*HEADER    TOXIN                                   06-JUL-17   5WE3              
*TITLE     SOLUTION NMR STRUCTURE OF PAURTX-3                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BETA-THERAPHOTOXIN-PS1A;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: BETA-TRTX-PS1A,PHRIXOTOXIN-3,PAURTX3;                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: PARAPHYSA SCROFA;                               
*SOURCE   4 ORGANISM_COMMON: CHILEAN COPPER TARANTULA;                           
*SOURCE   5 ORGANISM_TAXID: 269635                                               
*KEYWDS    DISULFIDE RICH PEPTIDES, PAIN, RATIONAL DRUG DESIGN, SERUM STABILITY, 
*KEYWDS   2 SPIDER VENOM, VOLTAGE-GATED ION CHANNELS, TRIMOLECULAR COMPLEX,      
*KEYWDS   3 TOXIN                                                                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.J.AGWA,C.I.SCHROEDER                                                
*REVDAT   1   13-SEP-17 5WE3    0                                                
# Restraints file 1: hbonds.tbl
#Hbonds
assign (resid 3     and name HN   ) (resid 15    and name O    )    2.00    2.00    0.00
assign (resid 3     and name N    ) (resid 15    and name O    )    3.00    3.00    0.00
assign (resid 6     and name HN   ) (resid 30    and name O    )    2.00    2.00    0.00
assign (resid 6     and name N    ) (resid 30    and name O    )    3.00    3.00    0.00
assign (resid 7     and name O    ) (resid 30    and name HN   )    2.00    2.00    0.00
assign (resid 7     and name O    ) (resid 30    and name N    )    3.00    3.00    0.00
assign (resid 24    and name O    ) (resid 28    and name HN   )    2.00    2.00    0.00
assign (resid 24    and name O    ) (resid 28    and name N    )    3.00    3.00    0.00
assign (resid 22    and name HN   ) (resid 31    and name O    )    2.00    2.00    0.00
assign (resid 22    and name N    ) (resid 31    and name O    )    3.00    3.00    0.00
assign (resid 22    and name O    ) (resid 31    and name HN   )    2.00    2.00    0.00
assign (resid 22    and name O    ) (resid 31    and name N    )    3.00    3.00    0.00
assign (resid 17    and name O    ) (resid 21    and name HN   )    2.00    2.00    0.00
assign (resid 17    and name O    ) (resid 21    and name N    )    3.00    3.00    0.00
# Restraints file 2: dihedrals.tbl
#Dihedral angles
assign (resid 2     and name C    ) (resid 3     and name N    ) (resid 3     and name CA   ) (resid 3     and name C    )    1.0  -79.9   30.7 2
assign (resid 3     and name N    ) (resid 3     and name CA   ) (resid 3     and name C    ) (resid 4     and name N    )    1.0  136.1   22.8 2
assign (resid 3     and name C    ) (resid 4     and name N    ) (resid 4     and name CA   ) (resid 4     and name C    )    1.0  -81.8   37.5 2
assign (resid 4     and name N    ) (resid 4     and name CA   ) (resid 4     and name C    ) (resid 5     and name N    )    1.0  156.8   30.3 2
assign (resid 9     and name C    ) (resid 10    and name N    ) (resid 10    and name CA   ) (resid 10    and name C    )    1.0 -118.6   31.2 2
assign (resid 10    and name N    ) (resid 10    and name CA   ) (resid 10    and name C    ) (resid 11    and name N    )    1.0  141.8   51.3 2
assign (resid 11    and name N    ) (resid 11    and name CA   ) (resid 11    and name C    ) (resid 12    and name N    )    1.0  -29.1   20.0 2
assign (resid 11    and name C    ) (resid 12    and name N    ) (resid 12    and name CA   ) (resid 12    and name C    )    1.0  -82.4   20.0 2
assign (resid 12    and name N    ) (resid 12    and name CA   ) (resid 12    and name C    ) (resid 13    and name N    )    1.0   -8.9   20.0 2
assign (resid 13    and name C    ) (resid 14    and name N    ) (resid 14    and name CA   ) (resid 14    and name C    )    1.0  -74.6   20.0 2
assign (resid 14    and name N    ) (resid 14    and name CA   ) (resid 14    and name C    ) (resid 15    and name N    )    1.0  128.4   28.5 2
assign (resid 15    and name C    ) (resid 16    and name N    ) (resid 16    and name CA   ) (resid 16    and name C    )    1.0  -71.4   30.0 2
assign (resid 16    and name N    ) (resid 16    and name CA   ) (resid 16    and name C    ) (resid 17    and name N    )    1.0  133.2   37.7 2
assign (resid 16    and name C    ) (resid 17    and name N    ) (resid 17    and name CA   ) (resid 17    and name C    )    1.0 -104.4   35.4 2
assign (resid 17    and name C    ) (resid 18    and name N    ) (resid 18    and name CA   ) (resid 18    and name C    )    1.0  -78.5   34.6 2
assign (resid 20    and name N    ) (resid 20    and name CA   ) (resid 20    and name C    ) (resid 21    and name N    )    1.0  -29.8   20.0 2
assign (resid 20    and name C    ) (resid 21    and name N    ) (resid 21    and name CA   ) (resid 21    and name C    )    1.0 -137.2   20.6 2
assign (resid 21    and name N    ) (resid 21    and name CA   ) (resid 21    and name C    ) (resid 22    and name N    )    1.0  140.8   20.0 2
assign (resid 21    and name C    ) (resid 22    and name N    ) (resid 22    and name CA   ) (resid 22    and name C    )    1.0 -108.2   44.1 2
assign (resid 22    and name N    ) (resid 22    and name CA   ) (resid 22    and name C    ) (resid 23    and name N    )    1.0  129.1   34.2 2
assign (resid 22    and name C    ) (resid 23    and name N    ) (resid 23    and name CA   ) (resid 23    and name C    )    1.0  -73.3   34.4 2
assign (resid 23    and name N    ) (resid 23    and name CA   ) (resid 23    and name C    ) (resid 24    and name N    )    1.0  127.7   32.2 2
assign (resid 23    and name C    ) (resid 24    and name N    ) (resid 24    and name CA   ) (resid 24    and name C    )    1.0  -88.2   20.2 2
assign (resid 24    and name N    ) (resid 24    and name CA   ) (resid 24    and name C    ) (resid 25    and name N    )    1.0  110.0   50.0 2
assign (resid 24    and name C    ) (resid 25    and name N    ) (resid 25    and name CA   ) (resid 25    and name C    )    1.0  -62.4   20.0 2
assign (resid 25    and name N    ) (resid 25    and name CA   ) (resid 25    and name C    ) (resid 26    and name N    )    1.0  -31.2   20.0 2
assign (resid 25    and name C    ) (resid 26    and name N    ) (resid 26    and name CA   ) (resid 26    and name C    )    1.0  -72.2   20.8 2
assign (resid 26    and name N    ) (resid 26    and name CA   ) (resid 26    and name C    ) (resid 27    and name N    )    1.0  -43.0   21.7 2
assign (resid 26    and name C    ) (resid 27    and name N    ) (resid 27    and name CA   ) (resid 27    and name C    )    1.0  -84.6   20.9 2
assign (resid 27    and name N    ) (resid 27    and name CA   ) (resid 27    and name C    ) (resid 28    and name N    )    1.0  -15.1   20.0 2
assign (resid 29    and name C    ) (resid 30    and name N    ) (resid 30    and name CA   ) (resid 30    and name C    )    1.0  -80.9   36.8 2
assign (resid 30    and name N    ) (resid 30    and name CA   ) (resid 30    and name C    ) (resid 31    and name N    )    1.0  135.1   31.4 2
assign (resid 31    and name C    ) (resid 32    and name N    ) (resid 32    and name CA   ) (resid 32    and name C    )    1.0  -73.0   25.4 2
assign (resid 32    and name N    ) (resid 32    and name CA   ) (resid 32    and name C    ) (resid 33    and name N    )    1.0  139.1   22.5 2
assign (resid 32    and name C    ) (resid 33    and name N    ) (resid 33    and name CA   ) (resid 33    and name C    )    1.0  -68.4   20.0 2
assign (resid 33    and name N    ) (resid 33    and name CA   ) (resid 33    and name C    ) (resid 34    and name N    )    1.0  120.0   60.0 2
assign (resid 15    and name N    ) (resid 15    and name CA   ) (resid 15    and name CB   ) (resid 15    and name CG   )    1.0 -146.0   30.0 2
assign (resid 17    and name N    ) (resid 17    and name CA   ) (resid 17    and name CB   ) (resid 17    and name SG   )    1.0  -60.0   30.0 2
assign (resid 21    and name N    ) (resid 21    and name CA   ) (resid 21    and name CB   ) (resid 21    and name CG   )    1.0  -60.0   30.0 2
assign (resid 28    and name N    ) (resid 28    and name CA   ) (resid 28    and name CB   ) (resid 28    and name CG   )    1.0  -60.0   30.0 2 
assign (resid 29    and name N    ) (resid 29    and name CA   ) (resid 29    and name CB   ) (resid 29    and name CG   )    1.0   60.0   30.0 2 
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ASP   1          1HT       ASP   1 -11.600   8.582   0.012
    2    H2   ASP   1          2HT       ASP   1 -11.727   9.934   1.025
    3    H3   ASP   1          3HT       ASP   1 -11.968   8.371   1.643
    4    HA   ASP   1           HA       ASP   1  -9.430   9.394   0.583
    5    HB2  ASP   1          2HB       ASP   1  -8.638   9.236   2.878
    6    HB3  ASP   1          1HB       ASP   1 -10.058  10.262   2.858
    7    H    CYS   2           H        CYS   2  -7.802   7.658   1.835
    8    HA   CYS   2           HA       CYS   2  -8.820   4.980   1.284
    9    HB2  CYS   2          2HB       CYS   2  -6.812   4.514  -0.013
   10    HB3  CYS   2          1HB       CYS   2  -7.889   5.630  -0.820
   11    H    LEU   3           H        LEU   3  -6.837   3.510   1.607
   12    HA   LEU   3           HA       LEU   3  -5.896   3.880   4.257
   13    HB2  LEU   3          2HB       LEU   3  -5.100   1.915   2.115
   14    HB3  LEU   3          1HB       LEU   3  -4.668   1.827   3.803
   15    HG   LEU   3           HG       LEU   3  -7.449   1.578   2.691
   16   HD11  LEU   3          1HD1      LEU   3  -6.063  -0.351   2.137
   17   HD12  LEU   3          2HD1      LEU   3  -7.265  -0.784   3.352
   18   HD13  LEU   3          3HD1      LEU   3  -5.589  -0.512   3.828
   19   HD21  LEU   3          1HD2      LEU   3  -6.435   1.194   5.500
   20   HD22  LEU   3          2HD2      LEU   3  -8.083   0.893   4.944
   21   HD23  LEU   3          3HD2      LEU   3  -7.434   2.532   4.933
   22    H    GLY   4           H        GLY   4  -4.064   4.803   4.805
   23    HA2  GLY   4          2HA       GLY   4  -2.536   6.197   2.818
   24    HA3  GLY   4          1HA       GLY   4  -2.340   6.266   4.568
   25    H    PHE   5           H        PHE   5   0.012   6.232   3.780
   26    HA   PHE   5           HA       PHE   5   0.847   3.627   3.013
   27    HB2  PHE   5          2HB       PHE   5   3.150   4.771   3.120
   28    HB3  PHE   5          1HB       PHE   5   2.062   5.300   1.852
   29    HD1  PHE   5          1HD       PHE   5   3.785   6.255   4.945
   30    HD2  PHE   5          2HD       PHE   5   1.097   7.540   1.903
   31    HE1  PHE   5          1HE       PHE   5   4.088   8.579   5.662
   32    HE2  PHE   5          2HE       PHE   5   1.401   9.868   2.617
   33    HZ   PHE   5           HZ       PHE   5   2.899  10.393   4.501
   34    H    LEU   6           H        LEU   6   2.155   2.414   4.284
   35    HA   LEU   6           HA       LEU   6   3.144   1.538   6.113
   36    HB2  LEU   6          2HB       LEU   6   2.046   3.777   7.756
   37    HB3  LEU   6          1HB       LEU   6   3.358   2.679   8.201
   38    HG   LEU   6           HG       LEU   6   3.381   4.792   6.084
   39   HD11  LEU   6          1HD1      LEU   6   4.735   4.676   8.788
   40   HD12  LEU   6          2HD1      LEU   6   3.446   5.776   8.288
   41   HD13  LEU   6          3HD1      LEU   6   5.053   5.914   7.573
   42   HD21  LEU   6          1HD2      LEU   6   4.830   2.967   5.424
   43   HD22  LEU   6          2HD2      LEU   6   5.612   2.966   7.004
   44   HD23  LEU   6          3HD2      LEU   6   5.830   4.335   5.915
   45    H    TRP   7           H        TRP   7   0.023   1.900   5.382
   46    HA   TRP   7           HA       TRP   7  -1.067   0.558   7.699
   47    HB2  TRP   7          2HB       TRP   7  -2.285   1.511   5.124
   48    HB3  TRP   7          1HB       TRP   7  -3.150   0.793   6.443
   49    HD1  TRP   7           HD       TRP   7  -0.645   3.773   6.611
   50    HE1  TRP   7          1HE       TRP   7  -1.816   5.776   7.659
   51    HE3  TRP   7          3HE       TRP   7  -5.296   1.752   7.170
   52    HZ2  TRP   7          2HZ       TRP   7  -4.405   6.439   8.612
   53    HZ3  TRP   7          3HZ       TRP   7  -7.071   3.152   8.159
   54    HH2  TRP   7           HH       TRP   7  -6.625   5.438   8.862
   55    H    LYS   8           H        LYS   8  -1.465  -1.546   7.546
   56    HA   LYS   8           HA       LYS   8  -0.194  -3.083   5.556
   57    HB2  LYS   8          2HB       LYS   8  -0.567  -4.007   7.807
   58    HB3  LYS   8          1HB       LYS   8  -2.306  -3.989   7.525
   59    HG2  LYS   8          2HG       LYS   8  -1.993  -5.526   5.633
   60    HG3  LYS   8          1HG       LYS   8  -0.276  -5.600   6.004
   61    HD2  LYS   8          2HD       LYS   8  -0.729  -6.635   8.119
   62    HD3  LYS   8          1HD       LYS   8  -2.467  -6.408   7.908
   63    HE2  LYS   8          2HE       LYS   8  -0.675  -8.113   6.173
   64    HE3  LYS   8          1HE       LYS   8  -1.824  -8.708   7.369
   65    HZ1  LYS   8          1HZ       LYS   8  -2.542  -7.199   4.879
   66    HZ2  LYS   8          2HZ       LYS   8  -3.611  -7.711   6.064
   67    HZ3  LYS   8          3HZ       LYS   8  -2.778  -8.840   5.167
   68    H    CYS   9           H        CYS   9  -0.921  -3.933   3.703
   69    HA   CYS   9           HA       CYS   9  -3.499  -2.965   2.869
   70    HB2  CYS   9          2HB       CYS   9  -2.661  -3.496   0.630
   71    HB3  CYS   9          1HB       CYS   9  -1.639  -2.378   1.538
   72    H    ASN  10           H        ASN  10  -4.628  -4.398   1.312
   73    HA   ASN  10           HA       ASN  10  -4.478  -7.215   1.982
   74    HB2  ASN  10          2HB       ASN  10  -6.322  -6.100   3.279
   75    HB3  ASN  10          1HB       ASN  10  -6.978  -5.504   1.762
