2      LEU  64  -6.872   8.973   3.332
  487    H    GLN  65           HN       GLN  65  -4.220  12.588   4.548
  488    HA   GLN  65           HA       GLN  65  -2.502  14.843   3.978
  489    HB2  GLN  65          2HB       GLN  65  -2.741  14.052   6.781
  490    HB3  GLN  65          3HB       GLN  65  -3.098  15.592   6.012
  491    HG2  GLN  65          2HG       GLN  65  -5.165  14.976   6.772
  492    HG3  GLN  65          3HG       GLN  65  -5.203  14.347   5.125
  493   HE21  GLN  65          1HE2      GLN  65  -3.248  12.226   6.020
  494   HE22  GLN  65          2HE2      GLN  65  -4.234  11.048   6.809
  495    H    GLU  66           HN       GLU  66  -0.465  15.120   5.273
  496    HA   GLU  66           HA       GLU  66   1.152  12.715   4.965
  497    HB2  GLU  66          2HB       GLU  66   1.622  15.592   4.853
  498    HB3  GLU  66          3HB       GLU  66   2.838  14.749   5.803
  499    HG2  GLU  66          2HG       GLU  66   3.718  13.710   4.011
  500    HG3  GLU  66          3HG       GLU  66   2.156  13.525   3.213
  501    H    ASN  67           HN       ASN  67  -0.093  14.815   7.448
  502    HA   ASN  67           HA       ASN  67   1.552  13.563   9.503
  503    HB2  ASN  67          2HB       ASN  67   1.362  15.590  10.431
  504    HB3  ASN  67          3HB       ASN  67   0.172  16.073   9.225
  505   HD21  ASN  67          1HD2      ASN  67  -1.859  16.372   9.849
  506   HD22  ASN  67          2HD2      ASN  67  -2.502  15.948  11.395
  507    H    GLU  68           HN       GLU  68  -1.936  14.227   9.123
  508    HA   GLU  68           HA       GLU  68  -2.999  12.687  11.064
  509    HB2  GLU  68          2HB       GLU  68  -3.907  13.688   8.525
  510    HB3  GLU  68          3HB       GLU  68  -4.583  12.090   8.808
  511    HG2  GLU  68          2HG       GLU  68  -4.697  14.026  11.043
  512    HG3  GLU  68          3HG       GLU  68  -5.751  14.315   9.660
  513    H    ILE  69           HN       ILE  69  -1.715  11.518   7.994
  514    HA   ILE  69           HA       ILE  69  -2.482   8.795   8.443
  515    HB   ILE  69           HB       ILE  69  -0.658  10.120   6.454
  516   HG12  ILE  69          2HG1      ILE  69  -3.432   9.122   6.526
  517   HG13  ILE  69          3HG1      ILE  69  -2.720  10.406   5.556
  518   HG21  ILE  69          1HG2      ILE  69   0.352   7.978   6.988
  519   HG22  ILE  69          2HG2      ILE  69  -1.193   7.166   6.741
  520   HG23  ILE  69          3HG2      ILE  69  -0.370   7.929   5.379
  521   HD11  ILE  69          1HD1      ILE  69  -1.806   8.765   4.023
  522   HD12  ILE  69          2HD1      ILE  69  -2.460   7.459   5.011
  523   HD13  ILE  69          3HD1      ILE  69  -3.552   8.570   4.184
  524    H    GLU  70           HN       GLU  70   0.776  10.220   8.126
  525    HA   GLU  70           HA       GLU  70   2.279   8.163   9.076
  526    HB2  GLU  70          2HB       GLU  70   4.003   9.646   9.236
  527    HB3  GLU  70          3HB       GLU  70   2.874  10.654   8.341
  528    HG2  GLU  70          2HG       GLU  70   2.170  11.728  10.405
  529    HG3  GLU  70          3HG       GLU  70   3.266  10.699  11.324
  530    H    CYS  71           HN       CYS  71   0.113  10.153  10.882
  531    HA   CYS  71           HA       CYS  71   1.182   9.671  13.468
  532    HB2  CYS  71          2HB       CYS  71  -1.414  10.705  12.402
  533    HB3  CYS  71          3HB       CYS  71  -1.313  10.246  14.097
  534    HG   CYS  71           HG       CYS  71   1.277  12.115  13.428
  535    H    MET  72           HN       MET  72  -1.286   8.074  11.508
  536    HA   MET  72           HA       MET  72  -1.974   6.189  13.562
  537    HB2  MET  72          2HB       MET  72  -3.620   5.470  12.151
  538    HB3  MET  72          3HB       MET  72  -3.337   7.060  11.454
  539    HG2  MET  72          2HG       MET  72  -1.667   5.854   9.917
  540    HG3  MET  72          3HG       MET  72  -2.481   4.380  10.439
  541    HE1  MET  72          1HE       MET  72  -2.764   3.989   7.904
  542    HE2  MET  72          2HE       MET  72  -3.934   4.817   6.876
  543    HE3  MET  72          3HE       MET  72  -2.383   5.577   7.237
  544    H    VAL  73           HN       VAL  73   0.800   6.509  12.023
  545    HA   VAL  73           HA       VAL  73   1.313   3.618  12.013
  546    HB   VAL  73           HB       VAL  73   3.023   4.361  10.080
  547   HG11  VAL  73          1HG1      VAL  73   0.241   3.788   9.195
  548   HG12  VAL  73          2HG1      VAL  73   1.763   3.060   8.682
  549   HG13  VAL  73          3HG1      VAL  73   1.053   2.618  10.235
  550   HG21  VAL  73          1HG2      VAL  73   1.602   6.656  10.306
  551   HG22  VAL  73          2HG2      VAL  73   2.413   6.133   8.831
  552   HG23  VAL  73          3HG2      VAL  73   0.691   5.823   9.047
  553    H    ALA  74           HN       ALA  74   3.174   6.592  11.373
  554    HA   ALA  74           HA       ALA  74   5.223   5.642  13.239
  555    HB1  ALA  74          1HB       ALA  74   6.762   6.729  11.999
  556    HB2  ALA  74          2HB       ALA  74   5.520   6.616  10.752
  557    HB3  ALA  74          3HB       ALA  74   5.701   8.102  11.684
  558    H    ALA  75           HN       ALA  75   3.066   6.416  14.622
  559    HA   ALA  75           HA       ALA  75   2.440   8.909  15.328
  560    HB1  ALA  75          1HB       ALA  75   2.772   6.429  16.854
  561    HB2  ALA  75          2HB       ALA  75   2.814   7.900  17.826
  562    HB3  ALA  75          3HB       ALA  75   1.420   7.560  16.801
  Start of MODEL   19
    1    H1   ALA   1           HN       ALA   1 -21.882  -7.082   5.281
    2    HA   ALA   1           HA       ALA   1 -23.863  -5.817   5.376
    3    HB1  ALA   1          1HB       ALA   1 -25.457  -6.369   3.274
    4    HB2  ALA   1          2HB       ALA   1 -24.289  -5.048   3.301
    5    HB3  ALA   1          3HB       ALA   1 -23.871  -6.579   2.531
    6    H    LEU   2           HN       LEU   2 -24.517  -8.787   3.508
    7    HA   LEU   2           HA       LEU   2 -26.602  -9.553   5.339
    8    HB2  LEU   2          2HB       LEU   2 -25.631 -10.388   2.718
    9    HB3  LEU   2          3HB       LEU   2 -26.131 -11.737   3.736
   10    HG   LEU   2           HG       LEU   2 -28.267 -10.145   4.041
   11   HD11  LEU   2          1HD1      LEU   2 -27.913  -9.707   1.160
   12   HD12  LEU   2          2HD1      LEU   2 -26.911  -8.696   2.200
   13   HD13  LEU   2          3HD1      LEU   2 -28.665  -8.684   2.384
   14   HD21  LEU   2          1HD2      LEU   2 -27.797 -12.003   1.712
   15   HD22  LEU   2          2HD2      LEU   2 -29.366 -11.515   2.349
   16   HD23  LEU   2          3HD2      LEU   2 -28.276 -12.488   3.339
   17    H    ASP   3           HN       ASP   3 -23.265  -9.923   5.265
   18    HA   ASP   3           HA       ASP   3 -23.048 -11.308   7.636
   19    HB2  ASP   3          2HB       ASP   3 -23.730 -13.380   7.017
   20    HB3  ASP   3          3HB       ASP   3 -23.456 -13.068   5.305
   21    HA   PRO   4           HA       PRO   4 -18.774 -11.542   5.411
   22    HB2  PRO   4          2HB       PRO   4 -18.701 -10.958   2.761
   23    HB3  PRO   4          3HB       PRO   4 -18.973 -12.592   3.377
   24    HG2  PRO   4          2HG       PRO   4 -20.962 -10.585   2.388
   25    HG3  PRO   4          3HG       PRO   4 -20.880 -12.328   2.073
   26    HD2  PRO   4          2HD       PRO   4 -22.571 -11.255   3.896
   27    HD3  PRO   4          3HD       PRO   4 -21.852 -12.867   4.092
   28    H    LEU   5           HN       LEU   5 -17.366  -9.861   3.981
   29    HA   LEU   5           HA       LEU   5 -18.428  -7.168   4.516
   30    HB2  LEU   5          2HB       LEU   5 -15.580  -8.048   4.960
   31    HB3  LEU   5          3HB       LEU   5 -16.256  -6.455   5.291
   32    HG   LEU   5           HG       LEU   5 -15.947  -7.628   7.363
   33   HD11  LEU   5          1HD1      LEU   5 -18.099  -6.279   6.824
   34   HD12  LEU   5          2HD1      LEU   5 -18.017  -7.237   8.302
   35   HD13  LEU   5          3HD1      LEU   5 -18.889  -7.855   6.899
   36   HD21  LEU   5          1HD2      LEU   5 -16.271  -9.813   7.642
   37   HD22  LEU   5          2HD2      LEU   5 -16.521  -9.902   5.897
   38   HD23  LEU   5          3HD2      LEU   5 -17.904  -9.732   6.980
   39    H    VAL   6           HN       VAL   6 -15.427  -8.476   3.110
   40    HA   VAL   6           HA       VAL   6 -14.298  -7.859   1.210
   41    HB   VAL   6           HB       VAL   6 -16.871  -7.914  -0.295
   42   HG11  VAL   6          1HG1      VAL   6 -14.120  -9.074  -0.692
   43   HG12  VAL   6          2HG1      VAL   6 -15.484  -9.399  -1.764
   44   HG13  VAL   6          3HG1      VAL   6 -14.874  -7.753  -1.585
   45   HG21  VAL   6          1HG2      VAL   6 -15.657 -10.391   0.921
   46   HG22  VAL   6          2HG2      VAL   6 -17.107  -9.593   1.530
   47   HG23  VAL   6          3HG2      VAL   6 -17.099 -10.294  -0.088
   48    H    SER   7           HN       SER   7 -13.652  -5.759   1.505
   49    HA   SER   7           HA       SER   7 -15.266  -3.737   0.119
   50    HB2  SER   7          2HB       SER   7 -14.318  -3.680   2.940
   51    HB3  SER   7          3HB       SER   7 -14.220  -2.176   2.026
   52    HG   SER   7           HG       SER   7 -16.539  -2.834   1.453
   53    H    CYS   8           HN       CYS   8 -12.114  -4.332   1.671
   54    HA   CYS   8           HA       CYS   8 -10.666  -2.394   0.276
   55    HB2  CYS   8          2HB       CYS   8  -9.933  -3.743   2.308
   56    HB3  CYS   8          3HB       CYS   8  -9.535  -5.039   1.185
   57    H    LYS   9           HN       LYS   9  -9.365  -2.472  -1.559
   58    HA   LYS   9           HA       LYS   9  -9.864  -4.744  -3.367
   59    HB2  LYS   9          2HB       LYS   9  -9.437  -1.912  -4.298
   60    HB3  LYS   9          3HB       LYS   9 -10.046  -3.278  -5.222
   61    HG2  LYS   9          2HG       LYS   9 -12.134  -2.798  -4.668
   62    HG3  LYS   9          3HG       LYS   9 -11.730  -2.791  -2.949
   63    HD2  LYS   9          2HD       LYS   9 -12.406  -0.621  -3.196
   64    HD3  LYS   9          3HD       LYS   9 -10.690  -0.440  -3.568
   65    HE2  LYS   9          2HE       LYS   9 -11.087   0.065  -5.722
   66    HE3  LYS   9          3HE       LYS   9 -12.366  -1.140  -5.871
   67    HZ1  LYS   9          1HZ       LYS   9 -12.653   1.607  -5.644
   68    HZ2  LYS   9          2HZ       LYS   9 -13.216   0.960  -4.186
   69    HZ3  LYS   9          3HZ       LYS   9 -13.881   0.442  -5.652
   70    H    LEU  10           HN       LEU  10  -7.581  -2.835  -1.772
   71    HA   LEU  10           HA       LEU  10  -5.427  -2.950  -3.606
   72    HB2  LEU  10          2HB       LEU  10  -5.635  -2.533  -0.647
   73    HB3  LEU  10          3HB       LEU  10  -4.061  -2.686  -1.426