   76   HD21  ASN  10          1HD2      ASN  10  -8.213  -7.257   3.796
   77   HD22  ASN  10          2HD2      ASN  10  -8.624  -8.702   2.955
   78    HA   PRO  11           HA       PRO  11  -4.118  -6.840  -2.516
   79    HB2  PRO  11          2HB       PRO  11  -4.462  -9.775  -2.438
   80    HB3  PRO  11          1HB       PRO  11  -3.152  -8.813  -3.128
   81    HG2  PRO  11          2HG       PRO  11  -2.805 -10.200  -0.879
   82    HG3  PRO  11          1HG       PRO  11  -2.050  -8.611  -1.106
   83    HD2  PRO  11          2HD       PRO  11  -4.470  -9.356   0.489
   84    HD3  PRO  11          1HD       PRO  11  -3.163  -8.207   0.864
   85    H    SER  12           H        SER  12  -6.661  -8.513  -0.816
   86    HA   SER  12           HA       SER  12  -8.274  -8.816  -3.185
   87    HB2  SER  12          2HB       SER  12  -8.548  -9.687  -0.336
   88    HB3  SER  12          1HB       SER  12  -9.618 -10.120  -1.667
   89    HG   SER  12           HG       SER  12  -8.078 -11.751  -1.330
   90    H    ASN  13           H        ASN  13  -7.710  -6.537  -0.823
   91    HA   ASN  13           HA       ASN  13 -10.245  -5.234  -1.178
   92    HB2  ASN  13          2HB       ASN  13 -10.598  -6.757   0.819
   93    HB3  ASN  13          1HB       ASN  13  -9.311  -5.890   1.639
   94   HD21  ASN  13          1HD2      ASN  13  -9.691  -3.791   2.373
   95   HD22  ASN  13          2HD2      ASN  13 -11.283  -3.116   2.478
   96    H    ASP  14           H        ASP  14  -8.514  -4.305  -2.298
   97    HA   ASP  14           HA       ASP  14  -6.544  -2.860  -0.751
   98    HB2  ASP  14          2HB       ASP  14  -5.960  -4.086  -2.753
   99    HB3  ASP  14          1HB       ASP  14  -6.977  -3.037  -3.725
  100    H    LYS  15           H        LYS  15  -7.106  -1.033   0.012
  101    HA   LYS  15           HA       LYS  15  -9.090   0.566  -1.386
  102    HB2  LYS  15          2HB       LYS  15  -9.310  -0.798   0.966
  103    HB3  LYS  15          1HB       LYS  15  -8.735   0.763   1.514
  104    HG2  LYS  15          2HG       LYS  15 -11.142   0.311  -0.196
  105    HG3  LYS  15          1HG       LYS  15 -11.198   0.535   1.553
  106    HD2  LYS  15          2HD       LYS  15 -10.085   2.728   1.242
  107    HD3  LYS  15          1HD       LYS  15 -10.199   2.485  -0.497
  108    HE2  LYS  15          2HE       LYS  15 -12.645   2.423  -0.359
  109    HE3  LYS  15          1HE       LYS  15 -12.565   2.586   1.392
  110    HZ1  LYS  15          1HZ       LYS  15 -11.662   4.630  -0.570
  111    HZ2  LYS  15          2HZ       LYS  15 -11.599   4.781   1.105
  112    HZ3  LYS  15          3HZ       LYS  15 -13.077   4.683   0.342
  113    H    CYS  16           H        CYS  16  -6.150   0.472  -1.571
  114    HA   CYS  16           HA       CYS  16  -5.377   2.871  -0.169
  115    HB2  CYS  16          2HB       CYS  16  -3.714   0.879  -1.724
  116    HB3  CYS  16          1HB       CYS  16  -3.060   2.292  -0.895
  117    H    CYS  17           H        CYS  17  -4.352   4.662  -1.406
  118    HA   CYS  17           HA       CYS  17  -5.718   5.138  -3.872
  119    HB2  CYS  17          2HB       CYS  17  -3.736   6.763  -2.319
  120    HB3  CYS  17          1HB       CYS  17  -4.427   7.313  -3.836
  121    H    ARG  18           H        ARG  18  -4.865   3.491  -5.210
  122    HA   ARG  18           HA       ARG  18  -2.125   3.478  -5.866
  123    HB2  ARG  18          2HB       ARG  18  -4.502   2.100  -7.089
  124    HB3  ARG  18          1HB       ARG  18  -2.820   1.713  -7.439
  125    HG2  ARG  18          2HG       ARG  18  -2.439   1.027  -5.184
  126    HG3  ARG  18          1HG       ARG  18  -4.038   1.586  -4.696
  127    HD2  ARG  18          2HD       ARG  18  -4.083  -0.775  -4.926
  128    HD3  ARG  18          1HD       ARG  18  -5.018  -0.011  -6.215
  129    HE   ARG  18           HE       ARG  18  -2.851  -0.340  -7.553
  130   HH11  ARG  18          1HH1      ARG  18  -3.831  -2.583  -4.997
  131   HH12  ARG  18          2HH1      ARG  18  -3.297  -3.960  -5.823
  132   HH21  ARG  18          1HH2      ARG  18  -2.073  -2.248  -8.653
  133   HH22  ARG  18          2HH2      ARG  18  -2.274  -3.780  -7.932
  134    HA   PRO  19           HA       PRO  19  -0.979   2.817  -7.623
  135    HB2  PRO  19          2HB       PRO  19   0.728   3.425  -9.502
  136    HB3  PRO  19          1HB       PRO  19  -0.889   2.774  -9.881
  137    HG2  PRO  19          2HG       PRO  19   0.084   5.593 -10.093
  138    HG3  PRO  19          1HG       PRO  19  -0.929   4.672 -11.219
  139    HD2  PRO  19          2HD       PRO  19  -1.836   6.432  -9.214
  140    HD3  PRO  19          1HD       PRO  19  -2.827   5.266 -10.110
  141    H    ASN  20           H        ASN  20  -1.046   5.960  -7.100
  142    HA   ASN  20           HA       ASN  20   1.634   6.738  -6.585
  143    HB2  ASN  20          2HB       ASN  20  -0.183   8.415  -6.606
  144    HB3  ASN  20          1HB       ASN  20  -0.814   7.747  -5.106
  145   HD21  ASN  20          1HD2      ASN  20   0.103   8.380  -3.184
  146   HD22  ASN  20          2HD2      ASN  20   1.390   9.527  -3.079
  147    H    LEU  21           H        LEU  21  -0.776   5.380  -4.344
  148    HA   LEU  21           HA       LEU  21   1.443   4.353  -2.762
  149    HB2  LEU  21          2HB       LEU  21  -1.435   4.543  -2.005
  150    HB3  LEU  21          1HB       LEU  21  -0.099   4.132  -0.998
  151    HG   LEU  21           HG       LEU  21  -0.572   6.918  -2.074
  152   HD11  LEU  21          1HD1      LEU  21  -0.924   5.802   0.702
  153   HD12  LEU  21          2HD1      LEU  21  -2.212   6.316  -0.387
  154   HD13  LEU  21          3HD1      LEU  21  -1.069   7.500   0.251
  155   HD21  LEU  21          1HD2      LEU  21   1.506   5.855  -0.154
  156   HD22  LEU  21          2HD2      LEU  21   1.238   7.557  -0.529
  157   HD23  LEU  21          3HD2      LEU  21   1.797   6.457  -1.788
  158    H    VAL  22           H        VAL  22   1.251   2.226  -2.411
  159    HA   VAL  22           HA       VAL  22  -0.904   0.725  -3.576
  160    HB   VAL  22           HB       VAL  22   0.367   1.188  -5.564
  161   HG11  VAL  22          1HG1      VAL  22   2.575   1.539  -4.652
  162   HG12  VAL  22          2HG1      VAL  22   2.644   0.341  -5.942
  163   HG13  VAL  22          3HG1      VAL  22   2.710  -0.175  -4.256
  164   HG21  VAL  22          1HG2      VAL  22   0.636  -1.712  -4.775
  165   HG22  VAL  22          2HG2      VAL  22   0.772  -1.106  -6.425
  166   HG23  VAL  22          3HG2      VAL  22  -0.753  -0.950  -5.551
  167    H    CYS  23           H        CYS  23  -0.962  -1.365  -3.045
  168    HA   CYS  23           HA       CYS  23   0.112  -2.116  -0.558
  169    HB2  CYS  23          2HB       CYS  23  -1.972  -3.023  -1.330
  170    HB3  CYS  23          1HB       CYS  23  -1.165  -3.726  -2.739
  171    H    SER  24           H        SER  24   1.981  -2.818  -0.156
  172    HA   SER  24           HA       SER  24   3.702  -3.666  -2.321
  173    HB2  SER  24          2HB       SER  24   4.575  -1.928  -0.872
  174    HB3  SER  24          1HB       SER  24   4.307  -2.948   0.540
  175    HG   SER  24           HG       SER  24   6.505  -2.862  -0.406
  176    H    ARG  25           H        ARG  25   4.226  -5.671  -2.609
  177    HA   ARG  25           HA       ARG  25   3.221  -7.794  -0.927
  178    HB2  ARG  25          2HB       ARG  25   3.237  -7.885  -3.400
  179    HB3  ARG  25          1HB       ARG  25   4.987  -7.812  -3.386
  180    HG2  ARG  25          2HG       ARG  25   5.059  -9.989  -2.278
  181    HG3  ARG  25          1HG       ARG  25   3.293 -10.049  -2.283
  182    HD2  ARG  25          2HD       ARG  25   3.336  -9.867  -4.753
  183    HD3  ARG  25          1HD       ARG  25   5.094  -9.929  -4.699
  184    HE   ARG  25           HE       ARG  25   4.190 -12.119  -3.327
  185   HH11  ARG  25          1HH1      ARG  25   4.109 -10.906  -6.674
  186   HH12  ARG  25          2HH1      ARG  25   3.848 -12.443  -7.370
  187   HH21  ARG  25          1HH2      ARG  25   3.909 -14.261  -4.346
  188   HH22  ARG  25          2HH2      ARG  25   3.736 -14.358  -6.028
  189    H    LYS  26           H        LYS  26   5.991  -5.932  -1.364
  190    HA   LYS  26           HA       LYS  26   7.976  -7.712  -0.235
  191    HB2  LYS  26          2HB       LYS  26   8.336  -6.017  -2.051
  192    HB3  LYS  26          1HB       LYS  26   8.066  -4.784  -0.864
  193    HG2  LYS  26          2HG       LYS  26  10.011  -5.461   0.407
  194    HG3  LYS  26          1HG       LYS  26  10.314  -6.780  -0.731
  195    HD2  LYS  26          2HD       LYS  26  10.563  -5.131  -2.545
  196    HD3  LYS  26          1HD       LYS  26  10.307  -3.835  -1.383
  197    HE2  LYS  26          2HE       LYS  26  12.685  -4.184  -1.898
  198    HE3  LYS  26          1HE       LYS  26  12.318  -4.443  -0.197
  199    HZ1  LYS  26          1HZ       LYS  26  12.584  -6.618  -2.204
  200    HZ2  LYS  26          2HZ       LYS  26  12.437  -6.805  -0.527
  201    HZ3  LYS  26          3HZ       LYS  26  13.808  -6.111  -1.185
  202    H    ASP  27           H        ASP  27   6.492  -4.604   0.580
  203    HA   ASP  27           HA       ASP  27   7.622  -4.617   3.221
  204    HB2  ASP  27          2HB       ASP  27   5.847  -2.622   1.829
  205    HB3  ASP  27          1HB       ASP  27   6.627  -2.408   3.382
  206    H    LYS  28           H        LYS  28   4.562  -5.486   1.734
  207    HA   LYS  28           HA       LYS  28   2.798  -6.445   2.443
  208    HB2  LYS  28          2HB       LYS  28   3.707  -6.276   5.321
  209    HB3  LYS  28          1HB       LYS  28   2.454  -7.256   4.557
  210    HG2  LYS  28          2HG       LYS  28   5.407  -7.570   4.076
  211    HG3  LYS  28          1HG       LYS  28   4.437  -8.581   5.141
  212    HD2  LYS  28          2HD       LYS  28   3.075  -9.259   3.186
  213    HD3  LYS  28          1HD       LYS  28   4.136  -8.299   2.150
  214    HE2  LYS  28          2HE       LYS  28   6.059  -9.636   2.963
  215    HE3  LYS  28          1HE       LYS  28   4.931 -10.651   3.855
  216    HZ1  LYS  28          1HZ       LYS  28   4.982 -10.288   0.917
  217    HZ2  LYS  28          2HZ       LYS  28   3.919 -11.301   1.751
  218    HZ3  LYS  28          3HZ       LYS  28   5.567 -11.628   1.746
  219    H    TRP  29           H        TRP  29   3.576  -3.395   3.095
  220    HA   TRP  29           HA       TRP  29   0.805  -2.843   3.824
  221    HB2  TRP  29          2HB       TRP  29   1.512  -0.828   5.051
  222    HB3  TRP  29          1HB       TRP  29   2.167  -2.283   5.767
  223    HD1  TRP  29           HD       TRP  29   3.434   0.483   3.318
  224    HE1  TRP  29          1HE       TRP  29   5.864   1.046   3.959
  225    HE3  TRP  29          3HE       TRP  29   4.076  -2.886   7.102
  226    HZ2  TRP  29          2HZ       TRP  29   7.798   0.179   5.825
  227    HZ3  TRP  29          3HZ       TRP  29   6.248  -2.944   8.274
  228    HH2  TRP  29           HH       TRP  29   8.060  -1.439   7.640
  229    H    CYS  30           H        CYS  30   0.070  -0.622   3.088
  230    HA   CYS  30           HA       CYS  30   0.878  -0.301   0.422
  231    HB2  CYS  30          2HB       CYS  30  -1.061   1.055   2.260
  232    HB3  CYS  30          1HB       CYS  30  -0.687   1.716   0.674
  233    H    LYS  31           H        LYS  31   2.303   1.001  -0.317
  234    HA   LYS  31           HA       LYS  31   3.562   2.943   1.501
  235    HB2  LYS  31          2HB       LYS  31   4.667   0.506   1.022
  236    HB3  LYS  31          1HB       LYS  31   5.131   1.394  -0.427
  237    HG2  LYS  31          2HG       LYS  31   6.369   2.981   0.831
  238    HG3  LYS  31          1HG       LYS  31   5.853   2.238   2.355
  239    HD2  LYS  31          2HD       LYS  31   6.891   0.111   1.617
  240    HD3  LYS  31          1HD       LYS  31   7.480   0.932   0.179
  241    HE2  LYS  31          2HE       LYS  31   8.222   1.566   3.036
  242    HE3  LYS  31          1HE       LYS  31   9.222   0.711   1.872
  243    HZ1  LYS  31          1HZ       LYS  31   9.167   2.755   0.490
  244    HZ2  LYS  31          2HZ       LYS  31   9.932   2.929   1.985
  245    HZ3  LYS  31          3HZ       LYS  31   8.377   3.542   1.775
  246    H    TYR  32           H        TYR  32   5.123   4.176  -0.033
  247    HA   TYR  32           HA       TYR  32   3.557   5.252  -2.228
  248    HB2  TYR  32          2HB       TYR  32   5.164   6.536  -0.622
  249    HB3  TYR  32          1HB       TYR  32   6.429   5.823  -1.566
  250    HD1  TYR  32          1HD       TYR  32   3.783   8.332  -1.578
  251    HD2  TYR  32          2HD       TYR  32   6.869   6.534  -3.877
  252    HE1  TYR  32          1HE       TYR  32   3.695  10.191  -3.171
  253    HE2  TYR  32          2HE       TYR  32   6.787   8.366  -5.457
  254    HH   TYR  32           HH       TYR  32   5.155  11.258  -4.761
  255    H    GLN  33           H        GLN  33   4.231   5.043  -4.414
  256    HA   GLN  33           HA       GLN  33   5.825   2.690  -4.856
  257    HB2  GLN  33          2HB       GLN  33   3.806   3.168  -6.185
  258    HB3  GLN  33          1HB       GLN  33   4.690   4.552  -6.862
  259    HG2  GLN  33          2HG       GLN  33   6.367   3.037  -7.801
  260    HG3  GLN  33          1HG       GLN  33   5.496   1.656  -7.149
  261   HE21  GLN  33          1HE2      GLN  33   2.856   2.827  -7.870
  262   HE22  GLN  33          2HE2      GLN  33   2.773   2.602  -9.578
  263    H    ILE  34           H        ILE  34   7.461   3.985  -3.750
  264    HA   ILE  34           HA       ILE  34   9.161   5.549  -5.477
  265    HB   ILE  34           HB       ILE  34  10.012   4.213  -2.865