   74    HG   LEU  10           HG       LEU  10  -6.121  -0.587  -2.103
   75   HD11  LEU  10          1HD1      LEU  10  -3.555  -0.245  -0.569
   76   HD12  LEU  10          2HD1      LEU  10  -5.138  -0.399   0.191
   77   HD13  LEU  10          3HD1      LEU  10  -4.801   0.965  -0.875
   78   HD21  LEU  10          1HD2      LEU  10  -4.872  -0.139  -3.878
   79   HD22  LEU  10          2HD2      LEU  10  -3.851  -1.528  -3.502
   80   HD23  LEU  10          3HD2      LEU  10  -3.452   0.063  -2.853
   81    H    CYS  11           HN       CYS  11  -6.731  -5.206  -1.301
   82    HA   CYS  11           HA       CYS  11  -4.710  -7.166  -2.150
   83    HB2  CYS  11          2HB       CYS  11  -4.592  -8.081   0.096
   84    HB3  CYS  11          3HB       CYS  11  -4.184  -6.370   0.136
   85    H    LEU  12           HN       LEU  12  -7.772  -6.388  -2.446
   86    HA   LEU  12           HA       LEU  12  -9.777  -7.470  -2.664
   87    HB2  LEU  12          2HB       LEU  12  -7.912  -9.651  -3.586
   88    HB3  LEU  12          3HB       LEU  12  -9.638  -9.564  -3.929
   89    HG   LEU  12           HG       LEU  12  -8.050  -7.233  -4.790
   90   HD11  LEU  12          1HD1      LEU  12  -6.532  -9.133  -5.275
   91   HD12  LEU  12          2HD1      LEU  12  -7.116  -8.310  -6.720
   92   HD13  LEU  12          3HD1      LEU  12  -7.811  -9.860  -6.248
   93   HD21  LEU  12          1HD2      LEU  12  -9.703  -8.633  -6.725
   94   HD22  LEU  12          2HD2      LEU  12  -9.788  -6.964  -6.159
   95   HD23  LEU  12          3HD2      LEU  12 -10.575  -8.249  -5.241
   96    H    GLY  13           HN       GLY  13  -9.113  -7.517  -0.053
   97    HA2  GLY  13          1HA       GLY  13  -9.505 -10.297   0.835
   98    HA3  GLY  13          2HA       GLY  13  -8.900  -8.987   1.837
   99    H    GLU  14           HN       GLU  14 -10.306  -7.773   3.000
  100    HA   GLU  14           HA       GLU  14 -12.932  -7.193   2.523
  101    HB2  GLU  14          2HB       GLU  14 -13.941  -8.956   4.207
  102    HB3  GLU  14          3HB       GLU  14 -13.787  -9.320   2.494
  103    HG2  GLU  14          2HG       GLU  14 -12.319 -10.958   2.853
  104    HG3  GLU  14          3HG       GLU  14 -11.419 -10.019   4.044
  105    H    TYR  15           HN       TYR  15 -11.941  -8.870   5.473
  106    HA   TYR  15           HA       TYR  15 -11.667  -8.157   7.615
  107    HB2  TYR  15          2HB       TYR  15 -10.840  -5.469   6.551
  108    HB3  TYR  15          3HB       TYR  15 -10.260  -6.311   7.983
  109    HD1  TYR  15          1HD       TYR  15 -10.042  -6.107   4.320
  110    HD2  TYR  15          2HD       TYR  15  -8.518  -7.967   7.829
  111    HE1  TYR  15          1HE       TYR  15  -8.145  -6.985   3.023
  112    HE2  TYR  15          2HE       TYR  15  -6.616  -8.849   6.544
  113    HH   TYR  15           HH       TYR  15  -5.495  -7.815   3.974
  114    HA   PRO  16           HA       PRO  16 -15.397  -6.127   8.749
  115    HB2  PRO  16          2HB       PRO  16 -14.835  -5.537  11.338
  116    HB3  PRO  16          3HB       PRO  16 -15.184  -7.178  10.781
  117    HG2  PRO  16          2HG       PRO  16 -12.539  -5.883  11.320
  118    HG3  PRO  16          3HG       PRO  16 -13.094  -7.513  11.745
  119    HD2  PRO  16          2HD       PRO  16 -11.493  -7.026   9.615
  120    HD3  PRO  16          3HD       PRO  16 -12.692  -8.336   9.629
  121    H    VAL  17           HN       VAL  17 -16.276  -4.094   8.956
  122    HA   VAL  17           HA       VAL  17 -15.051  -1.884   7.987
  123    HB   VAL  17           HB       VAL  17 -16.956  -1.466  10.254
  124   HG11  VAL  17          1HG1      VAL  17 -16.188   0.468   9.020
  125   HG12  VAL  17          2HG1      VAL  17 -16.678  -0.275   7.496
  126   HG13  VAL  17          3HG1      VAL  17 -17.896   0.188   8.685
  127   HG21  VAL  17          1HG2      VAL  17 -17.522  -2.930   7.705
  128   HG22  VAL  17          2HG2      VAL  17 -18.046  -3.304   9.347
  129   HG23  VAL  17          3HG2      VAL  17 -18.775  -1.955   8.476
  130    H    GLU  18           HN       GLU  18 -15.186  -2.809  11.415
  131    HA   GLU  18           HA       GLU  18 -13.864  -0.585  12.467
  132    HB2  GLU  18          2HB       GLU  18 -13.133  -2.366  14.259
  133    HB3  GLU  18          3HB       GLU  18 -14.817  -1.879  14.113
  134    HG2  GLU  18          2HG       GLU  18 -13.893  -4.208  12.523
  135    HG3  GLU  18          3HG       GLU  18 -14.105  -4.412  14.261
  136    H    GLN  19           HN       GLN  19 -12.622  -3.506  10.973
  137    HA   GLN  19           HA       GLN  19  -9.879  -2.881  11.647
  138    HB2  GLN  19          2HB       GLN  19 -11.206  -5.070  10.073
  139    HB3  GLN  19          3HB       GLN  19  -9.461  -4.862  10.042
  140    HG2  GLN  19          2HG       GLN  19 -10.564  -6.507  11.727
  141    HG3  GLN  19          3HG       GLN  19  -9.204  -5.502  12.224
  142   HE21  GLN  19          1HE2      GLN  19 -11.964  -6.675  13.312
  143   HE22  GLN  19          2HE2      GLN  19 -12.482  -5.399  14.356
  144    H    MET  20           HN       MET  20 -11.521  -1.028   9.984
  145    HA   MET  20           HA       MET  20  -9.674  -0.869   7.698
  146    HB2  MET  20          2HB       MET  20 -12.471   0.154   7.439
  147    HB3  MET  20          3HB       MET  20 -11.364  -0.395   6.189
  148    HG2  MET  20          2HG       MET  20 -11.654  -2.719   7.234
  149    HG3  MET  20          3HG       MET  20 -13.054  -2.021   8.046
  150    HE1  MET  20          1HE       MET  20 -11.434  -1.863   4.417
  151    HE2  MET  20          2HE       MET  20 -11.617  -3.558   4.867
  152    HE3  MET  20          3HE       MET  20 -12.592  -2.883   3.562
  153    H    THR  21           HN       THR  21  -9.831   1.422   6.686
  154    HA   THR  21           HA       THR  21 -10.223   3.477   8.736
  155    HB   THR  21           HB       THR  21  -7.649   3.002   7.235
  156    HG1  THR  21          1HG       THR  21  -8.383   3.168   9.979
  157   HG21  THR  21          1HG2      THR  21  -7.019   5.172   8.581
  158   HG22  THR  21          2HG2      THR  21  -8.748   5.498   8.449
  159   HG23  THR  21          3HG2      THR  21  -7.775   5.288   6.993
  160    H    THR  22           HN       THR  22 -10.627   5.549   7.935
  161    HA   THR  22           HA       THR  22 -11.614   5.593   5.202
  162    HB   THR  22           HB       THR  22 -11.816   7.640   7.419
  163    HG1  THR  22          1HG       THR  22 -13.086   5.458   7.214
  164   HG21  THR  22          1HG2      THR  22 -13.194   7.644   4.732
  165   HG22  THR  22          2HG2      THR  22 -11.814   8.659   5.150
  166   HG23  THR  22          3HG2      THR  22 -13.345   8.855   6.002
  167    H    ILE  23           HN       ILE  23 -10.945   7.020   3.606
  168    HA   ILE  23           HA       ILE  23  -8.203   7.647   3.527
  169    HB   ILE  23           HB       ILE  23 -10.491   8.587   1.801
  170   HG12  ILE  23          2HG1      ILE  23 -10.010   6.202   1.647
  171   HG13  ILE  23          3HG1      ILE  23  -9.502   7.011   0.169
  172   HG21  ILE  23          1HG2      ILE  23  -7.887   9.694   2.004
  173   HG22  ILE  23          2HG2      ILE  23  -7.998   8.835   0.469
  174   HG23  ILE  23          3HG2      ILE  23  -9.167  10.096   0.860
  175   HD11  ILE  23          1HD1      ILE  23  -7.785   5.513   0.661
  176   HD12  ILE  23          2HD1      ILE  23  -7.179   7.076   1.210
  177   HD13  ILE  23          3HD1      ILE  23  -7.807   5.913   2.378
  178    H    ALA  24           HN       ALA  24 -10.543  10.176   2.826
  179    HA   ALA  24           HA       ALA  24 -10.465  11.824   4.962
  180    HB1  ALA  24          1HB       ALA  24  -8.188  11.965   5.250
  181    HB2  ALA  24          2HB       ALA  24  -7.854  11.901   3.519
  182    HB3  ALA  24          3HB       ALA  24  -8.492  13.379   4.241
  183    H    GLN  25           HN       GLN  25  -9.861  11.747   1.489
  184    HA   GLN  25           HA       GLN  25 -11.436  14.205   1.174
  185    HB2  GLN  25          2HB       GLN  25  -9.171  13.043  -0.249
  186    HB3  GLN  25          3HB       GLN  25 -10.469  13.528  -1.331
  187    HG2  GLN  25          2HG       GLN  25  -9.216  15.319   0.738
  188    HG3  GLN  25          3HG       GLN  25  -8.758  15.276  -0.964
  189   HE21  GLN  25          1HE2      GLN  25 -10.688  16.748   1.298
  190   HE22  GLN  25          2HE2      GLN  25 -11.814  17.518   0.239
  191    H    CYS  26           HN       CYS  26 -11.045  11.015  -0.372
  192    HA   CYS  26           HA       CYS  26 -13.630  11.217  -1.638
  193    HB2  CYS  26          2HB       CYS  26 -13.124   8.963  -2.505
  194    HB3  CYS  26          3HB       CYS  26 -11.807  10.093  -2.807
  195    H    GLN  27           HN       GLN  27 -12.241   9.650   1.166
  196    HA   GLN  27           HA       GLN  27 -13.286   8.818   3.030
  197    HB2  GLN  27          2HB       GLN  27 -15.950   8.963   1.651
  198    HB3  GLN  27          3HB       GLN  27 -15.594   9.056   3.370
  199    HG2  GLN  27          2HG       GLN  27 -15.343  11.156   1.270
  200    HG3  GLN  27          3HG       GLN  27 -16.123  11.233   2.848
  201   HE21  GLN  27          1HE2      GLN  27 -13.975  10.113   4.330
  202   HE22  GLN  27          2HE2      GLN  27 -12.705  11.283   4.375
  203    H    CYS  28           HN       CYS  28 -12.107   7.150   1.249
  204    HA   CYS  28           HA       CYS  28 -13.938   4.978   0.628
  205    HB2  CYS  28          2HB       CYS  28 -11.016   5.466   0.084
  206    HB3  CYS  28          3HB       CYS  28 -11.760   3.898  -0.212
  207    H    ILE  29           HN       ILE  29 -12.704   2.706   1.054
  208    HA   ILE  29           HA       ILE  29 -11.865   2.663   3.870
  209    HB   ILE  29           HB       ILE  29 -14.361   1.816   3.049
  210   HG12  ILE  29          2HG1      ILE  29 -12.965   0.608   5.423
  211   HG13  ILE  29          3HG1      ILE  29 -13.317   2.332   5.365
  212   HG21  ILE  29          1HG2      ILE  29 -13.385  -0.097   1.892
  213   HG22  ILE  29          2HG2      ILE  29 -12.590  -0.602   3.383
  214   HG23  ILE  29          3HG2      ILE  29 -14.351  -0.618   3.273
  215   HD11  ILE  29          1HD1      ILE  29 -15.702   1.072   4.669
  216   HD12  ILE  29          2HD1      ILE  29 -15.043   0.134   6.010
  217   HD13  ILE  29          3HD1      ILE  29 -15.311   1.868   6.193
  218    H    PHE  30           HN       PHE  30 -10.118   1.453   4.248
  219    HA   PHE  30           HA       PHE  30  -9.487  -0.830   2.583
  220    HB2  PHE  30          2HB       PHE  30  -7.638   1.561   2.728
  221    HB3  PHE  30          3HB       PHE  30  -7.209  -0.005   2.045
  222    HD1  PHE  30          1HD       PHE  30  -8.919   3.133   1.507
  223    HD2  PHE  30          2HD       PHE  30  -8.317  -0.794  -0.021