  266   HG12  ILE  34          2HG1      ILE  34   9.121   7.065  -3.390
  267   HG13  ILE  34          1HG1      ILE  34   8.223   5.837  -2.505
  268   HG21  ILE  34          1HG2      ILE  34  11.896   5.804  -2.896
  269   HG22  ILE  34          2HG2      ILE  34  11.359   6.399  -4.466
  270   HG23  ILE  34          3HG2      ILE  34  11.917   4.735  -4.300
  271   HD11  ILE  34          1HD1      ILE  34   9.939   5.805  -0.782
  272   HD12  ILE  34          2HD1      ILE  34   9.285   7.430  -1.009
  273   HD13  ILE  34          3HD1      ILE  34  10.864   7.011  -1.676
  Start of MODEL    2
    1    H1   ASP   1          1HT       ASP   1 -12.912   8.869   1.549
    2    H2   ASP   1          2HT       ASP   1 -12.817   7.319   2.196
    3    H3   ASP   1          3HT       ASP   1 -12.639   7.531   0.523
    4    HA   ASP   1           HA       ASP   1 -10.589   8.794   1.021
    5    HB2  ASP   1          2HB       ASP   1  -9.634   8.480   3.244
    6    HB3  ASP   1          1HB       ASP   1 -11.131   9.389   3.344
    7    H    CYS   2           H        CYS   2  -8.611   7.581   1.446
    8    HA   CYS   2           HA       CYS   2  -9.018   4.714   1.140
    9    HB2  CYS   2          2HB       CYS   2  -6.842   4.903  -0.261
   10    HB3  CYS   2          1HB       CYS   2  -8.403   5.158  -1.007
   11    H    LEU   3           H        LEU   3  -7.068   3.472   1.555
   12    HA   LEU   3           HA       LEU   3  -6.038   4.175   4.084
   13    HB2  LEU   3          2HB       LEU   3  -5.381   1.940   2.180
   14    HB3  LEU   3          1HB       LEU   3  -4.771   2.089   3.808
   15    HG   LEU   3           HG       LEU   3  -7.677   1.739   3.080
   16   HD11  LEU   3          1HD1      LEU   3  -5.680  -0.229   4.192
   17   HD12  LEU   3          2HD1      LEU   3  -6.366  -0.251   2.567
   18   HD13  LEU   3          3HD1      LEU   3  -7.404  -0.525   3.967
   19   HD21  LEU   3          1HD2      LEU   3  -7.371   2.941   5.181
   20   HD22  LEU   3          2HD2      LEU   3  -6.270   1.686   5.748
   21   HD23  LEU   3          3HD2      LEU   3  -7.970   1.309   5.474
   22    H    GLY   4           H        GLY   4  -4.165   4.975   4.557
   23    HA2  GLY   4          2HA       GLY   4  -2.616   6.185   2.462
   24    HA3  GLY   4          1HA       GLY   4  -2.446   6.420   4.200
   25    H    PHE   5           H        PHE   5  -0.124   6.252   3.487
   26    HA   PHE   5           HA       PHE   5   0.704   3.607   2.868
   27    HB2  PHE   5          2HB       PHE   5   3.007   4.638   2.996
   28    HB3  PHE   5          1HB       PHE   5   1.957   5.365   1.796
   29    HD1  PHE   5          1HD       PHE   5   0.943   7.629   2.270
   30    HD2  PHE   5          2HD       PHE   5   3.947   5.900   4.741
   31    HE1  PHE   5          1HE       PHE   5   1.437   9.836   3.211
   32    HE2  PHE   5          2HE       PHE   5   4.435   8.104   5.687
   33    HZ   PHE   5           HZ       PHE   5   3.186  10.076   4.924
   34    H    LEU   6           H        LEU   6   2.233   2.550   4.253
   35    HA   LEU   6           HA       LEU   6   3.110   1.773   6.187
   36    HB2  LEU   6          2HB       LEU   6   1.504   3.786   7.702
   37    HB3  LEU   6          1HB       LEU   6   2.886   2.867   8.300
   38    HG   LEU   6           HG       LEU   6   2.870   5.113   6.311
   39   HD11  LEU   6          1HD1      LEU   6   3.998   4.940   9.110
   40   HD12  LEU   6          2HD1      LEU   6   2.588   5.867   8.597
   41   HD13  LEU   6          3HD1      LEU   6   4.195   6.314   8.021
   42   HD21  LEU   6          1HD2      LEU   6   5.225   3.511   7.335
   43   HD22  LEU   6          2HD2      LEU   6   5.334   4.951   6.323
   44   HD23  LEU   6          3HD2      LEU   6   4.580   3.486   5.693
   45    H    TRP   7           H        TRP   7  -0.145   2.088   5.408
   46    HA   TRP   7           HA       TRP   7  -1.230   0.548   7.549
   47    HB2  TRP   7          2HB       TRP   7  -2.310   1.671   4.989
   48    HB3  TRP   7          1HB       TRP   7  -3.261   0.670   6.071
   49    HD1  TRP   7           HD       TRP   7  -1.262   3.983   6.227
   50    HE1  TRP   7          1HE       TRP   7  -2.415   5.527   7.904
   51    HE3  TRP   7          3HE       TRP   7  -4.937   0.837   7.780
   52    HZ2  TRP   7          2HZ       TRP   7  -4.636   5.437   9.657
   53    HZ3  TRP   7          3HZ       TRP   7  -6.536   1.628   9.448
   54    HH2  TRP   7           HH       TRP   7  -6.393   3.890  10.372
   55    H    LYS   8           H        LYS   8  -2.171  -1.481   7.297
   56    HA   LYS   8           HA       LYS   8  -0.563  -3.291   5.851
   57    HB2  LYS   8          2HB       LYS   8  -1.682  -3.792   8.037
   58    HB3  LYS   8          1HB       LYS   8  -3.231  -3.734   7.212
   59    HG2  LYS   8          2HG       LYS   8  -2.573  -6.022   7.535
   60    HG3  LYS   8          1HG       LYS   8  -2.526  -5.628   5.811
   61    HD2  LYS   8          2HD       LYS   8  -0.086  -5.247   6.007
   62    HD3  LYS   8          1HD       LYS   8  -0.183  -5.747   7.694
   63    HE2  LYS   8          2HE       LYS   8  -0.921  -7.449   5.324
   64    HE3  LYS   8          1HE       LYS   8   0.620  -7.518   6.168
   65    HZ1  LYS   8          1HZ       LYS   8  -2.043  -8.169   7.321
   66    HZ2  LYS   8          2HZ       LYS   8  -0.568  -8.184   8.175
   67    HZ3  LYS   8          3HZ       LYS   8  -0.812  -9.243   6.894
   68    H    CYS   9           H        CYS   9  -0.879  -4.026   3.785
   69    HA   CYS   9           HA       CYS   9  -3.307  -3.098   2.526
   70    HB2  CYS   9          2HB       CYS   9  -2.101  -3.280   0.449
   71    HB3  CYS   9          1HB       CYS   9  -1.258  -2.292   1.648
   72    H    ASN  10           H        ASN  10  -4.241  -4.399   0.879
   73    HA   ASN  10           HA       ASN  10  -3.905  -7.280   1.187
   74    HB2  ASN  10          2HB       ASN  10  -5.930  -6.533   2.441
   75    HB3  ASN  10          1HB       ASN  10  -6.515  -5.745   0.985
   76   HD21  ASN  10          1HD2      ASN  10  -7.689  -7.834   2.618
   77   HD22  ASN  10          2HD2      ASN  10  -8.020  -9.169   1.569
   78    HA   PRO  11           HA       PRO  11  -3.158  -6.398  -3.184
   79    HB2  PRO  11          2HB       PRO  11  -3.298  -9.363  -3.249
   80    HB3  PRO  11          1HB       PRO  11  -2.079  -8.278  -3.921
   81    HG2  PRO  11          2HG       PRO  11  -1.565  -9.643  -1.703
   82    HG3  PRO  11          1HG       PRO  11  -1.040  -7.957  -1.861
   83    HD2  PRO  11          2HD       PRO  11  -3.340  -9.083  -0.315
   84    HD3  PRO  11          1HD       PRO  11  -2.230  -7.757   0.090
   85    H    SER  12           H        SER  12  -5.835  -8.272  -1.895
   86    HA   SER  12           HA       SER  12  -7.098  -8.425  -4.549
   87    HB2  SER  12          2HB       SER  12  -6.836 -10.471  -3.129
   88    HB3  SER  12          1HB       SER  12  -7.906  -9.730  -1.956
   89    HG   SER  12           HG       SER  12  -8.476 -10.864  -4.399
   90    H    ASN  13           H        ASN  13  -7.043  -6.577  -1.788
   91    HA   ASN  13           HA       ASN  13  -9.657  -5.446  -2.235
   92    HB2  ASN  13          2HB       ASN  13 -10.066  -7.282  -0.588
   93    HB3  ASN  13          1HB       ASN  13  -8.875  -6.562   0.482
   94   HD21  ASN  13          1HD2      ASN  13 -10.367  -6.249   2.124
   95   HD22  ASN  13          2HD2      ASN  13 -11.605  -5.057   2.042
   96    H    ASP  14           H        ASP  14  -8.056  -4.125  -2.991
   97    HA   ASP  14           HA       ASP  14  -6.262  -2.851  -1.158
   98    HB2  ASP  14          2HB       ASP  14  -5.396  -3.615  -3.149
   99    HB3  ASP  14          1HB       ASP  14  -6.667  -2.894  -4.096
  100    H    LYS  15           H        LYS  15  -6.823  -1.132  -0.214
  101    HA   LYS  15           HA       LYS  15  -8.897   0.524  -1.388
  102    HB2  LYS  15          2HB       LYS  15  -9.007  -1.051   0.835
  103    HB3  LYS  15          1HB       LYS  15  -8.582   0.514   1.526
  104    HG2  LYS  15          2HG       LYS  15 -10.927  -0.139  -0.217
  105    HG3  LYS  15          1HG       LYS  15 -10.994   0.180   1.518
  106    HD2  LYS  15          2HD       LYS  15 -10.114   2.444   1.073
  107    HD3  LYS  15          1HD       LYS  15 -10.169   2.082  -0.650
  108    HE2  LYS  15          2HE       LYS  15 -12.606   1.678  -0.455
  109    HE3  LYS  15          1HE       LYS  15 -12.535   2.157   1.237
  110    HZ1  LYS  15          1HZ       LYS  15 -11.889   3.873  -1.095
  111    HZ2  LYS  15          2HZ       LYS  15 -11.787   4.377   0.501
  112    HZ3  LYS  15          3HZ       LYS  15 -13.280   3.974  -0.167
  113    H    CYS  16           H        CYS  16  -5.775   0.431  -1.247
  114    HA   CYS  16           HA       CYS  16  -5.302   2.810   0.268
  115    HB2  CYS  16          2HB       CYS  16  -3.423   1.024  -1.267
  116    HB3  CYS  16          1HB       CYS  16  -2.901   2.503  -0.457
  117    H    CYS  17           H        CYS  17  -4.170   4.642  -0.692
  118    HA   CYS  17           HA       CYS  17  -5.677   5.670  -2.840
  119    HB2  CYS  17          2HB       CYS  17  -3.178   6.732  -1.577
  120    HB3  CYS  17          1HB       CYS  17  -4.288   7.663  -2.553
  121    H    ARG  18           H        ARG  18  -5.140   4.115  -4.606
  122    HA   ARG  18           HA       ARG  18  -2.514   4.315  -5.650
  123    HB2  ARG  18          2HB       ARG  18  -3.316   2.742  -7.372
  124    HB3  ARG  18          1HB       ARG  18  -3.656   2.178  -5.748
  125    HG2  ARG  18          2HG       ARG  18  -5.988   3.116  -6.101
  126    HG3  ARG  18          1HG       ARG  18  -5.550   3.235  -7.813
  127    HD2  ARG  18          2HD       ARG  18  -4.862   0.815  -7.663
  128    HD3  ARG  18          1HD       ARG  18  -5.589   0.844  -6.053
  129    HE   ARG  18           HE       ARG  18  -7.217   1.615  -8.334
  130   HH11  ARG  18          1HH1      ARG  18  -6.604  -0.715  -5.703
  131   HH12  ARG  18          2HH1      ARG  18  -7.991  -1.638  -6.056
  132   HH21  ARG  18          1HH2      ARG  18  -9.139   0.284  -8.760
  133   HH22  ARG  18          2HH2      ARG  18  -9.415  -1.086  -7.776
  134    HA   PRO  19           HA       PRO  19  -1.676   3.968  -7.702
  135    HB2  PRO  19          2HB       PRO  19  -0.322   4.995  -9.690
  136    HB3  PRO  19          1HB       PRO  19  -1.939   4.266  -9.895
  137    HG2  PRO  19          2HG       PRO  19  -1.175   7.153  -9.892
  138    HG3  PRO  19          1HG       PRO  19  -2.361   6.313 -10.901
  139    HD2  PRO  19          2HD       PRO  19  -2.872   7.726  -8.503
  140    HD3  PRO  19          1HD       PRO  19  -4.007   6.683  -9.383
  141    H    ASN  20           H        ASN  20  -1.795   6.786  -6.485
  142    HA   ASN  20           HA       ASN  20   0.899   7.754  -6.298
  143    HB2  ASN  20          2HB       ASN  20  -1.121   9.100  -5.568
  144    HB3  ASN  20          1HB       ASN  20  -1.168   8.114  -4.109
  145   HD21  ASN  20          1HD2      ASN  20  -0.739   9.802  -2.707
  146   HD22  ASN  20          2HD2      ASN  20   0.773  10.615  -2.636
  147    H    LEU  21           H        LEU  21  -0.964   5.627  -4.157
  148    HA   LEU  21           HA       LEU  21   1.547   4.623  -3.009
  149    HB2  LEU  21          2HB       LEU  21  -1.258   4.434  -1.970
  150    HB3  LEU  21          1HB       LEU  21   0.207   3.939  -1.175
  151    HG   LEU  21           HG       LEU  21  -0.498   6.809  -1.783
  152   HD11  LEU  21          1HD1      LEU  21  -0.526   5.317   0.825
  153   HD12  LEU  21          2HD1      LEU  21  -1.941   5.851  -0.075
  154   HD13  LEU  21          3HD1      LEU  21  -0.832   7.039   0.610
  155   HD21  LEU  21          1HD2      LEU  21   1.800   5.589  -0.256
  156   HD22  LEU  21          2HD2      LEU  21   1.406   7.304  -0.288
  157   HD23  LEU  21          3HD2      LEU  21   1.896   6.487  -1.773
  158    H    VAL  22           H        VAL  22   1.488   2.390  -2.595
  159    HA   VAL  22           HA       VAL  22  -0.411   0.751  -4.023
  160    HB   VAL  22           HB       VAL  22   1.259   1.350  -5.717
  161   HG11  VAL  22          1HG1      VAL  22   3.231   1.663  -4.378
  162   HG12  VAL  22          2HG1      VAL  22   3.560   0.454  -5.620
  163   HG13  VAL  22          3HG1      VAL  22   3.259  -0.049  -3.957
  164   HG21  VAL  22          1HG2      VAL  22   1.775  -0.915  -6.547
  165   HG22  VAL  22          2HG2      VAL  22   0.119  -0.781  -5.959
  166   HG23  VAL  22          3HG2      VAL  22   1.345  -1.573  -4.970
  167    H    CYS  23           H        CYS  23  -0.204  -1.400  -3.459
  168    HA   CYS  23           HA       CYS  23   0.670  -1.848  -0.752
  169    HB2  CYS  23          2HB       CYS  23  -1.364  -2.854  -1.375
  170    HB3  CYS  23          1HB       CYS  23  -0.634  -3.599  -2.801
  171    H    SER  24           H        SER  24   2.543  -2.387  -0.248
  172    HA   SER  24           HA       SER  24   4.380  -3.537  -2.183
  173    HB2  SER  24          2HB       SER  24   5.171  -1.662  -0.750
  174    HB3  SER  24          1HB       SER  24   4.804  -2.618   0.681
  175    HG   SER  24           HG       SER  24   7.032  -2.766   0.172
  176    H    ARG  25           H        ARG  25   4.295  -5.688  -2.343
  177    HA   ARG  25           HA       ARG  25   3.168  -7.297  -0.244
  178    HB2  ARG  25          2HB       ARG  25   2.873  -7.795  -2.687
  179    HB3  ARG  25          1HB       ARG  25   4.584  -8.171  -2.778
  180    HG2  ARG  25          2HG       ARG  25   4.296 -10.073  -1.324
  181    HG3  ARG  25          1HG       ARG  25   2.602  -9.651  -1.055
  182    HD2  ARG  25          2HD       ARG  25   2.177  -9.943  -3.461
  183    HD3  ARG  25          1HD       ARG  25   3.851 -10.423  -3.687
  184    HE   ARG  25           HE       ARG  25   3.375 -12.327  -2.218
  185   HH11  ARG  25          1HH1      ARG  25   0.626 -10.744  -3.824
  186   HH12  ARG  25          2HH1      ARG  25  -0.336 -12.130  -3.883
  187   HH21  ARG  25          1HH2      ARG  25   2.028 -14.251  -2.303
  188   HH22  ARG  25          2HH2      ARG  25   0.480 -14.189  -3.001
  189    H    LYS  26           H        LYS  26   6.158  -6.036  -0.986
  190    HA   LYS  26           HA       LYS  26   7.818  -7.994   0.301
  191    HB2  LYS  26          2HB       LYS  26   8.570  -6.354  -1.471
  192    HB3  LYS  26          1HB       LYS  26   8.384  -5.096  -0.281
  193    HG2  LYS  26          2HG       LYS  26  10.065  -6.131   1.145
  194    HG3  LYS  26          1HG       LYS  26  10.283  -7.418  -0.044
  195    HD2  LYS  26          2HD       LYS  26  10.978  -5.745  -1.706
  196    HD3  LYS  26          1HD       LYS  26  10.776  -4.477  -0.498
  197    HE2  LYS  26          2HE       LYS  26  12.700  -6.791  -0.340
  198    HE3  LYS  26          1HE       LYS  26  13.120  -5.124  -0.725
  199    HZ1  LYS  26          1HZ       LYS  26  11.930  -6.016   1.848
  200    HZ2  LYS  26          2HZ       LYS  26  12.452  -4.461   1.508
  201    HZ3  LYS  26          3HZ       LYS  26  13.552  -5.731   1.603
  202    H    ASP  27           H        ASP  27   6.928  -4.612   1.064
  203    HA   ASP  27           HA       ASP  27   7.838  -4.767   3.753
  204    HB2  ASP  27          2HB       ASP  27   6.166  -2.697   2.335
  205    HB3  ASP  27          1HB       ASP  27   6.839  -2.532   3.941
  206    H    LYS  28           H        LYS  28   4.823  -5.396   2.140
  207    HA   LYS  28           HA       LYS  28   2.937  -6.182   2.695
  208    HB2  LYS  28          2HB       LYS  28   3.967  -6.417   5.520
  209    HB3  LYS  28          1HB       LYS  28   2.457  -7.041   4.841
  210    HG2  LYS  28          2HG       LYS  28   3.675  -8.498   3.351
  211    HG3  LYS  28          1HG       LYS  28   5.207  -7.866   3.961
  212    HD2  LYS  28          2HD       LYS  28   4.651  -8.687   6.196
  213    HD3  LYS  28          1HD       LYS  28   3.127  -9.330   5.580
  214    HE2  LYS  28          2HE       LYS  28   4.769 -11.093   5.747
  215    HE3  LYS  28          1HE       LYS  28   4.382 -10.788   4.058
  216    HZ1  LYS  28          1HZ       LYS  28   6.785  -9.756   5.469
  217    HZ2  LYS  28          2HZ       LYS  28   6.439  -9.559   3.825
  218    HZ3  LYS  28          3HZ       LYS  28   6.750 -11.078   4.439
  219    H    TRP  29           H        TRP  29   3.655  -3.334   2.935
  220    HA   TRP  29           HA       TRP  29   1.047  -2.577   3.938
  221    HB2  TRP  29          2HB       TRP  29   1.847  -0.625   5.158
  222    HB3  TRP  29          1HB       TRP  29   2.576  -2.067   5.826
  223    HD1  TRP  29           HD       TRP  29   3.587   0.768   3.350
  224    HE1  TRP  29          1HE       TRP  29   6.033   1.361   3.774
  225    HE3  TRP  29          3HE       TRP  29   4.623  -2.691   6.951
  226    HZ2  TRP  29          2HZ       TRP  29   8.146   0.482   5.432
  227    HZ3  TRP  29          3HZ       TRP  29   6.880  -2.731   7.916
  228    HH2  TRP  29           HH       TRP  29   8.600  -1.180   7.169
  229    H    CYS  30           H        CYS  30   0.384  -0.398   3.114
  230    HA   CYS  30           HA       CYS  30   1.137  -0.150   0.432
  231    HB2  CYS  30          2HB       CYS  30  -0.624   1.421   2.289
  232    HB3  CYS  30          1HB       CYS  30  -0.389   1.838   0.596
  233    H    LYS  31           H        LYS  31   2.461   1.268  -0.502
  234    HA   LYS  31           HA       LYS  31   3.998   3.103   1.163
  235    HB2  LYS  31          2HB       LYS  31   4.903   0.603   1.014
  236    HB3  LYS  31          1HB       LYS  31   5.312   1.089  -0.621
  237    HG2  LYS  31          2HG       LYS  31   6.842   2.750   0.184
  238    HG3  LYS  31          1HG       LYS  31   6.367   2.427   1.861
  239    HD2  LYS  31          2HD       LYS  31   7.149   0.093   1.575
  240    HD3  LYS  31          1HD       LYS  31   7.693   0.501  -0.048
  241    HE2  LYS  31          2HE       LYS  31   9.243   2.155   0.904
  242    HE3  LYS  31          1HE       LYS  31   8.694   1.725   2.524
  243    HZ1  LYS  31          1HZ       LYS  31  10.031  -0.093   0.602
  244    HZ2  LYS  31          2HZ       LYS  31   9.521  -0.563   2.126
  245    HZ3  LYS  31          3HZ       LYS  31  10.763   0.578   1.952
  246    H    TYR  32           H        TYR  32   5.780   3.809  -0.744
  247    HA   TYR  32           HA       TYR  32   4.118   4.902  -2.891
  248    HB2  TYR  32          2HB       TYR  32   5.837   6.202  -1.448
  249    HB3  TYR  32          1HB       TYR  32   7.036   5.341  -2.347
  250    HD1  TYR  32          1HD       TYR  32   4.145   7.625  -2.876
  251    HD2  TYR  32          2HD       TYR  32   7.869   6.191  -4.343
  252    HE1  TYR  32          1HE       TYR  32   4.123   9.358  -4.590
  253    HE2  TYR  32          2HE       TYR  32   7.867   7.909  -6.066
  254    HH   TYR  32           HH       TYR  32   5.722  10.561  -6.004
  255    H    GLN  33           H        GLN  33   4.635   4.428  -5.110
  256    HA   GLN  33           HA       GLN  33   6.204   2.033  -5.458
  257    HB2  GLN  33          2HB       GLN  33   4.081   2.441  -6.731
  258    HB3  GLN  33          1HB       GLN  33   4.949   3.748  -7.552
  259    HG2  GLN  33          2HG       GLN  33   6.596   2.086  -8.368
  260    HG3  GLN  33          1HG       GLN  33   5.601   0.812  -7.673
  261   HE21  GLN  33          1HE2      GLN  33   6.397   1.281 -10.431
  262   HE22  GLN  33          2HE2      GLN  33   4.971   1.431 -11.354
  263    H    ILE  34           H        ILE  34   7.813   3.327  -4.535
  264    HA   ILE  34           HA       ILE  34   9.463   5.205  -5.804
  265    HB   ILE  34           HB       ILE  34  10.465   2.874  -4.124
  266   HG12  ILE  34          2HG1      ILE  34   9.595   5.630  -3.200
  267   HG13  ILE  34          1HG1      ILE  34   8.647   4.160  -3.007
  268   HG21  ILE  34          1HG2      ILE  34  12.252   4.069  -5.287
  269   HG22  ILE  34          2HG2      ILE  34  12.327   4.385  -3.554
  270   HG23  ILE  34          3HG2      ILE  34  11.664   5.602  -4.644
  271   HD11  ILE  34          1HD1      ILE  34  11.339   4.706  -1.769
  272   HD12  ILE  34          2HD1      ILE  34  10.381   3.240  -1.555
  273   HD13  ILE  34          3HD1      ILE  34   9.780   4.781  -0.948
  Start of MODEL    3
    1    H1   ASP   1          1HT       ASP   1 -12.735   8.714  -0.755
    2    H2   ASP   1          2HT       ASP   1 -12.741   7.030  -0.523
    3    H3   ASP   1          3HT       ASP   1 -11.808   7.703  -1.737
    4    HA   ASP   1           HA       ASP   1 -10.399   8.798  -0.160
    5    HB2  ASP   1          2HB       ASP   1 -10.583   8.210   2.210
    6    HB3  ASP   1          1HB       ASP   1 -12.002   9.086   1.661
    7    H    CYS   2           H        CYS   2  -8.783   7.503   1.242
    8    HA   CYS   2           HA       CYS   2  -8.779   4.714   0.613
    9    HB2  CYS   2          2HB       CYS   2  -6.489   4.972  -0.378
   10    HB3  CYS   2          1HB       CYS   2  -7.879   5.397  -1.373
   11    H    LEU   3           H        LEU   3  -6.654   3.770   1.315
   12    HA   LEU   3           HA       LEU   3  -6.044   4.675   3.982
   13    HB2  LEU   3          2HB       LEU   3  -5.272   2.216   2.428
   14    HB3  LEU   3          1HB       LEU   3  -4.876   2.535   4.096
   15    HG   LEU   3           HG       LEU   3  -7.646   2.117   2.985
   16   HD11  LEU   3          1HD1      LEU   3  -7.601   0.028   4.257
   17   HD12  LEU   3          2HD1      LEU   3  -5.928   0.347   4.715
   18   HD13  LEU   3          3HD1      LEU   3  -6.343   0.070   3.023
   19   HD21  LEU   3          1HD2      LEU   3  -8.364   2.083   5.336
   20   HD22  LEU   3          2HD2      LEU   3  -7.702   3.647   4.873
   21   HD23  LEU   3          3HD2      LEU   3  -6.732   2.529   5.833
   22    H    GLY   4           H        GLY   4  -4.082   5.391   4.532
   23    HA2  GLY   4          2HA       GLY   4  -2.360   6.402   2.481
   24    HA3  GLY   4          1HA       GLY   4  -2.154   6.583   4.219
   25    H    PHE   5           H        PHE   5   0.174   6.158   3.485
   26    HA   PHE   5           HA       PHE   5   0.578   3.388   2.917
   27    HB2  PHE   5          2HB       PHE   5   3.007   3.981   2.790
   28    HB3  PHE   5          1HB       PHE   5   2.018   4.854   1.643
   29    HD1  PHE   5          1HD       PHE   5   4.368   5.060   4.351
   30    HD2  PHE   5          2HD       PHE   5   1.545   7.299   2.084
   31    HE1  PHE   5          1HE       PHE   5   5.439   7.145   5.079
   32    HE2  PHE   5          2HE       PHE   5   2.608   9.385   2.817
   33    HZ   PHE   5           HZ       PHE   5   4.559   9.316   4.313
   34    H    LEU   6           H        LEU   6   2.221   2.250   4.227
   35    HA   LEU   6           HA       LEU   6   3.124   1.484   6.157
   36    HB2  LEU   6          2HB       LEU   6   1.546   3.534   7.653
   37    HB3  LEU   6          1HB       LEU   6   2.859   2.552   8.308
   38    HG   LEU   6           HG       LEU   6   3.055   4.765   6.277
   39   HD11  LEU   6          1HD1      LEU   6   3.942   4.653   9.164
   40   HD12  LEU   6          2HD1      LEU   6   2.615   5.609   8.503
   41   HD13  LEU   6          3HD1      LEU   6   4.278   5.978   8.051
   42   HD21  LEU   6          1HD2      LEU   6   5.506   4.527   6.513
   43   HD22  LEU   6          2HD2      LEU   6   4.756   3.069   5.860
   44   HD23  LEU   6          3HD2      LEU   6   5.255   3.122   7.550
   45    H    TRP   7           H        TRP   7  -0.002   1.581   5.164
   46    HA   TRP   7           HA       TRP   7  -1.150   0.036   7.324
   47    HB2  TRP   7          2HB       TRP   7  -2.236   1.141   4.748
   48    HB3  TRP   7          1HB       TRP   7  -3.157   0.216   5.899
   49    HD1  TRP   7           HD       TRP   7  -1.104   3.529   5.996
   50    HE1  TRP   7          1HE       TRP   7  -2.360   5.219   7.419
   51    HE3  TRP   7          3HE       TRP   7  -5.033   0.585   7.376
   52    HZ2  TRP   7          2HZ       TRP   7  -4.767   5.304   8.960
   53    HZ3  TRP   7          3HZ       TRP   7  -6.775   1.548   8.820
   54    HH2  TRP   7           HH       TRP   7  -6.641   3.845   9.592
   55    H    LYS   8           H        LYS   8  -1.690  -2.065   6.989
   56    HA   LYS   8           HA       LYS   8  -0.153  -3.492   5.049
   57    HB2  LYS   8          2HB       LYS   8  -0.572  -4.368   7.334
   58    HB3  LYS   8          1HB       LYS   8  -2.278  -4.519   6.946
   59    HG2  LYS   8          2HG       LYS   8  -1.784  -6.171   5.259
   60    HG3  LYS   8          1HG       LYS   8  -0.054  -5.973   5.539
   61    HD2  LYS   8          2HD       LYS   8  -0.342  -6.779   7.839
   62    HD3  LYS   8          1HD       LYS   8  -2.070  -6.975   7.551
   63    HE2  LYS   8          2HE       LYS   8  -0.879  -9.108   7.355
   64    HE3  LYS   8          1HE       LYS   8  -1.620  -8.635   5.830
   65    HZ1  LYS   8          1HZ       LYS   8   1.252  -8.284   6.522
   66    HZ2  LYS   8          2HZ       LYS   8   0.532  -7.905   5.033
   67    HZ3  LYS   8          3HZ       LYS   8   0.623  -9.505   5.547
   68    H    CYS   9           H        CYS   9  -0.819  -4.376   3.134
   69    HA   CYS   9           HA       CYS   9  -3.276  -3.294   2.077
   70    HB2  CYS   9          2HB       CYS   9  -2.515  -4.084  -0.054
   71    HB3  CYS   9          1HB       CYS   9  -1.122  -3.398   0.778
   72    H    ASN  10           H        ASN  10  -4.874  -4.618   1.003
   73    HA   ASN  10           HA       ASN  10  -4.922  -7.432   1.763
   74    HB2  ASN  10          2HB       ASN  10  -6.502  -6.219   3.266
   75    HB3  ASN  10          1HB       ASN  10  -7.279  -5.498   1.869
   76   HD21  ASN  10          1HD2      ASN  10  -8.370  -7.237   4.035
   77   HD22  ASN  10          2HD2      ASN  10  -9.105  -8.556   3.207
   78    HA   PRO  11           HA       PRO  11  -4.999  -7.346  -2.722
   79    HB2  PRO  11          2HB       PRO  11  -5.734 -10.190  -2.399
   80    HB3  PRO  11          1HB       PRO  11  -4.399  -9.468  -3.301
   81    HG2  PRO  11          2HG       PRO  11  -3.965 -10.745  -1.008
   82    HG3  PRO  11          1HG       PRO  11  -3.057  -9.284  -1.425
   83    HD2  PRO  11          2HD       PRO  11  -5.334  -9.618   0.478
   84    HD3  PRO  11          1HD       PRO  11  -3.871  -8.613   0.605
   85    H    SER  12           H        SER  12  -7.630  -8.591  -0.750
   86    HA   SER  12           HA       SER  12  -9.416  -8.742  -3.014
   87    HB2  SER  12          2HB       SER  12  -9.636  -9.528  -0.140
   88    HB3  SER  12          1HB       SER  12 -10.820  -9.829  -1.413
   89    HG   SER  12           HG       SER  12  -8.844 -10.781  -2.501
   90    H    ASN  13           H        ASN  13  -8.424  -6.493  -0.782
   91    HA   ASN  13           HA       ASN  13 -10.699  -4.827  -1.145
   92    HB2  ASN  13          2HB       ASN  13 -11.413  -6.391   0.715
   93    HB3  ASN  13          1HB       ASN  13 -10.117  -5.719   1.689
   94   HD21  ASN  13          1HD2      ASN  13 -10.303  -3.594   2.462
   95   HD22  ASN  13          2HD2      ASN  13 -11.829  -2.764   2.470
   96    H    ASP  14           H        ASP  14  -8.694  -4.090  -2.055
   97    HA   ASP  14           HA       ASP  14  -6.838  -2.927  -0.169
   98    HB2  ASP  14          2HB       ASP  14  -6.010  -4.212  -2.060