  224    HE1  PHE  30          1HE       PHE  30  -9.802   3.851  -0.674
  225    HE2  PHE  30          2HE       PHE  30  -9.199  -0.082  -2.205
  226    HZ   PHE  30           HZ       PHE  30  -9.942   2.242  -2.534
  227    H    CYS  31           HN       CYS  31  -8.336  -2.353   3.656
  228    HA   CYS  31           HA       CYS  31  -8.166  -2.291   6.433
  229    HB2  CYS  31          2HB       CYS  31  -7.046  -4.379   6.294
  230    HB3  CYS  31          3HB       CYS  31  -8.134  -4.327   4.911
  231    H    THR  32           HN       THR  32  -6.711  -1.553   7.852
  232    HA   THR  32           HA       THR  32  -4.914   0.373   7.489
  233    HB   THR  32           HB       THR  32  -4.212  -1.937   9.298
  234    HG1  THR  32          1HG       THR  32  -6.288  -0.044   9.451
  235   HG21  THR  32          1HG2      THR  32  -3.308   0.817   8.966
  236   HG22  THR  32          2HG2      THR  32  -2.552  -0.526   9.825
  237   HG23  THR  32          3HG2      THR  32  -3.790   0.444  10.621
  238    H    LEU  33           HN       LEU  33  -3.846  -3.035   7.535
  239    HA   LEU  33           HA       LEU  33  -1.269  -2.905   6.892
  240    HB2  LEU  33          2HB       LEU  33  -3.336  -4.678   5.610
  241    HB3  LEU  33          3HB       LEU  33  -1.602  -4.904   5.394
  242    HG   LEU  33           HG       LEU  33  -2.521  -4.794   8.190
  243   HD11  LEU  33          1HD1      LEU  33  -3.275  -7.168   8.101
  244   HD12  LEU  33          2HD1      LEU  33  -3.314  -7.036   6.343
  245   HD13  LEU  33          3HD1      LEU  33  -4.375  -6.028   7.325
  246   HD21  LEU  33          1HD2      LEU  33  -0.710  -6.102   8.548
  247   HD22  LEU  33          2HD2      LEU  33  -0.212  -5.432   6.994
  248   HD23  LEU  33          3HD2      LEU  33  -0.950  -7.033   7.070
  249    H    CYS  34           HN       CYS  34  -3.618  -3.140   4.218
  250    HA   CYS  34           HA       CYS  34  -1.863  -2.358   2.205
  251    HB2  CYS  34          2HB       CYS  34  -4.866  -2.021   2.340
  252    HB3  CYS  34          3HB       CYS  34  -3.902  -1.864   0.876
  253    H    LEU  35           HN       LEU  35  -4.420  -0.349   3.679
  254    HA   LEU  35           HA       LEU  35  -3.743   2.061   2.518
  255    HB2  LEU  35          2HB       LEU  35  -5.688   1.349   4.132
  256    HB3  LEU  35          3HB       LEU  35  -4.621   2.015   5.368
  257    HG   LEU  35           HG       LEU  35  -4.685   4.188   4.298
  258   HD11  LEU  35          1HD1      LEU  35  -6.714   4.069   2.432
  259   HD12  LEU  35          2HD1      LEU  35  -5.737   2.645   2.077
  260   HD13  LEU  35          3HD1      LEU  35  -4.992   4.243   2.095
  261   HD21  LEU  35          1HD2      LEU  35  -7.356   2.896   4.789
  262   HD22  LEU  35          2HD2      LEU  35  -7.164   4.626   4.506
  263   HD23  LEU  35          3HD2      LEU  35  -6.394   3.869   5.902
  264    H    LYS  36           HN       LYS  36  -1.977   0.263   4.796
  265    HA   LYS  36           HA       LYS  36  -0.483   2.564   5.782
  266    HB2  LYS  36          2HB       LYS  36  -1.057   0.827   7.389
  267    HB3  LYS  36          3HB       LYS  36  -0.251  -0.387   6.402
  268    HG2  LYS  36          2HG       LYS  36   1.457   1.867   7.144
  269    HG3  LYS  36          3HG       LYS  36   0.865   0.924   8.512
  270    HD2  LYS  36          2HD       LYS  36   1.590  -1.093   6.944
  271    HD3  LYS  36          3HD       LYS  36   2.679   0.135   6.295
  272    HE2  LYS  36          2HE       LYS  36   3.088   0.542   8.903
  273    HE3  LYS  36          3HE       LYS  36   2.633  -1.160   8.960
  274    HZ1  LYS  36          1HZ       LYS  36   5.097  -0.508   8.631
  275    HZ2  LYS  36          2HZ       LYS  36   4.651  -0.253   7.021
  276    HZ3  LYS  36          3HZ       LYS  36   4.451  -1.779   7.720
  277    H    GLN  37           HN       GLN  37   0.581  -0.621   4.591
  278    HA   GLN  37           HA       GLN  37   3.132  -0.004   3.880
  279    HB2  GLN  37          2HB       GLN  37   1.302  -2.101   3.309
  280    HB3  GLN  37          3HB       GLN  37   2.085  -1.657   1.798
  281    HG2  GLN  37          2HG       GLN  37   3.923  -2.734   2.379
  282    HG3  GLN  37          3HG       GLN  37   4.044  -1.804   3.872
  283   HE21  GLN  37          1HE2      GLN  37   2.515  -4.623   2.412
  284   HE22  GLN  37          2HE2      GLN  37   2.367  -5.527   3.876
  285    H    TYR  38           HN       TYR  38   0.255   1.115   2.376
  286    HA   TYR  38           HA       TYR  38   1.513   1.844  -0.119
  287    HB2  TYR  38          2HB       TYR  38  -0.650   1.641  -0.697
  288    HB3  TYR  38          3HB       TYR  38  -1.195   1.796   0.969
  289    HD1  TYR  38          1HD       TYR  38   0.613   4.197  -1.247
  290    HD2  TYR  38          2HD       TYR  38  -2.911   3.353   0.983
  291    HE1  TYR  38          1HE       TYR  38  -0.232   6.454  -1.740
  292    HE2  TYR  38          2HE       TYR  38  -3.766   5.607   0.496
  293    HH   TYR  38           HH       TYR  38  -1.867   7.918  -1.423
  294    H    VAL  39           HN       VAL  39   0.139   3.619   2.648
  295    HA   VAL  39           HA       VAL  39   1.248   6.120   1.723
  296    HB   VAL  39           HB       VAL  39   0.265   7.109   3.703
  297   HG11  VAL  39          1HG1      VAL  39  -1.726   7.098   2.713
  298   HG12  VAL  39          2HG1      VAL  39  -1.146   5.784   1.687
  299   HG13  VAL  39          3HG1      VAL  39  -2.009   5.422   3.184
  300   HG21  VAL  39          1HG2      VAL  39  -0.145   4.255   4.556
  301   HG22  VAL  39          2HG2      VAL  39   0.716   5.538   5.407
  302   HG23  VAL  39          3HG2      VAL  39  -1.041   5.597   5.266
  303    H    GLU  40           HN       GLU  40   1.738   4.024   4.564
  304    HA   GLU  40           HA       GLU  40   3.612   5.253   6.003
  305    HB2  GLU  40          2HB       GLU  40   2.794   2.662   5.823
  306    HB3  GLU  40          3HB       GLU  40   4.468   2.520   5.303
  307    HG2  GLU  40          2HG       GLU  40   4.432   4.169   7.597
  308    HG3  GLU  40          3HG       GLU  40   3.429   2.760   7.934
  309    H    LEU  41           HN       LEU  41   4.135   3.923   2.800
  310    HA   LEU  41           HA       LEU  41   6.976   4.449   2.851
  311    HB2  LEU  41          2HB       LEU  41   5.196   2.902   1.279
  312    HB3  LEU  41          3HB       LEU  41   6.005   4.041   0.205
  313    HG   LEU  41           HG       LEU  41   8.157   3.173   0.798
  314   HD11  LEU  41          1HD1      LEU  41   8.073   2.712   3.075
  315   HD12  LEU  41          2HD1      LEU  41   8.190   1.113   2.341
  316   HD13  LEU  41          3HD1      LEU  41   6.633   1.706   2.920
  317   HD21  LEU  41          1HD2      LEU  41   7.233   1.912  -0.937
  318   HD22  LEU  41          2HD2      LEU  41   6.074   1.120   0.130
  319   HD23  LEU  41          3HD2      LEU  41   7.785   0.704   0.221
  320    H    LEU  42           HN       LEU  42   4.105   5.822   1.289
  321    HA   LEU  42           HA       LEU  42   5.598   7.900  -0.018
  322    HB2  LEU  42          2HB       LEU  42   2.665   7.364   0.350
  323    HB3  LEU  42          3HB       LEU  42   3.260   8.822  -0.441
  324    HG   LEU  42           HG       LEU  42   3.990   6.074  -1.417
  325   HD11  LEU  42          1HD1      LEU  42   2.141   6.744  -3.174
  326   HD12  LEU  42          2HD1      LEU  42   1.471   7.605  -1.788
  327   HD13  LEU  42          3HD1      LEU  42   1.737   5.864  -1.700
  328   HD21  LEU  42          1HD2      LEU  42   4.279   8.870  -2.367
  329   HD22  LEU  42          2HD2      LEU  42   3.971   7.621  -3.575
  330   HD23  LEU  42          3HD2      LEU  42   5.380   7.500  -2.519
  331    H    ILE  43           HN       ILE  43   2.968   8.086   2.389
  332    HA   ILE  43           HA       ILE  43   3.084  10.659   3.150
  333    HB   ILE  43           HB       ILE  43   2.059   8.341   4.305
  334   HG12  ILE  43          2HG1      ILE  43   1.147  10.262   5.960
  335   HG13  ILE  43          3HG1      ILE  43   1.810  11.272   4.681
  336   HG21  ILE  43          1HG2      ILE  43   3.718   9.836   6.332
  337   HG22  ILE  43          2HG2      ILE  43   2.580   8.534   6.675
  338   HG23  ILE  43          3HG2      ILE  43   4.040   8.207   5.741
  339   HD11  ILE  43          1HD1      ILE  43   0.224   9.106   3.615
  340   HD12  ILE  43          2HD1      ILE  43  -0.691  10.107   4.743
  341   HD13  ILE  43          3HD1      ILE  43   0.095  10.844   3.347
  342    H    LYS  44           HN       LYS  44   5.523   8.258   3.781
  343    HA   LYS  44           HA       LYS  44   6.943   9.759   5.756
  344    HB2  LYS  44          2HB       LYS  44   7.150   7.176   4.512
  345    HB3  LYS  44          3HB       LYS  44   8.719   7.971   4.476
  346    HG2  LYS  44          2HG       LYS  44   8.390   6.564   6.470
  347    HG3  LYS  44          3HG       LYS  44   8.685   8.260   6.864
  348    HD2  LYS  44          2HD       LYS  44   6.873   8.076   8.171
  349    HD3  LYS  44          3HD       LYS  44   5.956   8.176   6.667
  350    HE2  LYS  44          2HE       LYS  44   5.135   6.153   7.073
  351    HE3  LYS  44          3HE       LYS  44   6.765   5.493   6.944
  352    HZ1  LYS  44          1HZ       LYS  44   5.141   5.892   9.269
  353    HZ2  LYS  44          2HZ       LYS  44   6.690   6.546   9.448
  354    HZ3  LYS  44          3HZ       LYS  44   6.502   4.909   9.061
  355    H    GLU  45           HN       GLU  45   7.582   9.049   2.320
  356    HA   GLU  45           HA       GLU  45   9.830  10.738   2.109
  357    HB2  GLU  45          2HB       GLU  45   8.555   8.916   0.466
  358    HB3  GLU  45          3HB       GLU  45   8.301  10.447  -0.360
  359    HG2  GLU  45          2HG       GLU  45  10.278   9.811  -1.288
  360    HG3  GLU  45          3HG       GLU  45  10.869  10.747   0.083
  361    H    GLY  46           HN       GLY  46   6.620  11.251   0.630
  362    HA2  GLY  46          1HA       GLY  46   5.395  13.171   0.322
  363    HA3  GLY  46          2HA       GLY  46   6.328  13.888   1.627
  364    H    LEU  47           HN       LEU  47   7.040  12.772  -1.687
  365    HA   LEU  47           HA       LEU  47   8.668  15.167  -2.083
  366    HB2  LEU  47          2HB       LEU  47   9.284  13.979  -4.237
  367    HB3  LEU  47          3HB       LEU  47   9.824  13.240  -2.730
  368    HG   LEU  47           HG       LEU  47   7.279  12.287  -3.956
  369   HD11  LEU  47          1HD1      LEU  47   9.209  12.475  -5.693
  370   HD12  LEU  47          2HD1      LEU  47   8.276  10.984  -5.572
  371   HD13  LEU  47          3HD1      LEU  47   9.872  11.089  -4.827
  372   HD21  LEU  47          1HD2      LEU  47   9.173  11.458  -1.925
  373   HD22  LEU  47          2HD2      LEU  47   8.841  10.173  -3.087
  374   HD23  LEU  47          3HD2      LEU  47   7.514  10.931  -2.206
  375    H    GLU  48           HN       GLU  48   5.698  13.690  -3.127
  376    HA   GLU  48           HA       GLU  48   4.508  15.988  -4.055
  377    HB2  GLU  48          2HB       GLU  48   4.614  15.527  -6.572
  378    HB3  GLU  48          3HB       GLU  48   6.025  16.265  -5.825
  379    HG2  GLU  48          2HG       GLU  48   7.113  14.070  -5.738
  380    HG3  GLU  48          3HG       GLU  48   5.708  13.356  -6.529
  381    H    THR  49           HN       THR  49   4.868  12.545  -4.257
  382    HA   THR  49           HA       THR  49   2.716  11.614  -5.593
  383    HB   THR  49           HB       THR  49   3.312  10.578  -2.826
  384    HG1  THR  49          1HG       THR  49   4.740   9.928  -5.202
  385   HG21  THR  49          1HG2      THR  49   2.139   8.778  -3.447
  386   HG22  THR  49          2HG2      THR  49   2.993   8.667  -4.986
  387   HG23  THR  49          3HG2      THR  49   1.589   9.723  -4.830
  388    H    ALA  50           HN       ALA  50   2.646  13.492  -2.683
  389    HA   ALA  50           HA       ALA  50   0.958  14.276  -1.364
  390    HB1  ALA  50          1HB       ALA  50  -1.229  14.665  -2.749
  391    HB2  ALA  50          2HB       ALA  50   0.225  15.605  -3.088
  392    HB3  ALA  50          3HB       ALA  50  -0.197  14.232  -4.112
  393    H    ILE  51           HN       ILE  51   1.203  11.253  -1.910
  394    HA   ILE  51           HA       ILE  51  -0.016   9.319  -1.572
  395    HB   ILE  51           HB       ILE  51  -0.752  10.987   0.835
  396   HG12  ILE  51          2HG1      ILE  51   1.134   9.860   1.910
  397   HG13  ILE  51          3HG1      ILE  51   1.452   8.951   0.436
  398   HG21  ILE  51          1HG2      ILE  51  -2.251   9.074   0.576
  399   HG22  ILE  51          2HG2      ILE  51  -0.860   7.996   0.471
  400   HG23  ILE  51          3HG2      ILE  51  -1.185   8.870   1.966
  401   HD11  ILE  51          1HD1      ILE  51   1.443  11.899   0.226
  402   HD12  ILE  51          2HD1      ILE  51   2.787  11.146   1.083
  403   HD13  ILE  51          3HD1      ILE  51   2.449  10.702  -0.589
  404    H    SER  52           HN       SER  52  -1.502   9.458  -3.318
  405    HA   SER  52           HA       SER  52  -4.155  10.529  -2.678
  406    HB2  SER  52          2HB       SER  52  -3.950   9.443  -5.343
  407    HB3  SER  52          3HB       SER  52  -4.269  11.103  -4.842
  408    HG   SER  52           HG       SER  52  -2.119  10.225  -6.007
  409    H    CYS  53           HN       CYS  53  -6.043   9.273  -2.974
  410    HA   CYS  53           HA       CYS  53  -6.277   6.899  -1.801
  411    HB2  CYS  53          2HB       CYS  53  -8.200   8.125  -2.690
  412    HB3  CYS  53          3HB       CYS  53  -7.747   7.671  -4.330
  413    HA   PRO  54           HA       PRO  54  -3.919   3.931  -4.065
  414    HB2  PRO  54          2HB       PRO  54  -4.955   1.693  -2.930
  415    HB3  PRO  54          3HB       PRO  54  -3.813   2.754  -2.096
  416    HG2  PRO  54          2HG       PRO  54  -6.795   2.621  -1.861
  417    HG3  PRO  54          3HG       PRO  54  -5.578   2.786  -0.581
  418    HD2  PRO  54          2HD       PRO  54  -6.992   4.893  -1.528
  419    HD3  PRO  54          3HD       PRO  54  -5.323   5.049  -0.942
  420    H    ASP  55           HN       ASP  55  -7.097   4.622  -4.561
  421    HA   ASP  55           HA       ASP  55  -7.465   2.428  -6.490
  422    HB2  ASP  55          2HB       ASP  55  -9.238   2.484  -4.842
  423    HB3  ASP  55          3HB       ASP  55  -9.508   4.200  -5.137
  424    H    ALA  56           HN       ALA  56  -6.278   3.366  -8.165
  425    HA   ALA  56           HA       ALA  56  -6.457   5.986  -9.081
  426    HB1  ALA  56          1HB       ALA  56  -4.764   5.066 -10.214
  427    HB2  ALA  56          2HB       ALA  56  -5.459   3.447 -10.120
  428    HB3  ALA  56          3HB       ALA  56  -5.996   4.565 -11.374
  429    H    ALA  57           HN       ALA  57  -8.821   3.574  -9.127
  430    HA   ALA  57           HA       ALA  57 -10.260   4.820 -11.363
  431    HB1  ALA  57          1HB       ALA  57 -11.092   2.299  -9.963
  432    HB2  ALA  57          2HB       ALA  57 -11.507   2.853 -11.586
  433    HB3  ALA  57          3HB       ALA  57  -9.870   2.296 -11.237
  434    H    CYS  58           HN       CYS  58  -9.951   5.689  -8.418
  435    HA   CYS  58           HA       CYS  58 -12.551   5.503  -7.270
  436    HB2  CYS  58          2HB       CYS  58 -10.363   5.942  -6.044
  437    HB3  CYS  58          3HB       CYS  58 -10.476   7.598  -6.631
  438    HA   PRO  59           HA       PRO  59 -14.583   8.623  -9.653
  439    HB2  PRO  59          2HB       PRO  59 -16.748   8.941  -8.045
  440    HB3  PRO  59          3HB       PRO  59 -16.534   7.541  -9.102
  441    HG2  PRO  59          2HG       PRO  59 -16.003   7.797  -6.167
  442    HG3  PRO  59          3HG       PRO  59 -16.775   6.469  -7.053
  443    HD2  PRO  59          2HD       PRO  59 -14.191   6.375  -6.248
  444    HD3  PRO  59          3HD       PRO  59 -14.757   5.581  -7.730
  445    H    LYS  60           HN       LYS  60 -13.382   9.019  -6.476
  446    HA   LYS  60           HA       LYS  60 -13.712  11.939  -6.702
  447    HB2  LYS  60          2HB       LYS  60 -14.366  10.131  -4.498
  448    HB3  LYS  60          3HB       LYS  60 -13.335  11.468  -4.006
  449    HG2  LYS  60          2HG       LYS  60 -15.558  12.290  -5.702
  450    HG3  LYS  60          3HG       LYS  60 -16.063  11.533  -4.188
  451    HD2  LYS  60          2HD       LYS  60 -15.843  13.670  -3.442
  452    HD3  LYS  60          3HD       LYS  60 -14.172  13.145  -3.223
  453    HE2  LYS  60          2HE       LYS  60 -13.543  14.818  -4.543
  454    HE3  LYS  60          3HE       LYS  60 -14.351  14.003  -5.880
  455    HZ1  LYS  60          1HZ       LYS  60 -15.965  15.653  -4.075
  456    HZ2  LYS  60          2HZ       LYS  60 -16.168  15.348  -5.726
  457    HZ3  LYS  60          3HZ       LYS  60 -14.981  16.436  -5.207
  458    H    GLN  61           HN       GLN  61 -11.622   9.261  -6.188
  459    HA   GLN  61           HA       GLN  61  -9.414   9.114  -5.511
  460    HB2  GLN  61          2HB       GLN  61  -8.892  11.401  -7.354
  461    HB3  GLN  61          3HB       GLN  61  -8.057   9.859  -7.221
  462    HG2  GLN  61          2HG       GLN  61  -9.718   8.731  -8.436
  463    HG3  GLN  61          3HG       GLN  61 -10.857  10.066  -8.273
  464   HE21  GLN  61          1HE2      GLN  61  -7.469  10.425  -9.060
  465   HE22  GLN  61          2HE2      GLN  61  -7.706  10.986 -10.677
  466    H    GLY  62           HN       GLY  62  -9.968  10.043  -3.350
  467    HA2  GLY  62          1HA       GLY  62  -9.217  12.815  -2.921
  468    HA3  GLY  62          2HA       GLY  62  -9.787  11.685  -1.701
  469    H    HIS  63           HN       HIS  63  -7.590  13.479  -1.417
  470    HA   HIS  63           HA       HIS  63  -5.243  11.729  -1.511
  471    HB2  HIS  63          2HB       HIS  63  -5.631  14.688  -1.218
  472    HB3  HIS  63          3HB       HIS  63  -4.130  13.944  -0.673
  473    HD1  HIS  63          1HD       HIS  63  -5.510  15.524  -3.529
  474    HD2  HIS  63          2HD       HIS  63  -2.998  12.267  -2.945
  475    HE1  HIS  63          1HE       HIS  63  -4.337  15.177  -5.726
  476    H    LEU  64           HN       LEU  64  -3.772  11.798   0.406
  477    HA   LEU  64           HA       LEU  64  -5.369  11.649   2.873
  478    HB2  LEU  64          2HB       LEU  64  -2.818  10.251   2.090
  479    HB3  LEU  64          3HB       LEU  64  -3.544  10.161   3.693
  480    HG   LEU  64           HG       LEU  64  -3.918   8.237   1.986
  481   HD11  LEU  64          1HD1      LEU  64  -5.545   9.392   4.072
  482   HD12  LEU  64          2HD1      LEU  64  -5.210   7.699   3.710
  483   HD13  LEU  64          3HD1      LEU  64  -6.530   8.532   2.888
  484   HD21  LEU  64          1HD2      LEU  64  -5.774   8.484   0.517
  485   HD22  LEU  64          2HD2      LEU  64  -4.668   9.819   0.191
  486   HD23  LEU  64          3HD2      LEU  64  -6.131  10.096   1.137
  487    H    GLN  65           HN       GLN  65  -4.238  12.201   4.891
  488    HA   GLN  65           HA       GLN  65  -2.755  14.671   4.551
  489    HB2  GLN  65          2HB       GLN  65  -3.149  13.750   7.295
  490    HB3  GLN  65          3HB       GLN  65  -3.611  15.270   6.541
  491    HG2  GLN  65          2HG       GLN  65  -5.649  14.392   7.111
  492    HG3  GLN  65          3HG       GLN  65  -5.486  13.854   5.441
  493   HE21  GLN  65          1HE2      GLN  65  -3.370  11.922   6.439
  494   HE22  GLN  65          2HE2      GLN  65  -4.282  10.598   7.072
  495    H    GLU  66           HN       GLU  66  -0.796  15.118   5.757
  496    HA   GLU  66           HA       GLU  66   0.996  12.821   5.720
  497    HB2  GLU  66          2HB       GLU  66   1.348  15.785   5.671
  498    HB3  GLU  66          3HB       GLU  66   2.673  14.794   6.266
  499    HG2  GLU  66          2HG       GLU  66   2.060  13.492   3.977
  500    HG3  GLU  66          3HG       GLU  66   1.652  15.149   3.539
  501    H    ASN  67           HN       ASN  67  -0.678  14.802   7.961
  502    HA   ASN  67           HA       ASN  67   1.075  14.092  10.181
  503    HB2  ASN  67          2HB       ASN  67  -0.258  15.596  11.512
  504    HB3  ASN  67          3HB       ASN  67   0.114  16.393   9.986
  505   HD21  ASN  67          1HD2      ASN  67  -2.155  16.412  12.085
  506   HD22  ASN  67          2HD2      ASN  67  -3.580  16.411  11.110
  507    H    GLU  68           HN       GLU  68  -2.343  13.702   9.260
  508    HA   GLU  68           HA       GLU  68  -3.127  12.102  11.404
  509    HB2  GLU  68          2HB       GLU  68  -4.231  12.944   8.899
  510    HB3  GLU  68          3HB       GLU  68  -4.534  11.225   9.103
  511    HG2  GLU  68          2HG       GLU  68  -5.073  12.824  11.490
  512    HG3  GLU  68          3HG       GLU  68  -6.082  13.226  10.100
  513    H    ILE  69           HN       ILE  69  -2.475  10.927   8.098
  514    HA   ILE  69           HA       ILE  69  -2.444   8.245   8.548
  515    HB   ILE  69           HB       ILE  69  -0.650   9.841   6.724
  516   HG12  ILE  69          2HG1      ILE  69  -3.384   8.786   6.602
  517   HG13  ILE  69          3HG1      ILE  69  -2.632  10.073   5.668
  518   HG21  ILE  69          1HG2      ILE  69  -0.210   7.728   5.543
  519   HG22  ILE  69          2HG2      ILE  69   0.437   7.726   7.182
  520   HG23  ILE  69          3HG2      ILE  69  -1.052   6.854   6.821
  521   HD11  ILE  69          1HD1      ILE  69  -1.613   8.419   4.202
  522   HD12  ILE  69          2HD1      ILE  69  -2.351   7.124   5.144
  523   HD13  ILE  69          3HD1      ILE  69  -3.368   8.250   4.244
  524    H    GLU  70           HN       GLU  70   0.527  10.227   8.568