   99    HB3  ASP  14          1HB       ASP  14  -6.753  -3.081  -3.177
  100    H    LYS  15           H        LYS  15  -7.162  -0.996   0.399
  101    HA   LYS  15           HA       LYS  15  -8.803   0.697  -1.272
  102    HB2  LYS  15          2HB       LYS  15  -9.135  -0.340   1.278
  103    HB3  LYS  15          1HB       LYS  15  -8.833   1.393   1.498
  104    HG2  LYS  15          2HG       LYS  15 -10.996   0.069  -0.139
  105    HG3  LYS  15          1HG       LYS  15 -11.198   0.973   1.365
  106    HD2  LYS  15          2HD       LYS  15 -10.281   2.962   0.220
  107    HD3  LYS  15          1HD       LYS  15 -10.251   2.031  -1.271
  108    HE2  LYS  15          2HE       LYS  15 -12.265   3.419  -1.185
  109    HE3  LYS  15          1HE       LYS  15 -12.677   1.707  -1.139
  110    HZ1  LYS  15          1HZ       LYS  15 -13.955   3.019   0.466
  111    HZ2  LYS  15          2HZ       LYS  15 -12.537   3.472   1.252
  112    HZ3  LYS  15          3HZ       LYS  15 -13.010   1.864   1.231
  113    H    CYS  16           H        CYS  16  -5.819   0.266  -1.025
  114    HA   CYS  16           HA       CYS  16  -4.910   2.581   0.377
  115    HB2  CYS  16          2HB       CYS  16  -3.441   0.577  -1.349
  116    HB3  CYS  16          1HB       CYS  16  -2.661   1.871  -0.438
  117    H    CYS  17           H        CYS  17  -3.745   4.338  -0.642
  118    HA   CYS  17           HA       CYS  17  -5.245   5.396  -2.792
  119    HB2  CYS  17          2HB       CYS  17  -2.672   6.446  -1.658
  120    HB3  CYS  17          1HB       CYS  17  -3.839   7.346  -2.602
  121    H    ARG  18           H        ARG  18  -4.768   3.680  -4.377
  122    HA   ARG  18           HA       ARG  18  -2.224   3.678  -5.588
  123    HB2  ARG  18          2HB       ARG  18  -3.346   2.198  -7.331
  124    HB3  ARG  18          1HB       ARG  18  -3.336   1.615  -5.682
  125    HG2  ARG  18          2HG       ARG  18  -5.465   1.095  -6.530
  126    HG3  ARG  18          1HG       ARG  18  -5.712   2.492  -5.501
  127    HD2  ARG  18          2HD       ARG  18  -5.741   3.937  -7.504
  128    HD3  ARG  18          1HD       ARG  18  -5.527   2.512  -8.521
  129    HE   ARG  18           HE       ARG  18  -7.745   2.215  -6.792
  130   HH11  ARG  18          1HH1      ARG  18  -6.836   3.855  -9.809
  131   HH12  ARG  18          2HH1      ARG  18  -8.421   3.909 -10.405
  132   HH21  ARG  18          1HH2      ARG  18  -9.944   2.332  -7.634
  133   HH22  ARG  18          2HH2      ARG  18 -10.214   3.013  -9.152
  134    HA   PRO  19           HA       PRO  19  -1.425   3.149  -7.572
  135    HB2  PRO  19          2HB       PRO  19   0.089   3.991  -9.558
  136    HB3  PRO  19          1HB       PRO  19  -1.566   3.404  -9.830
  137    HG2  PRO  19          2HG       PRO  19  -0.581   6.225  -9.745
  138    HG3  PRO  19          1HG       PRO  19  -1.707   5.474 -10.887
  139    HD2  PRO  19          2HD       PRO  19  -2.434   6.945  -8.632
  140    HD3  PRO  19          1HD       PRO  19  -3.490   5.819  -9.505
  141    H    ASN  20           H        ASN  20  -1.298   6.232  -6.712
  142    HA   ASN  20           HA       ASN  20   1.351   7.089  -6.412
  143    HB2  ASN  20          2HB       ASN  20  -0.697   8.427  -5.812
  144    HB3  ASN  20          1HB       ASN  20  -0.824   7.483  -4.335
  145   HD21  ASN  20          1HD2      ASN  20  -0.561   9.221  -3.012
  146   HD22  ASN  20          2HD2      ASN  20   0.924  10.089  -2.850
  147    H    LEU  21           H        LEU  21  -0.588   5.183  -4.119
  148    HA   LEU  21           HA       LEU  21   1.860   4.096  -2.913
  149    HB2  LEU  21          2HB       LEU  21  -0.910   4.068  -1.809
  150    HB3  LEU  21          1HB       LEU  21   0.586   3.748  -1.002
  151    HG   LEU  21           HG       LEU  21  -0.275   6.500  -1.908
  152   HD11  LEU  21          1HD1      LEU  21  -0.126   5.329   0.853
  153   HD12  LEU  21          2HD1      LEU  21  -1.598   5.689  -0.039
  154   HD13  LEU  21          3HD1      LEU  21  -0.521   6.998   0.452
  155   HD21  LEU  21          1HD2      LEU  21   1.659   7.285  -0.597
  156   HD22  LEU  21          2HD2      LEU  21   2.128   6.280  -1.965
  157   HD23  LEU  21          3HD2      LEU  21   2.147   5.606  -0.336
  158    H    VAL  22           H        VAL  22   1.771   1.937  -2.596
  159    HA   VAL  22           HA       VAL  22  -0.359   0.337  -3.692
  160    HB   VAL  22           HB       VAL  22   0.953   0.934  -5.679
  161   HG11  VAL  22          1HG1      VAL  22   3.217  -0.004  -6.057
  162   HG12  VAL  22          2HG1      VAL  22   3.247  -0.515  -4.370
  163   HG13  VAL  22          3HG1      VAL  22   3.163   1.200  -4.769
  164   HG21  VAL  22          1HG2      VAL  22   1.275  -1.334  -6.620
  165   HG22  VAL  22          2HG2      VAL  22  -0.245  -1.157  -5.744
  166   HG23  VAL  22          3HG2      VAL  22   1.112  -1.995  -4.994
  167    H    CYS  23           H        CYS  23   0.027  -1.914  -3.254
  168    HA   CYS  23           HA       CYS  23   1.172  -2.270  -0.682
  169    HB2  CYS  23          2HB       CYS  23  -0.746  -3.616  -1.363
  170    HB3  CYS  23          1HB       CYS  23   0.247  -4.397  -2.603
  171    H    SER  24           H        SER  24   3.048  -2.661  -0.177
  172    HA   SER  24           HA       SER  24   5.040  -3.437  -2.135
  173    HB2  SER  24          2HB       SER  24   5.573  -1.560  -0.652
  174    HB3  SER  24          1HB       SER  24   5.206  -2.558   0.754
  175    HG   SER  24           HG       SER  24   7.480  -2.328  -0.648
  176    H    ARG  25           H        ARG  25   5.543  -5.528  -2.273
  177    HA   ARG  25           HA       ARG  25   4.514  -7.367  -0.298
  178    HB2  ARG  25          2HB       ARG  25   4.448  -7.817  -2.763
  179    HB3  ARG  25          1HB       ARG  25   6.198  -7.912  -2.748
  180    HG2  ARG  25          2HG       ARG  25   6.158  -9.898  -1.438
  181    HG3  ARG  25          1HG       ARG  25   4.425  -9.727  -1.130
  182    HD2  ARG  25          2HD       ARG  25   5.717 -10.183  -3.811
  183    HD3  ARG  25          1HD       ARG  25   4.828 -11.386  -2.869
  184    HE   ARG  25           HE       ARG  25   2.915  -9.718  -3.059
  185   HH11  ARG  25          1HH1      ARG  25   5.264 -10.276  -5.605
  186   HH12  ARG  25          2HH1      ARG  25   4.286  -9.692  -6.860
  187   HH21  ARG  25          1HH2      ARG  25   1.539  -8.938  -4.725
  188   HH22  ARG  25          2HH2      ARG  25   2.052  -8.950  -6.345
  189    H    LYS  26           H        LYS  26   7.222  -5.552  -0.855
  190    HA   LYS  26           HA       LYS  26   9.184  -7.151   0.491
  191    HB2  LYS  26          2HB       LYS  26   9.575  -5.277  -1.226
  192    HB3  LYS  26          1HB       LYS  26   9.133  -4.157   0.030
  193    HG2  LYS  26          2HG       LYS  26  11.525  -6.010   0.146
  194    HG3  LYS  26          1HG       LYS  26  11.571  -4.316  -0.323
  195    HD2  LYS  26          2HD       LYS  26  10.662  -3.759   1.949
  196    HD3  LYS  26          1HD       LYS  26  10.856  -5.456   2.376
  197    HE2  LYS  26          2HE       LYS  26  12.767  -4.243   3.181
  198    HE3  LYS  26          1HE       LYS  26  13.269  -5.261   1.835
  199    HZ1  LYS  26          1HZ       LYS  26  14.212  -3.035   1.693
  200    HZ2  LYS  26          2HZ       LYS  26  12.691  -2.354   1.673
  201    HZ3  LYS  26          3HZ       LYS  26  13.190  -3.308   0.383
  202    H    ASP  27           H        ASP  27   7.485  -4.101   1.264
  203    HA   ASP  27           HA       ASP  27   8.149  -4.194   4.030
  204    HB2  ASP  27          2HB       ASP  27   6.432  -2.408   2.348
  205    HB3  ASP  27          1HB       ASP  27   6.567  -2.218   4.084
  206    H    LYS  28           H        LYS  28   5.463  -5.316   2.127
  207    HA   LYS  28           HA       LYS  28   3.687  -6.404   2.494
  208    HB2  LYS  28          2HB       LYS  28   4.478  -6.554   5.408
  209    HB3  LYS  28          1HB       LYS  28   3.125  -7.350   4.595
  210    HG2  LYS  28          2HG       LYS  28   6.006  -7.800   3.871
  211    HG3  LYS  28          1HG       LYS  28   5.064  -8.862   4.919
  212    HD2  LYS  28          2HD       LYS  28   3.451  -9.199   3.064
  213    HD3  LYS  28          1HD       LYS  28   4.467  -8.196   2.034
  214    HE2  LYS  28          2HE       LYS  28   4.884 -10.516   1.595
  215    HE3  LYS  28          1HE       LYS  28   6.306  -9.773   2.317
  216    HZ1  LYS  28          1HZ       LYS  28   5.700 -10.784   4.441
  217    HZ2  LYS  28          2HZ       LYS  28   5.837 -11.945   3.223
  218    HZ3  LYS  28          3HZ       LYS  28   4.312 -11.441   3.732
  219    H    TRP  29           H        TRP  29   4.033  -3.466   3.011
  220    HA   TRP  29           HA       TRP  29   1.228  -3.096   3.687
  221    HB2  TRP  29          2HB       TRP  29   1.643  -1.122   5.010
  222    HB3  TRP  29          1HB       TRP  29   2.542  -2.450   5.701
  223    HD1  TRP  29           HD       TRP  29   3.522   0.301   3.081
  224    HE1  TRP  29          1HE       TRP  29   5.663   1.437   3.883
  225    HE3  TRP  29          3HE       TRP  29   4.229  -2.326   7.393
  226    HZ2  TRP  29          2HZ       TRP  29   7.433   1.256   6.088
  227    HZ3  TRP  29          3HZ       TRP  29   6.156  -1.770   8.806
  228    HH2  TRP  29           HH       TRP  29   7.729  -0.013   8.159
  229    H    CYS  30           H        CYS  30   0.389  -0.985   2.886
  230    HA   CYS  30           HA       CYS  30   1.192  -0.566   0.235
  231    HB2  CYS  30          2HB       CYS  30  -0.625   0.925   2.129
  232    HB3  CYS  30          1HB       CYS  30  -0.494   1.212   0.396
  233    H    LYS  31           H        LYS  31   2.735   0.707  -0.425
  234    HA   LYS  31           HA       LYS  31   3.982   2.558   1.487
  235    HB2  LYS  31          2HB       LYS  31   5.129   0.195   0.901
  236    HB3  LYS  31          1HB       LYS  31   5.469   1.053  -0.598
  237    HG2  LYS  31          2HG       LYS  31   6.680   2.772   0.665
  238    HG3  LYS  31          1HG       LYS  31   6.395   1.808   2.126
  239    HD2  LYS  31          2HD       LYS  31   7.609  -0.057   1.131
  240    HD3  LYS  31          1HD       LYS  31   7.904   0.909  -0.314
  241    HE2  LYS  31          2HE       LYS  31   9.876   0.943   1.085
  242    HE3  LYS  31          1HE       LYS  31   9.146   2.543   1.068
  243    HZ1  LYS  31          1HZ       LYS  31   8.207   2.107   3.266
  244    HZ2  LYS  31          2HZ       LYS  31   9.866   1.841   3.294
  245    HZ3  LYS  31          3HZ       LYS  31   8.828   0.533   3.251
  246    H    TYR  32           H        TYR  32   5.591   3.814  -0.132
  247    HA   TYR  32           HA       TYR  32   3.892   5.026  -2.123
  248    HB2  TYR  32          2HB       TYR  32   5.577   6.315  -0.742
  249    HB3  TYR  32          1HB       TYR  32   6.840   5.457  -1.590
  250    HD1  TYR  32          1HD       TYR  32   3.878   7.602  -2.322
  251    HD2  TYR  32          2HD       TYR  32   7.773   6.394  -3.468
  252    HE1  TYR  32          1HE       TYR  32   3.848   9.247  -4.123
  253    HE2  TYR  32          2HE       TYR  32   7.768   8.031  -5.270
  254    HH   TYR  32           HH       TYR  32   6.085   9.152  -6.630
  255    H    GLN  33           H        GLN  33   4.348   4.941  -4.407
  256    HA   GLN  33           HA       GLN  33   5.537   2.443  -5.194
  257    HB2  GLN  33          2HB       GLN  33   3.514   3.577  -6.259
  258    HB3  GLN  33          1HB       GLN  33   4.710   4.645  -7.011
  259    HG2  GLN  33          2HG       GLN  33   5.813   2.611  -7.967
  260    HG3  GLN  33          1HG       GLN  33   4.450   1.666  -7.387
  261   HE21  GLN  33          1HE2      GLN  33   2.512   3.844  -8.074
  262   HE22  GLN  33          2HE2      GLN  33   2.422   3.807  -9.788
  263    H    ILE  34           H        ILE  34   7.360   3.582  -4.025
  264    HA   ILE  34           HA       ILE  34   9.528   4.347  -3.940
  265    HB   ILE  34           HB       ILE  34   9.585   2.552  -6.340
  266   HG12  ILE  34          2HG1      ILE  34  10.009   1.959  -3.400
  267   HG13  ILE  34          1HG1      ILE  34   8.582   1.545  -4.340
  268   HG21  ILE  34          1HG2      ILE  34  11.840   3.355  -4.455
  269   HG22  ILE  34          2HG2      ILE  34  11.687   3.853  -6.138
  270   HG23  ILE  34          3HG2      ILE  34  11.977   2.158  -5.747
  271   HD11  ILE  34          1HD1      ILE  34   9.919   0.034  -5.706
  272   HD12  ILE  34          2HD1      ILE  34  10.029  -0.383  -3.994
  273   HD13  ILE  34          3HD1      ILE  34  11.358   0.465  -4.783
  Start of MODEL    4
    1    H1   ASP   1          1HT       ASP   1 -12.074   8.625   2.095
    2    H2   ASP   1          2HT       ASP   1 -11.566  10.161   2.570
    3    H3   ASP   1          3HT       ASP   1 -11.008   8.763   3.379
    4    HA   ASP   1           HA       ASP   1 -10.469   9.420   0.554
    5    HB2  ASP   1          2HB       ASP   1  -8.653   9.460   2.974
    6    HB3  ASP   1          1HB       ASP   1  -8.103   9.569   1.314
    7    H    CYS   2           H        CYS   2  -8.478   8.021  -0.046
    8    HA   CYS   2           HA       CYS   2  -9.055   5.282   0.594
    9    HB2  CYS   2          2HB       CYS   2  -6.945   5.054  -0.927
   10    HB3  CYS   2          1HB       CYS   2  -8.499   5.436  -1.635
   11    H    LEU   3           H        LEU   3  -7.027   3.908   0.981
   12    HA   LEU   3           HA       LEU   3  -6.059   4.696   3.513
   13    HB2  LEU   3          2HB       LEU   3  -5.345   2.365   1.755
   14    HB3  LEU   3          1HB       LEU   3  -4.780   2.624   3.378
   15    HG   LEU   3           HG       LEU   3  -7.671   2.257   2.634