  525    HA   GLU  70           HA       GLU  70   2.263   8.311   9.533
  526    HB2  GLU  70          2HB       GLU  70   3.766  10.050  10.008
  527    HB3  GLU  70          3HB       GLU  70   2.766  10.685   8.709
  528    HG2  GLU  70          2HG       GLU  70   1.576  12.089  10.163
  529    HG3  GLU  70          3HG       GLU  70   2.173  11.249  11.593
  530    H    CYS  71           HN       CYS  71  -0.305   9.852  11.167
  531    HA   CYS  71           HA       CYS  71   0.719   9.587  13.827
  532    HB2  CYS  71          2HB       CYS  71  -1.323  11.010  12.741
  533    HB3  CYS  71          3HB       CYS  71  -2.210   9.666  13.448
  534    HG   CYS  71           HG       CYS  71  -1.346  10.103  16.038
  535    H    MET  72           HN       MET  72  -1.122   7.582  11.640
  536    HA   MET  72           HA       MET  72  -1.730   5.640  13.717
  537    HB2  MET  72          2HB       MET  72  -3.197   4.666  12.230
  538    HB3  MET  72          3HB       MET  72  -3.214   6.331  11.664
  539    HG2  MET  72          2HG       MET  72  -1.141   5.194  10.249
  540    HG3  MET  72          3HG       MET  72  -2.349   3.913  10.320
  541    HE1  MET  72          1HE       MET  72  -2.016   4.320   7.562
  542    HE2  MET  72          2HE       MET  72  -3.544   3.645   8.130
  543    HE3  MET  72          3HE       MET  72  -3.541   4.911   6.902
  544    H    VAL  73           HN       VAL  73   0.949   6.368  12.028
  545    HA   VAL  73           HA       VAL  73   1.902   3.590  12.124
  546    HB   VAL  73           HB       VAL  73   3.352   4.192  10.096
  547   HG11  VAL  73          1HG1      VAL  73   0.374   3.842   9.766
  548   HG12  VAL  73          2HG1      VAL  73   1.585   3.524   8.522
  549   HG13  VAL  73          3HG1      VAL  73   1.559   2.557   9.998
  550   HG21  VAL  73          1HG2      VAL  73   1.512   6.505  10.216
  551   HG22  VAL  73          2HG2      VAL  73   3.165   6.400   9.611
  552   HG23  VAL  73          3HG2      VAL  73   1.825   5.820   8.622
  553    H    ALA  74           HN       ALA  74   3.085   6.903  11.508
  554    HA   ALA  74           HA       ALA  74   5.533   6.315  12.961
  555    HB1  ALA  74          1HB       ALA  74   6.262   8.528  12.219
  556    HB2  ALA  74          2HB       ALA  74   5.682   7.554  10.868
  557    HB3  ALA  74          3HB       ALA  74   4.664   8.828  11.539
  558    H    ALA  75           HN       ALA  75   2.652   6.818  14.085
  559    HA   ALA  75           HA       ALA  75   2.359   9.041  15.571
  560    HB1  ALA  75          1HB       ALA  75   1.356   6.430  15.691
  561    HB2  ALA  75          2HB       ALA  75   1.903   6.812  17.324
  562    HB3  ALA  75          3HB       ALA  75   0.737   7.859  16.519
  Start of MODEL   20
    1    H1   ALA   1           HN       ALA   1 -24.955 -19.531   0.222
    2    HA   ALA   1           HA       ALA   1 -22.772 -20.724  -0.174
    3    HB1  ALA   1          1HB       ALA   1 -24.608 -20.068  -2.456
    4    HB2  ALA   1          2HB       ALA   1 -23.238 -21.164  -2.646
    5    HB3  ALA   1          3HB       ALA   1 -24.520 -21.545  -1.497
    6    H    LEU   2           HN       LEU   2 -20.761 -19.934  -0.144
    7    HA   LEU   2           HA       LEU   2 -18.873 -18.808  -0.727
    8    HB2  LEU   2          2HB       LEU   2 -19.688 -20.059  -2.922
    9    HB3  LEU   2          3HB       LEU   2 -19.864 -18.403  -3.498
   10    HG   LEU   2           HG       LEU   2 -17.295 -18.633  -2.318
   11   HD11  LEU   2          1HD1      LEU   2 -18.033 -20.905  -4.141
   12   HD12  LEU   2          2HD1      LEU   2 -17.282 -20.980  -2.549
   13   HD13  LEU   2          3HD1      LEU   2 -16.373 -20.353  -3.923
   14   HD21  LEU   2          1HD2      LEU   2 -16.598 -17.715  -4.307
   15   HD22  LEU   2          2HD2      LEU   2 -18.302 -17.258  -4.301
   16   HD23  LEU   2          3HD2      LEU   2 -17.760 -18.634  -5.265
   17    H    ASP   3           HN       ASP   3 -18.242 -16.756  -2.350
   18    HA   ASP   3           HA       ASP   3 -18.195 -14.470  -2.284
   19    HB2  ASP   3          2HB       ASP   3 -20.869 -15.296  -3.225
   20    HB3  ASP   3          3HB       ASP   3 -20.736 -13.615  -2.715
   21    HA   PRO   4           HA       PRO   4 -19.701 -14.268   2.107
   22    HB2  PRO   4          2HB       PRO   4 -17.321 -13.465   3.135
   23    HB3  PRO   4          3HB       PRO   4 -17.742 -15.165   2.904
   24    HG2  PRO   4          2HG       PRO   4 -16.070 -13.376   1.181
   25    HG3  PRO   4          3HG       PRO   4 -15.781 -15.060   1.659
   26    HD2  PRO   4          2HD       PRO   4 -16.780 -14.383  -0.765
   27    HD3  PRO   4          3HD       PRO   4 -17.220 -15.891   0.062
   28    H    LEU   5           HN       LEU   5 -17.038 -12.052   1.971
   29    HA   LEU   5           HA       LEU   5 -18.855  -9.793   1.504
   30    HB2  LEU   5          2HB       LEU   5 -17.530 -10.488   3.972
   31    HB3  LEU   5          3HB       LEU   5 -17.012  -8.903   3.401
   32    HG   LEU   5           HG       LEU   5 -19.923  -9.353   3.400
   33   HD11  LEU   5          1HD1      LEU   5 -20.290  -9.476   5.646
   34   HD12  LEU   5          2HD1      LEU   5 -18.736  -8.753   6.056
   35   HD13  LEU   5          3HD1      LEU   5 -18.815 -10.436   5.538
   36   HD21  LEU   5          1HD2      LEU   5 -19.090  -7.200   2.827
   37   HD22  LEU   5          2HD2      LEU   5 -18.056  -7.149   4.255
   38   HD23  LEU   5          3HD2      LEU   5 -19.810  -7.068   4.431
   39    H    VAL   6           HN       VAL   6 -17.119  -7.720   1.844
   40    HA   VAL   6           HA       VAL   6 -14.553  -7.924   0.841
   41    HB   VAL   6           HB       VAL   6 -15.312  -8.858  -1.197
   42   HG11  VAL   6          1HG1      VAL   6 -17.305  -8.486  -2.139
   43   HG12  VAL   6          2HG1      VAL   6 -17.697  -7.606  -0.661
   44   HG13  VAL   6          3HG1      VAL   6 -17.105  -6.735  -2.076
   45   HG21  VAL   6          1HG2      VAL   6 -15.190  -6.079  -2.176
   46   HG22  VAL   6          2HG2      VAL   6 -13.861  -6.594  -1.140
   47   HG23  VAL   6          3HG2      VAL   6 -14.220  -7.483  -2.620
   48    H    SER   7           HN       SER   7 -13.564  -5.951   0.787
   49    HA   SER   7           HA       SER   7 -15.175  -3.531   0.623
   50    HB2  SER   7          2HB       SER   7 -13.739  -4.451   3.086
   51    HB3  SER   7          3HB       SER   7 -13.836  -2.724   2.739
   52    HG   SER   7           HG       SER   7 -16.236  -3.463   2.382
   53    H    CYS   8           HN       CYS   8 -11.899  -4.266   1.805
   54    HA   CYS   8           HA       CYS   8 -10.615  -2.140   0.598
   55    HB2  CYS   8          2HB       CYS   8  -9.689  -3.772   2.319
   56    HB3  CYS   8          3HB       CYS   8  -9.338  -4.848   0.970
   57    H    LYS   9           HN       LYS   9  -9.392  -1.898  -1.297
   58    HA   LYS   9           HA       LYS   9 -10.041  -3.816  -3.438
   59    HB2  LYS   9          2HB       LYS   9  -9.638  -0.840  -3.772
   60    HB3  LYS   9          3HB       LYS   9 -10.143  -1.982  -5.009
   61    HG2  LYS   9          2HG       LYS   9 -12.276  -1.806  -4.423
   62    HG3  LYS   9          3HG       LYS   9 -11.903  -2.052  -2.717
   63    HD2  LYS   9          2HD       LYS   9 -11.764   0.184  -2.282
   64    HD3  LYS   9          3HD       LYS   9 -11.209   0.576  -3.912
   65    HE2  LYS   9          2HE       LYS   9 -13.293   1.343  -4.216
   66    HE3  LYS   9          3HE       LYS   9 -13.723  -0.358  -4.394
   67    HZ1  LYS   9          1HZ       LYS   9 -15.212   0.473  -2.827
   68    HZ2  LYS   9          2HZ       LYS   9 -14.029   1.373  -2.018
   69    HZ3  LYS   9          3HZ       LYS   9 -14.045  -0.314  -1.887
   70    H    LEU  10           HN       LEU  10  -7.687  -3.613  -1.622
   71    HA   LEU  10           HA       LEU  10  -5.616  -3.284  -3.692
   72    HB2  LEU  10          2HB       LEU  10  -5.390  -2.792  -0.728
   73    HB3  LEU  10          3HB       LEU  10  -4.049  -2.727  -1.869
   74    HG   LEU  10           HG       LEU  10  -6.428  -0.935  -2.202
   75   HD11  LEU  10          1HD1      LEU  10  -4.024   0.027  -0.740
   76   HD12  LEU  10          2HD1      LEU  10  -5.248  -0.878   0.151
   77   HD13  LEU  10          3HD1      LEU  10  -5.689   0.608  -0.690
   78   HD21  LEU  10          1HD2      LEU  10  -4.213  -1.399  -3.737
   79   HD22  LEU  10          2HD2      LEU  10  -3.729   0.012  -2.797
   80   HD23  LEU  10          3HD2      LEU  10  -5.196   0.065  -3.777
   81    H    CYS  11           HN       CYS  11  -6.815  -5.166  -0.994
   82    HA   CYS  11           HA       CYS  11  -4.950  -7.322  -1.742
   83    HB2  CYS  11          2HB       CYS  11  -4.890  -8.051   0.558
   84    HB3  CYS  11          3HB       CYS  11  -4.472  -6.342   0.500
   85    H    LEU  12           HN       LEU  12  -8.193  -6.342  -1.199
   86    HA   LEU  12           HA       LEU  12 -10.191  -7.469  -1.130
   87    HB2  LEU  12          2HB       LEU  12  -8.747  -8.975  -3.305
   88    HB3  LEU  12          3HB       LEU  12 -10.490  -8.985  -3.047
   89    HG   LEU  12           HG       LEU  12  -9.683  -7.526  -4.921
   90   HD11  LEU  12          1HD1      LEU  12 -11.068  -5.537  -4.150
   91   HD12  LEU  12          2HD1      LEU  12 -11.273  -6.410  -2.631
   92   HD13  LEU  12          3HD1      LEU  12 -11.857  -7.115  -4.139
   93   HD21  LEU  12          1HD2      LEU  12  -8.450  -5.611  -4.559
   94   HD22  LEU  12          2HD2      LEU  12  -7.692  -6.740  -3.435
   95   HD23  LEU  12          3HD2      LEU  12  -8.850  -5.548  -2.843
   96    H    GLY  13           HN       GLY  13  -9.690  -8.362   1.017
   97    HA2  GLY  13          1HA       GLY  13  -9.539 -11.305   0.882
   98    HA3  GLY  13          2HA       GLY  13  -8.607 -10.412   2.075
   99    H    GLU  14           HN       GLU  14 -11.670  -9.093   1.345
  100    HA   GLU  14           HA       GLU  14 -13.585  -8.867   2.552
  101    HB2  GLU  14          2HB       GLU  14 -13.772 -11.287   2.003
  102    HB3  GLU  14          3HB       GLU  14 -12.964 -11.662   3.519
  103    HG2  GLU  14          2HG       GLU  14 -15.110  -9.950   4.142
  104    HG3  GLU  14          3HG       GLU  14 -15.726 -11.167   3.025
  105    H    TYR  15           HN       TYR  15 -13.816  -7.604   4.266
  106    HA   TYR  15           HA       TYR  15 -12.891  -8.375   6.870
  107    HB2  TYR  15          2HB       TYR  15 -11.680  -5.866   5.709
  108    HB3  TYR  15          3HB       TYR  15 -11.313  -6.624   7.254
  109    HD1  TYR  15          1HD       TYR  15 -10.135  -8.859   7.257
  110    HD2  TYR  15          2HD       TYR  15 -10.516  -6.476   3.753
  111    HE1  TYR  15          1HE       TYR  15  -8.298 -10.115   6.209
  112    HE2  TYR  15          2HE       TYR  15  -8.682  -7.726   2.695
  113    HH   TYR  15           HH       TYR  15  -6.624  -9.780   4.421
  114    HA   PRO  16           HA       PRO  16 -16.278  -5.845   8.059
  115    HB2  PRO  16          2HB       PRO  16 -15.557  -5.211  10.599
  116    HB3  PRO  16          3HB       PRO  16 -16.111  -6.824  10.131
  117    HG2  PRO  16          2HG       PRO  16 -13.318  -5.820  10.526
  118    HG3  PRO  16          3HG       PRO  16 -14.039  -7.355  11.044
  119    HD2  PRO  16          2HD       PRO  16 -12.473  -7.150   8.844
  120    HD3  PRO  16          3HD       PRO  16 -13.812  -8.311   8.958
  121    H    VAL  17           HN       VAL  17 -16.904  -3.686   8.572
  122    HA   VAL  17           HA       VAL  17 -15.236  -1.694   7.446
  123    HB   VAL  17           HB       VAL  17 -17.909  -1.867   7.928
  124   HG11  VAL  17          1HG1      VAL  17 -17.297  -1.256  10.357
  125   HG12  VAL  17          2HG1      VAL  17 -17.046   0.371   9.724
  126   HG13  VAL  17          3HG1      VAL  17 -18.627  -0.398   9.582
  127   HG21  VAL  17          1HG2      VAL  17 -16.407  -0.381   6.378
  128   HG22  VAL  17          2HG2      VAL  17 -18.062   0.100   6.747
  129   HG23  VAL  17          3HG2      VAL  17 -16.715   0.847   7.606
  130    H    GLU  18           HN       GLU  18 -15.120  -3.134  10.438
  131    HA   GLU  18           HA       GLU  18 -14.179  -0.745  11.838
  132    HB2  GLU  18          2HB       GLU  18 -14.876  -3.533  12.732
  133    HB3  GLU  18          3HB       GLU  18 -13.991  -2.430  13.777
  134    HG2  GLU  18          2HG       GLU  18 -15.827  -1.299  14.312
  135    HG3  GLU  18          3HG       GLU  18 -16.362  -1.210  12.635
  136    H    GLN  19           HN       GLN  19 -13.012  -3.567  10.250
  137    HA   GLN  19           HA       GLN  19 -10.375  -3.370  11.476
  138    HB2  GLN  19          2HB       GLN  19 -11.639  -5.318   9.561
  139    HB3  GLN  19          3HB       GLN  19  -9.908  -5.321   9.866
  140    HG2  GLN  19          2HG       GLN  19 -11.592  -6.845  11.223
  141    HG3  GLN  19          3HG       GLN  19 -10.129  -6.176  11.946
  142   HE21  GLN  19          1HE2      GLN  19 -10.349  -4.203  13.184
  143   HE22  GLN  19          2HE2      GLN  19 -11.825  -3.892  14.027
  144    H    MET  20           HN       MET  20 -11.677  -1.394   9.517
  145    HA   MET  20           HA       MET  20  -9.365  -1.238   7.704
  146    HB2  MET  20          2HB       MET  20 -11.817  -0.011   6.677
  147    HB3  MET  20          3HB       MET  20 -10.648  -1.041   5.863
  148    HG2  MET  20          2HG       MET  20 -11.766  -2.924   7.293
  149    HG3  MET  20          3HG       MET  20 -13.105  -1.780   7.368
  150    HE1  MET  20          1HE       MET  20 -10.644  -2.248   4.172
  151    HE2  MET  20          2HE       MET  20 -10.667  -3.711   5.157
  152    HE3  MET  20          3HE       MET  20 -11.409  -3.714   3.556
  153    H    THR  21           HN       THR  21  -9.329   1.077   6.677
  154    HA   THR  21           HA       THR  21  -9.974   3.066   8.748
  155    HB   THR  21           HB       THR  21  -7.345   2.748   7.297
  156    HG1  THR  21          1HG       THR  21  -6.574   2.311   9.280
  157   HG21  THR  21          1HG2      THR  21  -6.694   4.834   8.552
  158   HG22  THR  21          2HG2      THR  21  -8.409   5.084   8.879
  159   HG23  THR  21          3HG2      THR  21  -7.818   5.082   7.217
  160    H    THR  22           HN       THR  22 -10.583   5.074   8.026
  161    HA   THR  22           HA       THR  22 -11.550   5.227   5.334
  162    HB   THR  22           HB       THR  22 -11.471   7.388   7.450
  163    HG1  THR  22          1HG       THR  22 -13.811   6.007   6.776
  164   HG21  THR  22          1HG2      THR  22 -11.826   8.432   5.354
  165   HG22  THR  22          2HG2      THR  22 -13.424   8.263   6.083
  166   HG23  THR  22          3HG2      THR  22 -12.910   7.150   4.815
  167    H    ILE  23           HN       ILE  23 -11.051   6.948   3.829
  168    HA   ILE  23           HA       ILE  23  -8.231   7.313   3.524
  169    HB   ILE  23           HB       ILE  23 -10.569   8.383   1.945
  170   HG12  ILE  23          2HG1      ILE  23 -10.301   5.996   1.717
  171   HG13  ILE  23          3HG1      ILE  23  -9.719   6.759   0.243
  172   HG21  ILE  23          1HG2      ILE  23  -7.634   8.573   1.281
  173   HG22  ILE  23          2HG2      ILE  23  -8.973   9.112   0.269
  174   HG23  ILE  23          3HG2      ILE  23  -8.651   9.914   1.806
  175   HD11  ILE  23          1HD1      ILE  23  -7.402   6.581   1.224
  176   HD12  ILE  23          2HD1      ILE  23  -8.109   5.542   2.460
  177   HD13  ILE  23          3HD1      ILE  23  -8.178   5.066   0.764
  178    H    ALA  24           HN       ALA  24 -10.563   9.920   3.060
  179    HA   ALA  24           HA       ALA  24 -10.206  11.540   5.190
  180    HB1  ALA  24          1HB       ALA  24  -8.266  13.019   3.988
  181    HB2  ALA  24          2HB       ALA  24  -7.992  11.879   5.305
  182    HB3  ALA  24          3HB       ALA  24  -7.726  11.378   3.636
  183    H    GLN  25           HN       GLN  25  -9.855  11.613   1.663
  184    HA   GLN  25           HA       GLN  25 -11.507  14.035   1.574
  185    HB2  GLN  25          2HB       GLN  25  -9.319  13.002  -0.038
  186    HB3  GLN  25          3HB       GLN  25 -10.703  13.453  -1.024
  187    HG2  GLN  25          2HG       GLN  25  -9.283  15.342  -0.887
  188    HG3  GLN  25          3HG       GLN  25 -10.694  15.672   0.117
  189   HE21  GLN  25          1HE2      GLN  25  -7.921  16.730   0.157
  190   HE22  GLN  25          2HE2      GLN  25  -7.367  16.479   1.774
  191    H    CYS  26           HN       CYS  26 -11.189  10.902  -0.098
  192    HA   CYS  26           HA       CYS  26 -13.857  11.116  -1.182
  193    HB2  CYS  26          2HB       CYS  26 -13.384   8.907  -2.172
  194    HB3  CYS  26          3HB       CYS  26 -12.103  10.064  -2.514
  195    H    GLN  27           HN       GLN  27 -12.234   9.382   1.406
  196    HA   GLN  27           HA       GLN  27 -13.114   8.446   3.306
  197    HB2  GLN  27          2HB       GLN  27 -15.894   8.739   2.206
  198    HB3  GLN  27          3HB       GLN  27 -15.371   8.707   3.885
  199    HG2  GLN  27          2HG       GLN  27 -15.203  10.939   1.903
  200    HG3  GLN  27          3HG       GLN  27 -15.928  10.927   3.511
  201   HE21  GLN  27          1HE2      GLN  27 -13.683   9.586   4.743
  202   HE22  GLN  27          2HE2      GLN  27 -12.415  10.753   4.858
  203    H    CYS  28           HN       CYS  28 -12.199   6.912   1.214
  204    HA   CYS  28           HA       CYS  28 -14.109   4.839   0.599
  205    HB2  CYS  28          2HB       CYS  28 -11.179   5.227   0.011
  206    HB3  CYS  28          3HB       CYS  28 -12.007   3.721  -0.373
  207    H    ILE  29           HN       ILE  29 -12.864   2.497   0.812
  208    HA   ILE  29           HA       ILE  29 -12.213   2.228   3.675
  209    HB   ILE  29           HB       ILE  29 -14.520   1.337   2.730
  210   HG12  ILE  29          2HG1      ILE  29 -14.347  -0.543   4.449
  211   HG13  ILE  29          3HG1      ILE  29 -12.669  -0.056   4.664
  212   HG21  ILE  29          1HG2      ILE  29 -13.326  -0.008   0.973
  213   HG22  ILE  29          2HG2      ILE  29 -12.749  -1.052   2.272
  214   HG23  ILE  29          3HG2      ILE  29 -14.479  -0.908   1.958
  215   HD11  ILE  29          1HD1      ILE  29 -13.976   2.315   4.939
  216   HD12  ILE  29          2HD1      ILE  29 -15.125   1.176   5.642
  217   HD13  ILE  29          3HD1      ILE  29 -13.478   1.264   6.265
  218    H    PHE  30           HN       PHE  30 -10.308   1.326   4.074
  219    HA   PHE  30           HA       PHE  30  -9.255  -0.760   2.364
  220    HB2  PHE  30          2HB       PHE  30  -7.820   1.879   2.715
  221    HB3  PHE  30          3HB       PHE  30  -7.067   0.423   2.073
  222    HD1  PHE  30          1HD       PHE  30  -9.250   3.223   1.384
  223    HD2  PHE  30          2HD       PHE  30  -7.803  -0.496  -0.096
  224    HE1  PHE  30          1HE       PHE  30 -10.033   3.821  -0.871
  225    HE2  PHE  30          2HE       PHE  30  -8.582   0.096  -2.353
  226    HZ   PHE  30           HZ       PHE  30  -9.699   2.256  -2.744
  227    H    CYS  31           HN       CYS  31  -8.110  -2.208   3.505
  228    HA   CYS  31           HA       CYS  31  -8.019  -2.077   6.312
  229    HB2  CYS  31          2HB       CYS  31  -6.923  -4.181   6.239
  230    HB3  CYS  31          3HB       CYS  31  -8.015  -4.162   4.858
  231    H    THR  32           HN       THR  32  -6.596  -1.221   7.678
  232    HA   THR  32           HA       THR  32  -4.745   0.632   7.209
  233    HB   THR  32           HB       THR  32  -3.912  -1.448   9.189
  234    HG1  THR  32          1HG       THR  32  -6.338  -0.009   9.177
  235   HG21  THR  32          1HG2      THR  32  -3.624   1.433   8.777
  236   HG22  THR  32          2HG2      THR  32  -2.615   0.314   9.695
  237   HG23  THR  32          3HG2      THR  32  -4.066   0.998  10.427
  238    H    LEU  33           HN       LEU  33  -4.007  -2.849   7.185
  239    HA   LEU  33           HA       LEU  33  -1.347  -2.921   6.762
  240    HB2  LEU  33          2HB       LEU  33  -3.588  -4.584   6.021
  241    HB3  LEU  33          3HB       LEU  33  -2.308  -4.671   4.812
  242    HG   LEU  33           HG       LEU  33  -1.576  -5.024   7.678
  243   HD11  LEU  33          1HD1      LEU  33  -3.622  -6.407   7.273
  244   HD12  LEU  33          2HD1      LEU  33  -2.177  -7.326   7.695
  245   HD13  LEU  33          3HD1      LEU  33  -2.721  -7.260   6.020
  246   HD21  LEU  33          1HD2      LEU  33   0.353  -5.547   6.719
  247   HD22  LEU  33          2HD2      LEU  33  -0.362  -5.337   5.120
  248   HD23  LEU  33          3HD2      LEU  33  -0.424  -6.911   5.915
  249    H    CYS  34           HN       CYS  34  -3.557  -2.913   3.962
  250    HA   CYS  34           HA       CYS  34  -1.585  -2.192   2.099
  251    HB2  CYS  34          2HB       CYS  34  -4.550  -1.656   1.856
  252    HB3  CYS  34          3HB       CYS  34  -3.391  -1.848   0.543
  253    H    LEU  35           HN       LEU  35  -4.263  -0.170   3.317
  254    HA   LEU  35           HA       LEU  35  -3.501   2.240   2.252
  255    HB2  LEU  35          2HB       LEU  35  -5.593   1.752   3.525
  256    HB3  LEU  35          3HB       LEU  35  -4.654   1.878   5.012
  257    HG   LEU  35           HG       LEU  35  -4.103   4.252   4.276
  258   HD11  LEU  35          1HD1      LEU  35  -6.047   5.151   2.810
  259   HD12  LEU  35          2HD1      LEU  35  -6.147   3.486   2.237
  260   HD13  LEU  35          3HD1      LEU  35  -4.650   4.398   2.039
  261   HD21  LEU  35          1HD2      LEU  35  -5.762   4.977   5.612
  262   HD22  LEU  35          2HD2      LEU  35  -6.067   3.254   5.842