   16   HD11  LEU   3          1HD1      LEU   3  -7.386   0.010   3.560
   17   HD12  LEU   3          2HD1      LEU   3  -5.663   0.319   3.772
   18   HD13  LEU   3          3HD1      LEU   3  -6.357   0.263   2.152
   19   HD21  LEU   3          1HD2      LEU   3  -7.307   3.506   4.723
   20   HD22  LEU   3          2HD2      LEU   3  -6.262   2.213   5.308
   21   HD23  LEU   3          3HD2      LEU   3  -7.975   1.906   5.029
   22    H    GLY   4           H        GLY   4  -4.201   5.435   4.105
   23    HA2  GLY   4          2HA       GLY   4  -2.360   6.506   2.179
   24    HA3  GLY   4          1HA       GLY   4  -2.277   6.671   3.932
   25    H    PHE   5           H        PHE   5   0.109   6.209   3.421
   26    HA   PHE   5           HA       PHE   5   0.544   3.468   2.722
   27    HB2  PHE   5          2HB       PHE   5   2.978   4.112   2.772
   28    HB3  PHE   5          1HB       PHE   5   2.034   4.989   1.584
   29    HD1  PHE   5          1HD       PHE   5   1.425   7.396   2.071
   30    HD2  PHE   5          2HD       PHE   5   4.199   5.211   4.444
   31    HE1  PHE   5          1HE       PHE   5   2.317   9.490   2.957
   32    HE2  PHE   5          2HE       PHE   5   5.085   7.318   5.341
   33    HZ   PHE   5           HZ       PHE   5   4.144   9.463   4.594
   34    H    LEU   6           H        LEU   6   2.046   2.257   4.057
   35    HA   LEU   6           HA       LEU   6   2.825   1.346   5.962
   36    HB2  LEU   6          2HB       LEU   6   1.583   3.584   7.498
   37    HB3  LEU   6          1HB       LEU   6   2.810   2.460   8.084
   38    HG   LEU   6           HG       LEU   6   3.109   4.647   6.060
   39   HD11  LEU   6          1HD1      LEU   6   4.277   4.315   8.836
   40   HD12  LEU   6          2HD1      LEU   6   3.008   5.445   8.369
   41   HD13  LEU   6          3HD1      LEU   6   4.643   5.645   7.737
   42   HD21  LEU   6          1HD2      LEU   6   4.523   2.792   5.414
   43   HD22  LEU   6          2HD2      LEU   6   5.148   2.650   7.055
   44   HD23  LEU   6          3HD2      LEU   6   5.534   4.071   6.089
   45    H    TRP   7           H        TRP   7  -0.303   1.803   5.060
   46    HA   TRP   7           HA       TRP   7  -1.387   0.379   7.274
   47    HB2  TRP   7          2HB       TRP   7  -2.621   1.651   4.853
   48    HB3  TRP   7          1HB       TRP   7  -3.517   0.743   6.058
   49    HD1  TRP   7           HD       TRP   7  -1.579   3.961   5.623
   50    HE1  TRP   7          1HE       TRP   7  -2.151   5.600   7.501
   51    HE3  TRP   7          3HE       TRP   7  -4.442   0.870   8.437
   52    HZ2  TRP   7          2HZ       TRP   7  -3.675   5.562   9.924
   53    HZ3  TRP   7          3HZ       TRP   7  -5.426   1.725  10.525
   54    HH2  TRP   7           HH       TRP   7  -5.044   4.028  11.246
   55    H    LYS   8           H        LYS   8  -2.261  -1.597   7.027
   56    HA   LYS   8           HA       LYS   8  -0.903  -3.442   5.460
   57    HB2  LYS   8          2HB       LYS   8  -1.859  -4.087   7.494
   58    HB3  LYS   8          1HB       LYS   8  -3.510  -3.657   7.005
   59    HG2  LYS   8          2HG       LYS   8  -3.276  -6.023   7.041
   60    HG3  LYS   8          1HG       LYS   8  -3.289  -5.534   5.342
   61    HD2  LYS   8          2HD       LYS   8  -1.507  -7.106   5.558
   62    HD3  LYS   8          1HD       LYS   8  -0.839  -5.462   5.465
   63    HE2  LYS   8          2HE       LYS   8  -0.448  -5.394   7.831
   64    HE3  LYS   8          1HE       LYS   8  -1.223  -6.965   8.036
   65    HZ1  LYS   8          1HZ       LYS   8   0.561  -7.926   6.675
   66    HZ2  LYS   8          2HZ       LYS   8   1.138  -7.184   8.064
   67    HZ3  LYS   8          3HZ       LYS   8   1.306  -6.409   6.585
   68    H    CYS   9           H        CYS   9  -1.151  -4.064   3.354
   69    HA   CYS   9           HA       CYS   9  -3.495  -3.096   2.022
   70    HB2  CYS   9          2HB       CYS   9  -2.321  -3.768  -0.018
   71    HB3  CYS   9          1HB       CYS   9  -1.447  -2.600   0.988
   72    H    ASN  10           H        ASN  10  -4.799  -4.388   0.806
   73    HA   ASN  10           HA       ASN  10  -4.743  -7.236   1.463
   74    HB2  ASN  10          2HB       ASN  10  -6.403  -5.994   2.867
   75    HB3  ASN  10          1HB       ASN  10  -7.155  -5.391   1.401
   76   HD21  ASN  10          1HD2      ASN  10  -8.300  -6.931   3.541
   77   HD22  ASN  10          2HD2      ASN  10  -8.922  -8.383   2.857
   78    HA   PRO  11           HA       PRO  11  -4.758  -7.103  -3.038
   79    HB2  PRO  11          2HB       PRO  11  -5.243  -9.784  -3.435
   80    HB3  PRO  11          1HB       PRO  11  -3.647  -9.094  -3.128
   81    HG2  PRO  11          2HG       PRO  11  -5.537 -10.422  -1.226
   82    HG3  PRO  11          1HG       PRO  11  -3.776 -10.581  -1.349
   83    HD2  PRO  11          2HD       PRO  11  -4.920  -9.068   0.541
   84    HD3  PRO  11          1HD       PRO  11  -3.394  -8.584  -0.225
   85    H    SER  12           H        SER  12  -7.342  -8.543  -1.125
   86    HA   SER  12           HA       SER  12  -9.143  -8.643  -3.374
   87    HB2  SER  12          2HB       SER  12  -9.362  -9.506  -0.520
   88    HB3  SER  12          1HB       SER  12 -10.496  -9.839  -1.825
   89    HG   SER  12           HG       SER  12  -8.654 -11.401  -1.162
   90    H    ASN  13           H        ASN  13  -8.186  -6.430  -1.171
   91    HA   ASN  13           HA       ASN  13 -10.643  -4.923  -1.232
   92    HB2  ASN  13          2HB       ASN  13 -10.807  -6.494   0.816
   93    HB3  ASN  13          1HB       ASN  13  -9.471  -5.572   1.492
   94   HD21  ASN  13          1HD2      ASN  13 -12.815  -5.655   0.836
   95   HD22  ASN  13          2HD2      ASN  13 -13.226  -4.133   1.533
   96    H    ASP  14           H        ASP  14  -8.820  -4.169  -2.519
   97    HA   ASP  14           HA       ASP  14  -6.644  -2.880  -1.145
   98    HB2  ASP  14          2HB       ASP  14  -6.438  -4.155  -3.231
   99    HB3  ASP  14          1HB       ASP  14  -7.400  -2.943  -4.063
  100    H    LYS  15           H        LYS  15  -6.974  -0.977  -0.361
  101    HA   LYS  15           HA       LYS  15  -8.994   0.775  -1.612
  102    HB2  LYS  15          2HB       LYS  15  -8.850  -0.505   0.875
  103    HB3  LYS  15          1HB       LYS  15  -8.779   1.241   1.140
  104    HG2  LYS  15          2HG       LYS  15 -10.844   1.518  -0.047
  105    HG3  LYS  15          1HG       LYS  15 -10.863  -0.205  -0.460
  106    HD2  LYS  15          2HD       LYS  15 -12.256  -0.086   1.407
  107    HD3  LYS  15          1HD       LYS  15 -10.638  -0.601   1.939
  108    HE2  LYS  15          2HE       LYS  15 -10.102   1.572   2.768
  109    HE3  LYS  15          1HE       LYS  15 -11.585   2.242   2.093
  110    HZ1  LYS  15          1HZ       LYS  15 -11.792   1.908   4.431
  111    HZ2  LYS  15          2HZ       LYS  15 -11.392   0.276   4.289
  112    HZ3  LYS  15          3HZ       LYS  15 -12.841   0.855   3.636
  113    H    CYS  16           H        CYS  16  -6.004   0.440  -1.393
  114    HA   CYS  16           HA       CYS  16  -5.146   2.846  -0.064
  115    HB2  CYS  16          2HB       CYS  16  -3.566   0.901  -1.733
  116    HB3  CYS  16          1HB       CYS  16  -2.866   2.274  -0.878
  117    H    CYS  17           H        CYS  17  -4.028   4.614  -1.027
  118    HA   CYS  17           HA       CYS  17  -5.419   5.605  -3.265
  119    HB2  CYS  17          2HB       CYS  17  -3.016   6.699  -1.842
  120    HB3  CYS  17          1HB       CYS  17  -3.946   7.579  -3.035
  121    H    ARG  18           H        ARG  18  -4.837   3.925  -4.893
  122    HA   ARG  18           HA       ARG  18  -2.244   3.943  -5.963
  123    HB2  ARG  18          2HB       ARG  18  -4.903   3.091  -7.100
  124    HB3  ARG  18          1HB       ARG  18  -3.356   2.784  -7.858
  125    HG2  ARG  18          2HG       ARG  18  -2.705   1.321  -6.082
  126    HG3  ARG  18          1HG       ARG  18  -4.149   1.747  -5.148
  127    HD2  ARG  18          2HD       ARG  18  -5.549   0.901  -6.780
  128    HD3  ARG  18          1HD       ARG  18  -4.227   0.549  -7.898
  129    HE   ARG  18           HE       ARG  18  -4.518  -0.803  -5.284
  130   HH11  ARG  18          1HH1      ARG  18  -4.066  -1.032  -8.826
  131   HH12  ARG  18          2HH1      ARG  18  -3.906  -2.717  -8.831
  132   HH21  ARG  18          1HH2      ARG  18  -4.272  -3.113  -5.330
  133   HH22  ARG  18          2HH2      ARG  18  -4.016  -3.960  -6.791
  134    HA   PRO  19           HA       PRO  19  -1.349   3.778  -7.865
  135    HB2  PRO  19          2HB       PRO  19   0.047   4.729  -9.841
  136    HB3  PRO  19          1HB       PRO  19  -1.630   4.157 -10.064
  137    HG2  PRO  19          2HG       PRO  19  -0.606   6.963  -9.947
  138    HG3  PRO  19          1HG       PRO  19  -1.851   6.276 -11.004
  139    HD2  PRO  19          2HD       PRO  19  -2.259   7.634  -8.560
  140    HD3  PRO  19          1HD       PRO  19  -3.473   6.722  -9.479
  141    H    ASN  20           H        ASN  20  -1.331   6.588  -6.620
  142    HA   ASN  20           HA       ASN  20   1.416   7.422  -6.488
  143    HB2  ASN  20          2HB       ASN  20  -0.586   8.859  -5.781
  144    HB3  ASN  20          1HB       ASN  20  -0.569   7.958  -4.266
  145   HD21  ASN  20          1HD2      ASN  20   0.009   9.674  -2.965
  146   HD22  ASN  20          2HD2      ASN  20   1.555  10.432  -3.054
  147    H    LEU  21           H        LEU  21  -0.595   5.425  -4.352
  148    HA   LEU  21           HA       LEU  21   1.827   4.349  -3.061
  149    HB2  LEU  21          2HB       LEU  21  -1.019   4.251  -2.143
  150    HB3  LEU  21          1HB       LEU  21   0.416   3.832  -1.259
  151    HG   LEU  21           HG       LEU  21  -0.306   6.651  -2.065
  152   HD11  LEU  21          1HD1      LEU  21  -0.733   7.023   0.288
  153   HD12  LEU  21          2HD1      LEU  21  -0.407   5.324   0.624
  154   HD13  LEU  21          3HD1      LEU  21  -1.799   5.774  -0.357
  155   HD21  LEU  21          1HD2      LEU  21   1.536   7.282  -0.538
  156   HD22  LEU  21          2HD2      LEU  21   2.078   6.381  -1.948
  157   HD23  LEU  21          3HD2      LEU  21   1.960   5.573  -0.387
  158    H    VAL  22           H        VAL  22   1.708   2.142  -2.650
  159    HA   VAL  22           HA       VAL  22  -0.214   0.531  -4.092
  160    HB   VAL  22           HB       VAL  22   1.431   1.110  -5.783
  161   HG11  VAL  22          1HG1      VAL  22   3.424   1.421  -4.464
  162   HG12  VAL  22          2HG1      VAL  22   3.747   0.203  -5.700
  163   HG13  VAL  22          3HG1      VAL  22   3.447  -0.287  -4.032
  164   HG21  VAL  22          1HG2      VAL  22   1.971  -1.172  -6.611
  165   HG22  VAL  22          2HG2      VAL  22   0.306  -1.011  -6.050
  166   HG23  VAL  22          3HG2      VAL  22   1.503  -1.814  -5.035
  167    H    CYS  23           H        CYS  23  -0.135  -1.569  -3.506
  168    HA   CYS  23           HA       CYS  23   0.703  -2.185  -0.855
  169    HB2  CYS  23          2HB       CYS  23  -1.287  -3.201  -1.704
  170    HB3  CYS  23          1HB       CYS  23  -0.411  -3.884  -3.072
  171    H    SER  24           H        SER  24   2.511  -2.893  -0.258
  172    HA   SER  24           HA       SER  24   4.492  -3.737  -2.194
  173    HB2  SER  24          2HB       SER  24   5.143  -2.050  -0.510
  174    HB3  SER  24          1HB       SER  24   4.723  -3.186   0.770
  175    HG   SER  24           HG       SER  24   6.987  -3.159   0.343
  176    H    ARG  25           H        ARG  25   5.027  -5.777  -2.413
  177    HA   ARG  25           HA       ARG  25   3.643  -7.883  -1.052
  178    HB2  ARG  25          2HB       ARG  25   4.272  -8.145  -3.363
  179    HB3  ARG  25          1HB       ARG  25   5.956  -7.833  -2.991
  180    HG2  ARG  25          2HG       ARG  25   6.063  -9.908  -1.730
  181    HG3  ARG  25          1HG       ARG  25   4.371 -10.229  -2.104
  182    HD2  ARG  25          2HD       ARG  25   4.885 -10.243  -4.465
  183    HD3  ARG  25          1HD       ARG  25   6.582  -9.893  -4.116
  184    HE   ARG  25           HE       ARG  25   5.573 -12.210  -2.801
  185   HH11  ARG  25          1HH1      ARG  25   7.010 -11.044  -5.821
  186   HH12  ARG  25          2HH1      ARG  25   7.647 -12.564  -6.254
  187   HH21  ARG  25          1HH2      ARG  25   6.426 -14.259  -3.404
  188   HH22  ARG  25          2HH2      ARG  25   7.267 -14.446  -4.883
  189    H    LYS  26           H        LYS  26   6.748  -6.403  -0.992
  190    HA   LYS  26           HA       LYS  26   8.133  -8.148   0.729
  191    HB2  LYS  26          2HB       LYS  26   9.199  -6.473  -0.732
  192    HB3  LYS  26          1HB       LYS  26   8.466  -5.206   0.203
  193    HG2  LYS  26          2HG       LYS  26   9.812  -5.616   2.087
  194    HG3  LYS  26          1HG       LYS  26  10.372  -7.160   1.448
  195    HD2  LYS  26          2HD       LYS  26  12.110  -5.448   1.241
  196    HD3  LYS  26          1HD       LYS  26  11.572  -5.994  -0.339
  197    HE2  LYS  26          2HE       LYS  26  11.884  -3.586  -0.341
  198    HE3  LYS  26          1HE       LYS  26  10.180  -3.967  -0.541
  199    HZ1  LYS  26          1HZ       LYS  26  10.781  -2.128   1.001
  200    HZ2  LYS  26          2HZ       LYS  26  11.318  -3.264   2.118
  201    HZ3  LYS  26          3HZ       LYS  26   9.700  -3.229   1.611
  202    H    ASP  27           H        ASP  27   6.716  -5.003   1.284
  203    HA   ASP  27           HA       ASP  27   7.071  -5.201   4.099
  204    HB2  ASP  27          2HB       ASP  27   5.762  -3.060   2.450