  263   HD23  LEU  35          3HD2      LEU  35  -7.016   4.170   4.670
  264    H    LYS  36           HN       LYS  36  -1.915   0.443   4.685
  265    HA   LYS  36           HA       LYS  36  -0.431   2.740   5.695
  266    HB2  LYS  36          2HB       LYS  36  -1.142   1.092   7.327
  267    HB3  LYS  36          3HB       LYS  36  -0.345  -0.192   6.428
  268    HG2  LYS  36          2HG       LYS  36   1.734   1.479   6.845
  269    HG3  LYS  36          3HG       LYS  36   0.769   1.789   8.289
  270    HD2  LYS  36          2HD       LYS  36   1.876   0.000   9.099
  271    HD3  LYS  36          3HD       LYS  36   0.664  -0.910   8.195
  272    HE2  LYS  36          2HE       LYS  36   2.203  -1.734   6.813
  273    HE3  LYS  36          3HE       LYS  36   2.872  -0.132   6.502
  274    HZ1  LYS  36          1HZ       LYS  36   3.724  -0.715   9.017
  275    HZ2  LYS  36          2HZ       LYS  36   4.646  -0.852   7.606
  276    HZ3  LYS  36          3HZ       LYS  36   3.841  -2.205   8.224
  277    H    GLN  37           HN       GLN  37   0.619  -0.510   4.673
  278    HA   GLN  37           HA       GLN  37   3.225  -0.047   4.142
  279    HB2  GLN  37          2HB       GLN  37   1.524  -2.109   3.630
  280    HB3  GLN  37          3HB       GLN  37   1.906  -1.580   1.997
  281    HG2  GLN  37          2HG       GLN  37   4.282  -1.846   2.451
  282    HG3  GLN  37          3HG       GLN  37   3.917  -2.344   4.102
  283   HE21  GLN  37          1HE2      GLN  37   2.088  -4.143   4.042
  284   HE22  GLN  37          2HE2      GLN  37   2.469  -5.479   3.014
  285    H    TYR  38           HN       TYR  38   0.540   1.206   2.366
  286    HA   TYR  38           HA       TYR  38   2.116   1.967   0.064
  287    HB2  TYR  38          2HB       TYR  38   0.017   1.682  -0.737
  288    HB3  TYR  38          3HB       TYR  38  -0.731   2.014   0.822
  289    HD1  TYR  38          1HD       TYR  38   1.231   3.905  -1.747
  290    HD2  TYR  38          2HD       TYR  38  -2.115   3.849   0.880
  291    HE1  TYR  38          1HE       TYR  38   0.573   6.136  -2.547
  292    HE2  TYR  38          2HE       TYR  38  -2.784   6.079   0.086
  293    HH   TYR  38           HH       TYR  38  -2.440   7.643  -1.514
  294    H    VAL  39           HN       VAL  39   0.048   3.921   2.210
  295    HA   VAL  39           HA       VAL  39   1.228   6.372   1.625
  296    HB   VAL  39           HB       VAL  39   0.125   7.266   3.548
  297   HG11  VAL  39          1HG1      VAL  39  -1.339   6.624   1.720
  298   HG12  VAL  39          2HG1      VAL  39  -1.501   5.001   2.394
  299   HG13  VAL  39          3HG1      VAL  39  -2.153   6.388   3.267
  300   HG21  VAL  39          1HG2      VAL  39  -0.003   4.416   4.513
  301   HG22  VAL  39          2HG2      VAL  39   0.825   5.776   5.270
  302   HG23  VAL  39          3HG2      VAL  39  -0.937   5.730   5.228
  303    H    GLU  40           HN       GLU  40   1.873   4.178   4.352
  304    HA   GLU  40           HA       GLU  40   3.622   5.462   5.892
  305    HB2  GLU  40          2HB       GLU  40   3.015   2.905   5.732
  306    HB3  GLU  40          3HB       GLU  40   4.548   2.806   4.878
  307    HG2  GLU  40          2HG       GLU  40   4.772   4.330   7.329
  308    HG3  GLU  40          3HG       GLU  40   4.166   2.699   7.611
  309    H    LEU  41           HN       LEU  41   4.799   3.703   3.017
  310    HA   LEU  41           HA       LEU  41   7.384   4.712   3.028
  311    HB2  LEU  41          2HB       LEU  41   5.628   3.388   1.090
  312    HB3  LEU  41          3HB       LEU  41   6.892   4.379   0.366
  313    HG   LEU  41           HG       LEU  41   7.800   2.228   0.454
  314   HD11  LEU  41          1HD1      LEU  41   8.953   3.014   3.041
  315   HD12  LEU  41          2HD1      LEU  41   8.998   4.252   1.786
  316   HD13  LEU  41          3HD1      LEU  41   9.739   2.678   1.498
  317   HD21  LEU  41          1HD2      LEU  41   7.367   1.757   3.339
  318   HD22  LEU  41          2HD2      LEU  41   7.349   0.625   1.986
  319   HD23  LEU  41          3HD2      LEU  41   5.945   1.646   2.300
  320    H    LEU  42           HN       LEU  42   4.462   6.020   1.529
  321    HA   LEU  42           HA       LEU  42   5.771   8.175   0.212
  322    HB2  LEU  42          2HB       LEU  42   2.919   7.577   0.918
  323    HB3  LEU  42          3HB       LEU  42   3.375   9.120   0.200
  324    HG   LEU  42           HG       LEU  42   3.512   6.379  -1.026
  325   HD11  LEU  42          1HD1      LEU  42   2.234   7.557  -2.818
  326   HD12  LEU  42          2HD1      LEU  42   2.145   8.961  -1.754
  327   HD13  LEU  42          3HD1      LEU  42   1.391   7.441  -1.273
  328   HD21  LEU  42          1HD2      LEU  42   4.946   8.893  -1.819
  329   HD22  LEU  42          2HD2      LEU  42   4.499   7.670  -3.008
  330   HD23  LEU  42          3HD2      LEU  42   5.578   7.253  -1.677
  331    H    ILE  43           HN       ILE  43   3.376   8.420   2.839
  332    HA   ILE  43           HA       ILE  43   3.747  10.946   3.669
  333    HB   ILE  43           HB       ILE  43   2.831   8.532   4.942
  334   HG12  ILE  43          2HG1      ILE  43   1.417  10.263   6.177
  335   HG13  ILE  43          3HG1      ILE  43   2.276  11.484   5.243
  336   HG21  ILE  43          1HG2      ILE  43   3.230   9.151   7.273
  337   HG22  ILE  43          2HG2      ILE  43   4.741   8.828   6.426
  338   HG23  ILE  43          3HG2      ILE  43   4.247  10.491   6.744
  339   HD11  ILE  43          1HD1      ILE  43   1.036   9.261   3.739
  340   HD12  ILE  43          2HD1      ILE  43  -0.039  10.454   4.468
  341   HD13  ILE  43          3HD1      ILE  43   1.200  10.967   3.322
  342    H    LYS  44           HN       LYS  44   6.010   8.331   4.092
  343    HA   LYS  44           HA       LYS  44   7.663   9.621   6.023
  344    HB2  LYS  44          2HB       LYS  44   7.648   7.126   4.548
  345    HB3  LYS  44          3HB       LYS  44   9.263   7.820   4.601
  346    HG2  LYS  44          2HG       LYS  44   8.772   6.241   6.449
  347    HG3  LYS  44          3HG       LYS  44   9.250   7.853   6.988
  348    HD2  LYS  44          2HD       LYS  44   7.438   7.649   8.320
  349    HD3  LYS  44          3HD       LYS  44   6.573   8.163   6.869
  350    HE2  LYS  44          2HE       LYS  44   5.413   6.270   6.965
  351    HE3  LYS  44          3HE       LYS  44   6.902   5.393   6.617
  352    HZ1  LYS  44          1HZ       LYS  44   6.730   6.132   9.364
  353    HZ2  LYS  44          2HZ       LYS  44   6.961   4.604   8.676
  354    HZ3  LYS  44          3HZ       LYS  44   5.395   5.204   8.896
  355    H    GLU  45           HN       GLU  45   7.777   9.312   2.494
  356    HA   GLU  45           HA       GLU  45  10.221  10.748   2.205
  357    HB2  GLU  45          2HB       GLU  45   8.508   9.271   0.530
  358    HB3  GLU  45          3HB       GLU  45   8.560  10.891  -0.146
  359    HG2  GLU  45          2HG       GLU  45  10.677  10.676  -0.835
  360    HG3  GLU  45          3HG       GLU  45  11.172   9.822   0.626
  361    H    GLY  46           HN       GLY  46   6.950  11.671   1.107
  362    HA2  GLY  46          1HA       GLY  46   5.850  13.705   1.426
  363    HA3  GLY  46          2HA       GLY  46   7.284  14.327   2.229
  364    H    LEU  47           HN       LEU  47   8.883  13.308  -0.162
  365    HA   LEU  47           HA       LEU  47   9.403  15.603  -1.475
  366    HB2  LEU  47          2HB       LEU  47  10.528  14.375  -3.036
  367    HB3  LEU  47          3HB       LEU  47  10.344  13.176  -1.758
  368    HG   LEU  47           HG       LEU  47   8.446  13.348  -4.085
  369   HD11  LEU  47          1HD1      LEU  47  10.899  11.609  -3.880
  370   HD12  LEU  47          2HD1      LEU  47  10.759  13.037  -4.905
  371   HD13  LEU  47          3HD1      LEU  47   9.725  11.639  -5.196
  372   HD21  LEU  47          1HD2      LEU  47   9.074  10.819  -2.706
  373   HD22  LEU  47          2HD2      LEU  47   7.532  11.444  -3.290
  374   HD23  LEU  47          3HD2      LEU  47   8.194  12.018  -1.759
  375    H    GLU  48           HN       GLU  48   6.849  13.303  -2.359
  376    HA   GLU  48           HA       GLU  48   5.110  15.310  -3.304
  377    HB2  GLU  48          2HB       GLU  48   5.190  15.045  -5.655
  378    HB3  GLU  48          3HB       GLU  48   6.856  15.271  -5.143
  379    HG2  GLU  48          2HG       GLU  48   7.475  13.274  -5.901
  380    HG3  GLU  48          3HG       GLU  48   6.065  12.474  -5.207
  381    H    THR  49           HN       THR  49   3.975  13.579  -5.419
  382    HA   THR  49           HA       THR  49   2.708  11.668  -5.687
  383    HB   THR  49           HB       THR  49   3.188  10.857  -2.834
  384    HG1  THR  49          1HG       THR  49   4.921  10.319  -5.036
  385   HG21  THR  49          1HG2      THR  49   1.756   9.306  -3.685
  386   HG22  THR  49          2HG2      THR  49   3.263   8.602  -4.276
  387   HG23  THR  49          3HG2      THR  49   2.269   9.587  -5.348
  388    H    ALA  50           HN       ALA  50   2.501  13.535  -2.717
  389    HA   ALA  50           HA       ALA  50   0.742  14.383  -1.548
  390    HB1  ALA  50          1HB       ALA  50  -0.494  14.107  -4.274
  391    HB2  ALA  50          2HB       ALA  50  -1.349  14.830  -2.911
  392    HB3  ALA  50          3HB       ALA  50   0.144  15.559  -3.502
  393    H    ILE  51           HN       ILE  51   1.039  11.316  -2.152
  394    HA   ILE  51           HA       ILE  51  -0.165   9.376  -1.800
  395    HB   ILE  51           HB       ILE  51  -0.832  11.009   0.650
  396   HG12  ILE  51          2HG1      ILE  51   1.084   9.869   1.654
  397   HG13  ILE  51          3HG1      ILE  51   1.359   8.980   0.161
  398   HG21  ILE  51          1HG2      ILE  51  -2.305   9.023   0.287
  399   HG22  ILE  51          2HG2      ILE  51  -0.864   8.011   0.365
  400   HG23  ILE  51          3HG2      ILE  51  -1.350   8.963   1.767
  401   HD11  ILE  51          1HD1      ILE  51   1.343  11.932  -0.007
  402   HD12  ILE  51          2HD1      ILE  51   2.714  11.165   0.795
  403   HD13  ILE  51          3HD1      ILE  51   2.323  10.747  -0.872
  404    H    SER  52           HN       SER  52  -1.716   9.437  -3.456
  405    HA   SER  52           HA       SER  52  -4.330  10.581  -2.792
  406    HB2  SER  52          2HB       SER  52  -4.197   9.330  -5.399
  407    HB3  SER  52          3HB       SER  52  -4.528  11.013  -4.984
  408    HG   SER  52           HG       SER  52  -2.651  10.903  -6.213
  409    H    CYS  53           HN       CYS  53  -6.269   9.318  -3.188
  410    HA   CYS  53           HA       CYS  53  -6.597   7.076  -1.788
  411    HB2  CYS  53          2HB       CYS  53  -8.450   8.212  -2.913
  412    HB3  CYS  53          3HB       CYS  53  -7.901   7.595  -4.468