  205    HB3  ASP  27          1HB       ASP  27   6.241  -2.957   4.135
  206    H    LYS  28           H        LYS  28   4.394  -5.685   1.869
  207    HA   LYS  28           HA       LYS  28   2.402  -6.366   2.055
  208    HB2  LYS  28          2HB       LYS  28   3.135  -7.137   4.880
  209    HB3  LYS  28          1HB       LYS  28   1.688  -7.603   3.966
  210    HG2  LYS  28          2HG       LYS  28   2.946  -8.791   2.361
  211    HG3  LYS  28          1HG       LYS  28   4.463  -8.176   3.010
  212    HD2  LYS  28          2HD       LYS  28   4.039  -9.417   5.090
  213    HD3  LYS  28          1HD       LYS  28   2.555 -10.058   4.382
  214    HE2  LYS  28          2HE       LYS  28   4.439 -11.633   4.201
  215    HE3  LYS  28          1HE       LYS  28   3.799 -11.146   2.637
  216    HZ1  LYS  28          1HZ       LYS  28   5.658  -9.645   2.337
  217    HZ2  LYS  28          2HZ       LYS  28   6.246 -11.176   2.721
  218    HZ3  LYS  28          3HZ       LYS  28   6.228  -9.974   3.893
  219    H    TRP  29           H        TRP  29   3.223  -3.678   2.923
  220    HA   TRP  29           HA       TRP  29   0.526  -2.926   3.622
  221    HB2  TRP  29          2HB       TRP  29   1.348  -0.978   4.921
  222    HB3  TRP  29          1HB       TRP  29   1.858  -2.483   5.654
  223    HD1  TRP  29           HD       TRP  29   3.446   0.143   3.227
  224    HE1  TRP  29          1HE       TRP  29   5.897   0.488   3.941
  225    HE3  TRP  29          3HE       TRP  29   3.640  -3.177   7.100
  226    HZ2  TRP  29          2HZ       TRP  29   7.659  -0.502   5.887
  227    HZ3  TRP  29          3HZ       TRP  29   5.745  -3.410   8.351
  228    HH2  TRP  29           HH       TRP  29   7.715  -2.094   7.755
  229    H    CYS  30           H        CYS  30   0.068  -0.652   2.786
  230    HA   CYS  30           HA       CYS  30   1.110  -0.454   0.183
  231    HB2  CYS  30          2HB       CYS  30  -0.780   1.199   1.839
  232    HB3  CYS  30          1HB       CYS  30  -0.383   1.539   0.159
  233    H    LYS  31           H        LYS  31   2.601   0.937  -0.559
  234    HA   LYS  31           HA       LYS  31   3.843   2.773   1.335
  235    HB2  LYS  31          2HB       LYS  31   4.993   0.380   1.070
  236    HB3  LYS  31          1HB       LYS  31   5.460   1.043  -0.491
  237    HG2  LYS  31          2HG       LYS  31   6.725   2.775   0.521
  238    HG3  LYS  31          1HG       LYS  31   6.179   2.300   2.135
  239    HD2  LYS  31          2HD       LYS  31   7.304   0.148   1.866
  240    HD3  LYS  31          1HD       LYS  31   7.813   0.607   0.242
  241    HE2  LYS  31          2HE       LYS  31   8.607   1.986   2.810
  242    HE3  LYS  31          1HE       LYS  31   9.622   0.900   1.865
  243    HZ1  LYS  31          1HZ       LYS  31   9.423   2.516   0.008
  244    HZ2  LYS  31          2HZ       LYS  31  10.222   3.107   1.350
  245    HZ3  LYS  31          3HZ       LYS  31   8.647   3.598   1.053
  246    H    TYR  32           H        TYR  32   5.686   3.829  -0.349
  247    HA   TYR  32           HA       TYR  32   3.951   5.241  -2.177
  248    HB2  TYR  32          2HB       TYR  32   6.172   5.967  -0.748
  249    HB3  TYR  32          1HB       TYR  32   6.834   5.684  -2.323
  250    HD1  TYR  32          1HD       TYR  32   4.448   7.754  -0.477
  251    HD2  TYR  32          2HD       TYR  32   6.389   7.127  -4.210
  252    HE1  TYR  32          1HE       TYR  32   3.671   9.936  -1.237
  253    HE2  TYR  32          2HE       TYR  32   5.617   9.320  -4.981
  254    HH   TYR  32           HH       TYR  32   3.718  10.847  -4.435
  255    H    GLN  33           H        GLN  33   3.943   5.078  -4.359
  256    HA   GLN  33           HA       GLN  33   5.472   2.925  -5.509
  257    HB2  GLN  33          2HB       GLN  33   3.151   3.139  -6.105
  258    HB3  GLN  33          1HB       GLN  33   3.444   4.788  -6.666
  259    HG2  GLN  33          2HG       GLN  33   3.213   3.289  -8.574
  260    HG3  GLN  33          1HG       GLN  33   4.859   3.902  -8.474
  261   HE21  GLN  33          1HE2      GLN  33   2.830   1.133  -8.264
  262   HE22  GLN  33          2HE2      GLN  33   4.096  -0.039  -8.196
  263    H    ILE  34           H        ILE  34   7.219   4.096  -4.868
  264    HA   ILE  34           HA       ILE  34   8.328   6.315  -6.240
  265    HB   ILE  34           HB       ILE  34   9.913   3.992  -5.071
  266   HG12  ILE  34          2HG1      ILE  34   9.026   6.583  -3.762
  267   HG13  ILE  34          1HG1      ILE  34   8.378   4.982  -3.429
  268   HG21  ILE  34          1HG2      ILE  34  11.240   5.421  -6.548
  269   HG22  ILE  34          2HG2      ILE  34  11.737   5.635  -4.870
  270   HG23  ILE  34          3HG2      ILE  34  10.725   6.850  -5.651
  271   HD11  ILE  34          1HD1      ILE  34  10.546   4.280  -2.555
  272   HD12  ILE  34          2HD1      ILE  34   9.931   5.692  -1.697
  273   HD13  ILE  34          3HD1      ILE  34  11.204   5.879  -2.903
  Start of MODEL    5
    1    H1   ASP   1          1HT       ASP   1 -12.635   7.650   1.232
    2    H2   ASP   1          2HT       ASP   1 -12.668   7.223  -0.363
    3    H3   ASP   1          3HT       ASP   1 -12.979   8.841   0.069
    4    HA   ASP   1           HA       ASP   1 -10.779   8.591  -0.861
    5    HB2  ASP   1          2HB       ASP   1  -9.410   9.465   0.994
    6    HB3  ASP   1          1HB       ASP   1 -10.981  10.248   0.961
    7    H    CYS   2           H        CYS   2  -8.496   7.886  -0.035
    8    HA   CYS   2           HA       CYS   2  -8.765   5.027   0.436
    9    HB2  CYS   2          2HB       CYS   2  -6.439   5.074  -0.708
   10    HB3  CYS   2          1HB       CYS   2  -7.906   5.105  -1.664
   11    H    LEU   3           H        LEU   3  -6.803   4.015   1.304
   12    HA   LEU   3           HA       LEU   3  -6.209   5.139   3.828
   13    HB2  LEU   3          2HB       LEU   3  -5.163   2.706   2.415
   14    HB3  LEU   3          1HB       LEU   3  -4.866   3.115   4.085
   15    HG   LEU   3           HG       LEU   3  -7.543   2.431   2.876
   16   HD11  LEU   3          1HD1      LEU   3  -7.384   0.409   4.240
   17   HD12  LEU   3          2HD1      LEU   3  -5.773   0.892   4.770
   18   HD13  LEU   3          3HD1      LEU   3  -6.063   0.507   3.074
   19   HD21  LEU   3          1HD2      LEU   3  -6.791   3.042   5.738
   20   HD22  LEU   3          2HD2      LEU   3  -8.358   2.443   5.192
   21   HD23  LEU   3          3HD2      LEU   3  -7.804   4.036   4.689
   22    H    GLY   4           H        GLY   4  -4.057   5.369   4.647
   23    HA2  GLY   4          2HA       GLY   4  -2.330   6.771   2.789
   24    HA3  GLY   4          1HA       GLY   4  -2.175   6.718   4.546
   25    H    PHE   5           H        PHE   5   0.157   6.302   3.809
   26    HA   PHE   5           HA       PHE   5   0.514   3.595   2.929
   27    HB2  PHE   5          2HB       PHE   5   2.994   4.201   3.018
   28    HB3  PHE   5          1HB       PHE   5   2.033   5.053   1.831
   29    HD1  PHE   5          1HD       PHE   5   3.918   5.345   4.949
   30    HD2  PHE   5          2HD       PHE   5   1.692   7.439   1.997
   31    HE1  PHE   5          1HE       PHE   5   4.804   7.471   5.794
   32    HE2  PHE   5          2HE       PHE   5   2.581   9.568   2.837
   33    HZ   PHE   5           HZ       PHE   5   4.138   9.584   4.740
   34    H    LEU   6           H        LEU   6   2.282   2.371   4.146
   35    HA   LEU   6           HA       LEU   6   3.111   1.349   5.994
   36    HB2  LEU   6          2HB       LEU   6   1.574   3.240   7.703
   37    HB3  LEU   6          1HB       LEU   6   2.917   2.216   8.207
   38    HG   LEU   6           HG       LEU   6   2.972   4.650   6.476
   39   HD11  LEU   6          1HD1      LEU   6   4.038   4.131   9.243
   40   HD12  LEU   6          2HD1      LEU   6   2.662   5.144   8.798
   41   HD13  LEU   6          3HD1      LEU   6   4.292   5.611   8.316
   42   HD21  LEU   6          1HD2      LEU   6   5.453   4.425   6.511
   43   HD22  LEU   6          2HD2      LEU   6   4.665   3.085   5.681
   44   HD23  LEU   6          3HD2      LEU   6   5.274   2.867   7.320
   45    H    TRP   7           H        TRP   7  -0.148   1.754   5.271
   46    HA   TRP   7           HA       TRP   7  -1.167   0.065   7.328
   47    HB2  TRP   7          2HB       TRP   7  -2.354   1.174   4.808
   48    HB3  TRP   7          1HB       TRP   7  -3.224   0.208   5.969
   49    HD1  TRP   7           HD       TRP   7  -1.386   3.612   5.870
   50    HE1  TRP   7          1HE       TRP   7  -2.476   5.188   7.522
   51    HE3  TRP   7          3HE       TRP   7  -4.803   0.382   7.845
   52    HZ2  TRP   7          2HZ       TRP   7  -4.590   5.101   9.443
   53    HZ3  TRP   7          3HZ       TRP   7  -6.335   1.211   9.589
   54    HH2  TRP   7           HH       TRP   7  -6.223   3.522  10.364
   55    H    LYS   8           H        LYS   8  -1.576  -1.982   7.097
   56    HA   LYS   8           HA       LYS   8  -0.124  -3.499   5.196
   57    HB2  LYS   8          2HB       LYS   8  -0.684  -4.284   7.491
   58    HB3  LYS   8          1HB       LYS   8  -2.367  -4.423   7.009
   59    HG2  LYS   8          2HG       LYS   8  -1.759  -6.106   5.342
   60    HG3  LYS   8          1HG       LYS   8  -0.068  -5.969   5.820
   61    HD2  LYS   8          2HD       LYS   8  -2.330  -6.834   7.611
   62    HD3  LYS   8          1HD       LYS   8  -1.188  -7.925   6.830
   63    HE2  LYS   8          2HE       LYS   8   0.654  -6.857   8.077
   64    HE3  LYS   8          1HE       LYS   8  -0.507  -5.787   8.852
   65    HZ1  LYS   8          1HZ       LYS   8  -1.550  -7.697   9.880
   66    HZ2  LYS   8          2HZ       LYS   8   0.083  -7.637  10.271
   67    HZ3  LYS   8          3HZ       LYS   8  -0.456  -8.749   9.142
   68    H    CYS   9           H        CYS   9  -0.697  -3.974   3.192
   69    HA   CYS   9           HA       CYS   9  -3.277  -3.079   2.315
   70    HB2  CYS   9          2HB       CYS   9  -2.341  -3.387   0.069
   71    HB3  CYS   9          1HB       CYS   9  -1.367  -2.339   1.103
   72    H    ASN  10           H        ASN  10  -4.636  -4.283   1.073
   73    HA   ASN  10           HA       ASN  10  -4.355  -7.189   1.287
   74    HB2  ASN  10          2HB       ASN  10  -6.247  -6.174   2.626
   75    HB3  ASN  10          1HB       ASN  10  -6.894  -5.518   1.132
   76   HD21  ASN  10          1HD2      ASN  10  -8.208  -7.287   2.977
   77   HD22  ASN  10          2HD2      ASN  10  -8.589  -8.708   2.104
   78    HA   PRO  11           HA       PRO  11  -3.967  -6.247  -3.136
   79    HB2  PRO  11          2HB       PRO  11  -3.514  -8.804  -3.968
   80    HB3  PRO  11          1HB       PRO  11  -2.264  -7.772  -3.261
   81    HG2  PRO  11          2HG       PRO  11  -3.915  -9.908  -1.964
   82    HG3  PRO  11          1HG       PRO  11  -2.178  -9.586  -1.799
   83    HD2  PRO  11          2HD       PRO  11  -3.964  -8.821   0.056
   84    HD3  PRO  11          1HD       PRO  11  -2.524  -7.846  -0.311
   85    H    SER  12           H        SER  12  -6.349  -8.026  -1.600
   86    HA   SER  12           HA       SER  12  -7.825  -8.647  -4.057
   87    HB2  SER  12          2HB       SER  12  -7.382 -10.391  -2.336
   88    HB3  SER  12          1HB       SER  12  -8.344  -9.473  -1.200
   89    HG   SER  12           HG       SER  12  -9.434 -10.233  -3.692
   90    H    ASN  13           H        ASN  13  -7.475  -6.284  -1.753
   91    HA   ASN  13           HA       ASN  13  -9.924  -4.982  -2.292
   92    HB2  ASN  13          2HB       ASN  13 -10.595  -6.636  -0.534
   93    HB3  ASN  13          1HB       ASN  13  -9.429  -5.905   0.551
   94   HD21  ASN  13          1HD2      ASN  13 -12.512  -5.478  -0.998
   95   HD22  ASN  13          2HD2      ASN  13 -12.995  -4.088  -0.095
   96    H    ASP  14           H        ASP  14  -8.245  -3.797  -3.031
   97    HA   ASP  14           HA       ASP  14  -6.283  -2.770  -1.208
   98    HB2  ASP  14          2HB       ASP  14  -5.805  -3.617  -3.428
   99    HB3  ASP  14          1HB       ASP  14  -6.718  -2.298  -4.150
  100    H    LYS  15           H        LYS  15  -6.590  -0.989  -0.248
  101    HA   LYS  15           HA       LYS  15  -8.805   0.717  -1.095
  102    HB2  LYS  15          2HB       LYS  15  -8.501  -0.904   1.040
  103    HB3  LYS  15          1HB       LYS  15  -8.033   0.666   1.692
  104    HG2  LYS  15          2HG       LYS  15 -10.158   1.571   0.917
  105    HG3  LYS  15          1HG       LYS  15 -10.607  -0.038   0.323
  106    HD2  LYS  15          2HD       LYS  15 -10.233  -0.924   2.528
  107    HD3  LYS  15          1HD       LYS  15  -9.900   0.700   3.119
  108    HE2  LYS  15          2HE       LYS  15 -12.525  -0.238   1.919
  109    HE3  LYS  15          1HE       LYS  15 -12.225   0.058   3.627
  110    HZ1  LYS  15          1HZ       LYS  15 -11.783   2.387   3.067
  111    HZ2  LYS  15          2HZ       LYS  15 -13.341   1.922   2.718
  112    HZ3  LYS  15          3HZ       LYS  15 -12.214   2.105   1.457
  113    H    CYS  16           H        CYS  16  -5.706   0.573  -1.310
  114    HA   CYS  16           HA       CYS  16  -5.176   3.047   0.008
  115    HB2  CYS  16          2HB       CYS  16  -3.304   0.999  -1.134
  116    HB3  CYS  16          1HB       CYS  16  -2.735   2.586  -0.604
  117    H    CYS  17           H        CYS  17  -3.779   4.657  -1.171
  118    HA   CYS  17           HA       CYS  17  -5.267   5.560  -3.407
  119    HB2  CYS  17          2HB       CYS  17  -2.801   6.642  -2.097
  120    HB3  CYS  17          1HB       CYS  17  -3.778   7.517  -3.258
  121    H    ARG  18           H        ARG  18  -4.775   4.121  -5.198