  413    HA   PRO  54           HA       PRO  54  -4.132   3.889  -3.594
  414    HB2  PRO  54          2HB       PRO  54  -5.254   1.780  -2.306
  415    HB3  PRO  54          3HB       PRO  54  -4.157   2.915  -1.513
  416    HG2  PRO  54          2HG       PRO  54  -7.148   2.816  -1.451
  417    HG3  PRO  54          3HG       PRO  54  -6.010   3.105  -0.122
  418    HD2  PRO  54          2HD       PRO  54  -7.344   5.110  -1.360
  419    HD3  PRO  54          3HD       PRO  54  -5.712   5.318  -0.691
  420    H    ASP  55           HN       ASP  55  -7.266   4.536  -4.351
  421    HA   ASP  55           HA       ASP  55  -7.741   2.086  -5.869
  422    HB2  ASP  55          2HB       ASP  55  -9.555   3.231  -4.505
  423    HB3  ASP  55          3HB       ASP  55  -9.534   4.509  -5.717
  424    H    ALA  56           HN       ALA  56  -7.784   1.978  -8.075
  425    HA   ALA  56           HA       ALA  56  -6.569   4.240  -9.483
  426    HB1  ALA  56          1HB       ALA  56  -5.682   2.755 -10.989
  427    HB2  ALA  56          2HB       ALA  56  -5.735   1.757  -9.535
  428    HB3  ALA  56          3HB       ALA  56  -6.984   1.585 -10.768
  429    H    ALA  57           HN       ALA  57  -9.419   4.139  -8.724
  430    HA   ALA  57           HA       ALA  57 -10.526   5.141 -11.117
  431    HB1  ALA  57          1HB       ALA  57 -12.202   2.851 -10.539
  432    HB2  ALA  57          2HB       ALA  57 -11.550   3.414 -12.078
  433    HB3  ALA  57          3HB       ALA  57 -10.579   2.373 -11.037
  434    H    CYS  58           HN       CYS  58 -10.313   6.056  -8.495
  435    HA   CYS  58           HA       CYS  58 -12.816   5.695  -7.122
  436    HB2  CYS  58          2HB       CYS  58 -10.598   6.180  -6.002
  437    HB3  CYS  58          3HB       CYS  58 -10.737   7.826  -6.610
  438    HA   PRO  59           HA       PRO  59 -15.081   8.761  -9.358
  439    HB2  PRO  59          2HB       PRO  59 -17.149   9.013  -7.617
  440    HB3  PRO  59          3HB       PRO  59 -16.962   7.623  -8.691
  441    HG2  PRO  59          2HG       PRO  59 -16.255   7.888  -5.794
  442    HG3  PRO  59          3HG       PRO  59 -17.043   6.540  -6.635
  443    HD2  PRO  59          2HD       PRO  59 -14.412   6.519  -5.993
  444    HD3  PRO  59          3HD       PRO  59 -15.048   5.712  -7.440
  445    H    LYS  60           HN       LYS  60 -13.738   9.180  -6.230
  446    HA   LYS  60           HA       LYS  60 -14.124  12.093  -6.450
  447    HB2  LYS  60          2HB       LYS  60 -14.066  10.406  -3.943
  448    HB3  LYS  60          3HB       LYS  60 -14.030  12.163  -3.953
  449    HG2  LYS  60          2HG       LYS  60 -16.218  11.857  -5.389
  450    HG3  LYS  60          3HG       LYS  60 -16.266  10.304  -4.551
  451    HD2  LYS  60          2HD       LYS  60 -17.023  11.281  -2.702
  452    HD3  LYS  60          3HD       LYS  60 -15.646  12.386  -2.683
  453    HE2  LYS  60          2HE       LYS  60 -17.740  13.622  -2.750
  454    HE3  LYS  60          3HE       LYS  60 -16.823  13.871  -4.234
  455    HZ1  LYS  60          1HZ       LYS  60 -19.437  12.901  -3.947
  456    HZ2  LYS  60          2HZ       LYS  60 -18.494  11.663  -4.610
  457    HZ3  LYS  60          3HZ       LYS  60 -18.569  13.171  -5.374
  458    H    GLN  61           HN       GLN  61 -11.965   9.485  -6.192
  459    HA   GLN  61           HA       GLN  61  -9.725   9.336  -5.626
  460    HB2  GLN  61          2HB       GLN  61  -9.366  11.797  -7.283
  461    HB3  GLN  61          3HB       GLN  61  -8.453  10.294  -7.305
  462    HG2  GLN  61          2HG       GLN  61 -10.085   9.186  -8.561
  463    HG3  GLN  61          3HG       GLN  61 -11.302  10.416  -8.224
  464   HE21  GLN  61          1HE2      GLN  61 -10.262  12.720  -8.864
  465   HE22  GLN  61          2HE2      GLN  61  -9.735  12.775 -10.508
  466    H    GLY  62           HN       GLY  62 -10.301  10.103  -3.370
  467    HA2  GLY  62          1HA       GLY  62  -9.562  12.824  -2.721
  468    HA3  GLY  62          2HA       GLY  62 -10.051  11.574  -1.587
  469    H    HIS  63           HN       HIS  63  -7.828  13.469  -1.422
  470    HA   HIS  63           HA       HIS  63  -5.497  11.709  -1.624
  471    HB2  HIS  63          2HB       HIS  63  -5.764  14.680  -1.157
  472    HB3  HIS  63          3HB       HIS  63  -4.229  13.824  -1.044
  473    HD1  HIS  63          1HD       HIS  63  -6.401  15.501  -3.415
  474    HD2  HIS  63          2HD       HIS  63  -3.483  12.550  -3.588
  475    HE1  HIS  63          1HE       HIS  63  -5.720  15.371  -5.831
  476    H    LEU  64           HN       LEU  64  -3.885  11.941   0.225
  477    HA   LEU  64           HA       LEU  64  -5.354  11.759   2.770
  478    HB2  LEU  64          2HB       LEU  64  -2.849  10.387   1.823
  479    HB3  LEU  64          3HB       LEU  64  -3.382  10.368   3.502
  480    HG   LEU  64           HG       LEU  64  -3.913   8.333   2.045
  481   HD11  LEU  64          1HD1      LEU  64  -5.186   7.955   3.821
  482   HD12  LEU  64          2HD1      LEU  64  -6.499   8.810   3.013
  483   HD13  LEU  64          3HD1      LEU  64  -5.408   9.684   4.088
  484   HD21  LEU  64          1HD2      LEU  64  -4.759   9.867   0.169
  485   HD22  LEU  64          2HD2      LEU  64  -6.235   9.993   1.124
  486   HD23  LEU  64          3HD2      LEU  64  -5.694   8.419   0.542
  487    H    GLN  65           HN       GLN  65  -4.079  12.334   4.721
  488    HA   GLN  65           HA       GLN  65  -2.696  14.850   4.257
  489    HB2  GLN  65          2HB       GLN  65  -2.915  14.009   7.036
  490    HB3  GLN  65          3HB       GLN  65  -3.500  15.473   6.256
  491    HG2  GLN  65          2HG       GLN  65  -5.452  14.512   6.983
  492    HG3  GLN  65          3HG       GLN  65  -5.359  13.924   5.323
  493   HE21  GLN  65          1HE2      GLN  65  -3.099  12.127   6.218
  494   HE22  GLN  65          2HE2      GLN  65  -3.897  10.787   6.961
  495    H    GLU  66           HN       GLU  66  -0.726  15.356   5.508
  496    HA   GLU  66           HA       GLU  66   1.150  13.134   5.316
  497    HB2  GLU  66          2HB       GLU  66   1.351  16.092   5.304
  498    HB3  GLU  66          3HB       GLU  66   2.712  15.216   5.991
  499    HG2  GLU  66          2HG       GLU  66   2.168  13.870   3.636
  500    HG3  GLU  66          3HG       GLU  66   1.938  15.569   3.228
  501    H    ASN  67           HN       ASN  67  -0.265  15.272   7.700
  502    HA   ASN  67           HA       ASN  67   1.460  14.325   9.823
  503    HB2  ASN  67          2HB       ASN  67   0.786  16.165  10.919
  504    HB3  ASN  67          3HB       ASN  67  -0.022  16.635   9.426
  505   HD21  ASN  67          1HD2      ASN  67  -2.233  16.404   9.246
  506   HD22  ASN  67          2HD2      ASN  67  -3.250  16.096  10.609
  507    H    GLU  68           HN       GLU  68  -2.028  14.181   9.105
  508    HA   GLU  68           HA       GLU  68  -2.804  12.546  11.203
  509    HB2  GLU  68          2HB       GLU  68  -3.923  13.409   8.674
  510    HB3  GLU  68          3HB       GLU  68  -4.379  11.750   9.032
  511    HG2  GLU  68          2HG       GLU  68  -4.644  13.753  11.201
  512    HG3  GLU  68          3HG       GLU  68  -5.796  13.820   9.869
  513    H    ILE  69           HN       ILE  69  -2.141  11.474   7.862
  514    HA   ILE  69           HA       ILE  69  -2.281   8.760   8.238
  515    HB   ILE  69           HB       ILE  69  -0.569  10.400   6.395
  516   HG12  ILE  69          2HG1      ILE  69  -3.203   9.131   6.339
  517   HG13  ILE  69          3HG1      ILE  69  -2.562  10.434   5.345
  518   HG21  ILE  69          1HG2      ILE  69   0.701   8.380   6.875
  519   HG22  ILE  69          2HG2      ILE  69  -0.707   7.390   6.493
  520   HG23  ILE  69          3HG2      ILE  69   0.070   8.343   5.229
  521   HD11  ILE  69          1HD1      ILE  69  -3.211   8.452   4.045
  522   HD12  ILE  69          2HD1      ILE  69  -1.499   8.846   3.881
  523   HD13  ILE  69          3HD1      ILE  69  -2.002   7.510   4.917
  524    H    GLU  70           HN       GLU  70   0.793  10.577   8.208
  525    HA   GLU  70           HA       GLU  70   2.438   8.562   9.125
  526    HB2  GLU  70          2HB       GLU  70   4.050  10.208   9.565
  527    HB3  GLU  70          3HB       GLU  70   3.055  10.907   8.296
  528    HG2  GLU  70          2HG       GLU  70   1.940  12.327   9.836
  529    HG3  GLU  70          3HG       GLU  70   2.650  11.490  11.215
  530    H    CYS  71           HN       CYS  71  -0.009  10.216  10.822
  531    HA   CYS  71           HA       CYS  71   1.064   9.899  13.457
  532    HB2  CYS  71          2HB       CYS  71  -0.672  11.183  14.069
  533    HB3  CYS  71          3HB       CYS  71  -1.025  11.335  12.351
  534    HG   CYS  71           HG       CYS  71  -3.020  10.303  14.581
  535    H    MET  72           HN       MET  72  -0.936   7.993  11.317
  536    HA   MET  72           HA       MET  72  -1.605   6.082  13.395
  537    HB2  MET  72          2HB       MET  72  -3.173   5.263  11.965
  538    HB3  MET  72          3HB       MET  72  -2.975   6.846  11.226
  539    HG2  MET  72          2HG       MET  72  -1.318   5.839   9.668
  540    HG3  MET  72          3HG       MET  72  -1.717   4.262  10.346
  541    HE1  MET  72          1HE       MET  72  -1.977   5.898   7.325
  542    HE2  MET  72          2HE       MET  72  -2.026   4.137   7.384
  543    HE3  MET  72          3HE       MET  72  -3.341   5.030   6.619
  544    H    VAL  73           HN       VAL  73   1.145   6.679  11.866
  545    HA   VAL  73           HA       VAL  73   1.964   3.865  11.935
  546    HB   VAL  73           HB       VAL  73   3.466   4.403   9.919
  547   HG11  VAL  73          1HG1      VAL  73   1.716   2.791   9.739
  548   HG12  VAL  73          2HG1      VAL  73   0.485   4.054   9.655
  549   HG13  VAL  73          3HG1      VAL  73   1.623   3.841   8.325
  550   HG21  VAL  73          1HG2      VAL  73   3.318   6.642   9.480
  551   HG22  VAL  73          2HG2      VAL  73   2.076   6.041   8.381
  552   HG23  VAL  73          3HG2      VAL  73   1.617   6.733   9.937
  553    H    ALA  74           HN       ALA  74   3.283   7.125  11.317
  554    HA   ALA  74           HA       ALA  74   5.609   6.440  12.963
  555    HB1  ALA  74          1HB       ALA  74   6.835   7.831  11.690
  556    HB2  ALA  74          2HB       ALA  74   5.511   7.636  10.541
  557    HB3  ALA  74          3HB       ALA  74   5.557   9.045  11.600
  558    H    ALA  75           HN       ALA  75   3.312   6.790  14.427
  559    HA   ALA  75           HA       ALA  75   2.577   9.259  15.328
  560    HB1  ALA  75          1HB       ALA  75   1.360   7.645  16.361
  561    HB2  ALA  75          2HB       ALA  75   2.753   6.588  16.598
  562    HB3  ALA  75          3HB       ALA  75   2.508   7.975  17.658