  122    HA   ARG  18           HA       ARG  18  -2.123   4.669  -6.134
  123    HB2  ARG  18          2HB       ARG  18  -2.168   2.685  -7.607
  124    HB3  ARG  18          1HB       ARG  18  -2.390   2.248  -5.927
  125    HG2  ARG  18          2HG       ARG  18  -4.695   2.569  -7.787
  126    HG3  ARG  18          1HG       ARG  18  -3.781   1.053  -7.716
  127    HD2  ARG  18          2HD       ARG  18  -4.292   0.978  -5.298
  128    HD3  ARG  18          1HD       ARG  18  -5.300   2.414  -5.498
  129    HE   ARG  18           HE       ARG  18  -5.960   0.323  -7.289
  130   HH11  ARG  18          1HH1      ARG  18  -6.416   1.498  -3.998
  131   HH12  ARG  18          2HH1      ARG  18  -7.830   0.589  -3.715
  132   HH21  ARG  18          1HH2      ARG  18  -7.931  -0.869  -6.950
  133   HH22  ARG  18          2HH2      ARG  18  -8.736  -0.736  -5.448
  134    HA   PRO  19           HA       PRO  19  -1.085   4.397  -8.016
  135    HB2  PRO  19          2HB       PRO  19   0.026   5.701 -10.029
  136    HB3  PRO  19          1HB       PRO  19  -1.065   4.334 -10.290
  137    HG2  PRO  19          2HG       PRO  19  -1.556   7.236 -10.606
  138    HG3  PRO  19          1HG       PRO  19  -2.224   5.888 -11.557
  139    HD2  PRO  19          2HD       PRO  19  -3.471   7.284  -9.420
  140    HD3  PRO  19          1HD       PRO  19  -4.047   5.788 -10.177
  141    H    ASN  20           H        ASN  20  -0.215   5.147  -6.324
  142    HA   ASN  20           HA       ASN  20   1.457   7.419  -6.255
  143    HB2  ASN  20          2HB       ASN  20  -0.634   8.533  -5.757
  144    HB3  ASN  20          1HB       ASN  20  -0.991   7.365  -4.501
  145   HD21  ASN  20          1HD2      ASN  20   1.221   9.930  -5.362
  146   HD22  ASN  20          2HD2      ASN  20   1.752  10.266  -3.748
  147    H    LEU  21           H        LEU  21  -0.464   5.207  -4.350
  148    HA   LEU  21           HA       LEU  21   1.913   4.276  -2.949
  149    HB2  LEU  21          2HB       LEU  21  -1.015   3.992  -2.297
  150    HB3  LEU  21          1HB       LEU  21   0.323   3.444  -1.327
  151    HG   LEU  21           HG       LEU  21  -0.361   6.334  -1.870
  152   HD11  LEU  21          1HD1      LEU  21  -0.647   4.675   0.625
  153   HD12  LEU  21          2HD1      LEU  21  -1.961   5.260  -0.397
  154   HD13  LEU  21          3HD1      LEU  21  -0.956   6.406   0.492
  155   HD21  LEU  21          1HD2      LEU  21   1.352   6.793  -0.134
  156   HD22  LEU  21          2HD2      LEU  21   2.011   6.093  -1.605
  157   HD23  LEU  21          3HD2      LEU  21   1.802   5.083  -0.177
  158    H    VAL  22           H        VAL  22   1.808   2.002  -2.591
  159    HA   VAL  22           HA       VAL  22   0.256   0.446  -4.469
  160    HB   VAL  22           HB       VAL  22   2.144   1.062  -5.774
  161   HG11  VAL  22          1HG1      VAL  22   3.907  -0.140  -3.630
  162   HG12  VAL  22          2HG1      VAL  22   3.777   1.569  -4.042
  163   HG13  VAL  22          3HG1      VAL  22   4.474   0.437  -5.199
  164   HG21  VAL  22          1HG2      VAL  22   2.352  -1.822  -4.925
  165   HG22  VAL  22          2HG2      VAL  22   3.077  -1.160  -6.389
  166   HG23  VAL  22          3HG2      VAL  22   1.323  -1.161  -6.197
  167    H    CYS  23           H        CYS  23   0.056  -1.592  -3.899
  168    HA   CYS  23           HA       CYS  23   0.648  -2.293  -1.168
  169    HB2  CYS  23          2HB       CYS  23  -1.471  -3.014  -2.121
  170    HB3  CYS  23          1HB       CYS  23  -0.599  -3.907  -3.379
  171    H    SER  24           H        SER  24   2.396  -3.103  -0.620
  172    HA   SER  24           HA       SER  24   4.248  -4.114  -2.620
  173    HB2  SER  24          2HB       SER  24   4.978  -2.237  -1.231
  174    HB3  SER  24          1HB       SER  24   4.640  -3.173   0.219
  175    HG   SER  24           HG       SER  24   6.845  -3.120  -0.374
  176    H    ARG  25           H        ARG  25   4.779  -6.204  -2.633
  177    HA   ARG  25           HA       ARG  25   3.619  -8.043  -0.729
  178    HB2  ARG  25          2HB       ARG  25   3.774  -8.614  -3.133
  179    HB3  ARG  25          1HB       ARG  25   5.527  -8.517  -3.047
  180    HG2  ARG  25          2HG       ARG  25   4.777 -10.832  -3.035
  181    HG3  ARG  25          1HG       ARG  25   5.542 -10.412  -1.499
  182    HD2  ARG  25          2HD       ARG  25   3.338 -10.057  -0.508
  183    HD3  ARG  25          1HD       ARG  25   2.581 -10.513  -2.031
  184    HE   ARG  25           HE       ARG  25   4.140 -12.626  -1.441
  185   HH11  ARG  25          1HH1      ARG  25   1.718 -10.826   0.385
  186   HH12  ARG  25          2HH1      ARG  25   1.162 -12.153   1.267
  187   HH21  ARG  25          1HH2      ARG  25   3.366 -14.495  -0.240
  188   HH22  ARG  25          2HH2      ARG  25   2.109 -14.315   0.899
  189    H    LYS  26           H        LYS  26   6.527  -6.456  -1.423
  190    HA   LYS  26           HA       LYS  26   8.425  -7.896   0.092
  191    HB2  LYS  26          2HB       LYS  26   8.835  -6.174  -1.722
  192    HB3  LYS  26          1HB       LYS  26   8.316  -4.956  -0.605
  193    HG2  LYS  26          2HG       LYS  26  10.743  -6.687  -0.112
  194    HG3  LYS  26          1HG       LYS  26  10.801  -5.128  -0.923
  195    HD2  LYS  26          2HD       LYS  26   9.823  -4.099   1.136
  196    HD3  LYS  26          1HD       LYS  26   9.937  -5.669   1.923
  197    HE2  LYS  26          2HE       LYS  26  12.233  -4.043   0.831
  198    HE3  LYS  26          1HE       LYS  26  11.813  -4.234   2.530
  199    HZ1  LYS  26          1HZ       LYS  26  12.701  -6.383   0.698
  200    HZ2  LYS  26          2HZ       LYS  26  12.304  -6.620   2.311
  201    HZ3  LYS  26          3HZ       LYS  26  13.634  -5.665   1.887
  202    H    ASP  27           H        ASP  27   6.714  -4.860   0.711
  203    HA   ASP  27           HA       ASP  27   7.497  -4.840   3.476
  204    HB2  ASP  27          2HB       ASP  27   5.709  -2.982   1.930
  205    HB3  ASP  27          1HB       ASP  27   6.359  -2.724   3.533
  206    H    LYS  28           H        LYS  28   4.639  -5.613   1.562
  207    HA   LYS  28           HA       LYS  28   2.746  -6.345   1.904
  208    HB2  LYS  28          2HB       LYS  28   3.732  -7.066   4.657
  209    HB3  LYS  28          1HB       LYS  28   2.143  -7.467   3.983
  210    HG2  LYS  28          2HG       LYS  28   3.138  -8.722   2.193
  211    HG3  LYS  28          1HG       LYS  28   4.752  -8.262   2.724
  212    HD2  LYS  28          2HD       LYS  28   4.444  -9.509   4.785
  213    HD3  LYS  28          1HD       LYS  28   2.794  -9.919   4.309
  214    HE2  LYS  28          2HE       LYS  28   4.352 -11.768   3.879
  215    HE3  LYS  28          1HE       LYS  28   3.633 -11.159   2.393
  216    HZ1  LYS  28          1HZ       LYS  28   6.004 -11.568   2.145
  217    HZ2  LYS  28          2HZ       LYS  28   6.371 -10.531   3.389
  218    HZ3  LYS  28          3HZ       LYS  28   5.712  -9.920   1.963
  219    H    TRP  29           H        TRP  29   3.541  -3.607   2.640
  220    HA   TRP  29           HA       TRP  29   0.878  -2.872   3.535
  221    HB2  TRP  29          2HB       TRP  29   1.689  -1.055   4.903
  222    HB3  TRP  29          1HB       TRP  29   2.494  -2.512   5.439
  223    HD1  TRP  29           HD       TRP  29   3.340   0.397   2.998
  224    HE1  TRP  29          1HE       TRP  29   5.707   1.127   3.361
  225    HE3  TRP  29          3HE       TRP  29   4.560  -2.953   6.641
  226    HZ2  TRP  29          2HZ       TRP  29   7.916   0.386   5.070
  227    HZ3  TRP  29          3HZ       TRP  29   6.822  -2.863   7.607
  228    HH2  TRP  29           HH       TRP  29   8.461  -1.225   6.832
  229    H    CYS  30           H        CYS  30   0.358  -0.583   2.857
  230    HA   CYS  30           HA       CYS  30   0.967  -0.220   0.152
  231    HB2  CYS  30          2HB       CYS  30  -0.354   1.564   2.198
  232    HB3  CYS  30          1HB       CYS  30  -0.430   1.740   0.447
  233    H    LYS  31           H        LYS  31   2.732   0.710  -0.600
  234    HA   LYS  31           HA       LYS  31   4.378   2.446   1.128
  235    HB2  LYS  31          2HB       LYS  31   5.446   0.195   0.525
  236    HB3  LYS  31          1HB       LYS  31   5.125   0.634  -1.143
  237    HG2  LYS  31          2HG       LYS  31   7.478   0.803  -0.643
  238    HG3  LYS  31          1HG       LYS  31   6.834   2.365  -1.087
  239    HD2  LYS  31          2HD       LYS  31   8.230   2.787   0.748
  240    HD3  LYS  31          1HD       LYS  31   6.608   2.737   1.441
  241    HE2  LYS  31          2HE       LYS  31   8.101   1.470   2.843
  242    HE3  LYS  31          1HE       LYS  31   6.977   0.381   2.048
  243    HZ1  LYS  31          1HZ       LYS  31   9.808   0.838   1.246
  244    HZ2  LYS  31          2HZ       LYS  31   8.707  -0.120   0.399
  245    HZ3  LYS  31          3HZ       LYS  31   9.139  -0.552   1.945
  246    H    TYR  32           H        TYR  32   5.794   3.558  -0.665
  247    HA   TYR  32           HA       TYR  32   3.898   5.094  -2.317
  248    HB2  TYR  32          2HB       TYR  32   5.921   5.951  -0.716
  249    HB3  TYR  32          1HB       TYR  32   6.785   5.725  -2.199
  250    HD1  TYR  32          1HD       TYR  32   3.956   7.588  -0.736
  251    HD2  TYR  32          2HD       TYR  32   6.650   7.279  -4.010
  252    HE1  TYR  32          1HE       TYR  32   3.213   9.767  -1.537
  253    HE2  TYR  32          2HE       TYR  32   5.908   9.470  -4.825
  254    HH   TYR  32           HH       TYR  32   4.064  11.587  -2.946
  255    H    GLN  33           H        GLN  33   4.310   5.208  -4.578
  256    HA   GLN  33           HA       GLN  33   5.701   2.888  -5.500
  257    HB2  GLN  33          2HB       GLN  33   3.607   3.414  -6.486
  258    HB3  GLN  33          1HB       GLN  33   4.240   4.975  -7.028
  259    HG2  GLN  33          2HG       GLN  33   5.705   3.905  -8.599
  260    HG3  GLN  33          1HG       GLN  33   5.308   2.315  -7.960
  261   HE21  GLN  33          1HE2      GLN  33   4.173   4.994  -9.835
  262   HE22  GLN  33          2HE2      GLN  33   2.867   4.157 -10.600
  263    H    ILE  34           H        ILE  34   7.487   3.819  -4.520
  264    HA   ILE  34           HA       ILE  34   9.208   5.325  -6.309
  265    HB   ILE  34           HB       ILE  34   9.859   4.123  -3.589
  266   HG12  ILE  34          2HG1      ILE  34   8.276   5.989  -3.477
  267   HG13  ILE  34          1HG1      ILE  34   9.820   6.423  -2.753
  268   HG21  ILE  34          1HG2      ILE  34  11.557   5.950  -5.291
  269   HG22  ILE  34          2HG2      ILE  34  11.884   4.254  -4.937
  270   HG23  ILE  34          3HG2      ILE  34  11.930   5.450  -3.641
  271   HD11  ILE  34          1HD1      ILE  34   8.924   8.257  -4.045
  272   HD12  ILE  34          2HD1      ILE  34   8.818   7.238  -5.476
  273   HD13  ILE  34          3HD1      ILE  34  10.397   7.657  -4.805
  Start of MODEL    6
    1    H1   ASP   1          1HT       ASP   1 -12.217   9.925  -0.321
    2    H2   ASP   1          2HT       ASP   1 -12.480   8.240  -0.324
    3    H3   ASP   1          3HT       ASP   1 -11.427   8.927  -1.435
    4    HA   ASP   1           HA       ASP   1  -9.911   9.529   0.267
    5    HB2  ASP   1          2HB       ASP   1 -10.221   8.762   2.545
    6    HB3  ASP   1          1HB       ASP   1 -11.505   9.865   2.115
    7    H    CYS   2           H        CYS   2  -8.545   7.895   1.399
    8    HA   CYS   2           HA       CYS   2  -8.943   5.182   0.529
    9    HB2  CYS   2          2HB       CYS   2  -6.561   5.294  -0.384
   10    HB3  CYS   2          1HB       CYS   2  -7.920   5.810  -1.378
   11    H    LEU   3           H        LEU   3  -7.112   3.835   1.243
   12    HA   LEU   3           HA       LEU   3  -6.473   4.421   3.961
   13    HB2  LEU   3          2HB       LEU   3  -5.655   2.143   2.162
   14    HB3  LEU   3          1HB       LEU   3  -5.419   2.242   3.885
   15    HG   LEU   3           HG       LEU   3  -8.103   2.120   2.521
   16   HD11  LEU   3          1HD1      LEU   3  -6.548   0.011   4.002
   17   HD12  LEU   3          2HD1      LEU   3  -6.873   0.048   2.267
   18   HD13  LEU   3          3HD1      LEU   3  -8.201  -0.146   3.412
   19   HD21  LEU   3          1HD2      LEU   3  -8.962   1.717   4.779
   20   HD22  LEU   3          2HD2      LEU   3  -8.189   3.296   4.655
   21   HD23  LEU   3          3HD2      LEU   3  -7.344   1.959   5.439
   22    H    GLY   4           H        GLY   4  -4.441   4.791   4.739
   23    HA2  GLY   4          2HA       GLY   4  -2.692   6.120   2.866
   24    HA3  GLY   4          1HA       GLY   4  -2.570   6.131   4.619
   25    H    PHE   5           H        PHE   5  -0.271   5.903   3.896
   26    HA   PHE   5           HA       PHE   5   0.441   3.243   3.104
   27    HB2  PHE   5          2HB       PHE   5   2.780   4.277   3.103
   28    HB3  PHE   5          1HB       PHE   5   1.659   4.924   1.918
   29    HD1  PHE   5          1HD       PHE   5   3.759   5.648   4.752
   30    HD2  PHE   5          2HD       PHE   5   0.615   7.182   2.325
   31    HE1  PHE   5          1HE       PHE   5   4.191   7.903   5.607
   32    HE2  PHE   5          2HE       PHE   5   1.048   9.433   3.174
   33    HZ   PHE   5           HZ       PHE   5   2.836   9.800   4.818
   34    H    LEU   6           H        LEU   6   2.289   2.300   4.369
   35    HA   LEU   6           HA       LEU   6   3.270   1.503   6.237
   36    HB2  LEU   6          2HB       LEU   6   1.768   3.522   7.851
   37    HB3  LEU   6          1HB       LEU   6   3.193   2.620   8.363
   38    HG   LEU   6           HG       LEU   6   3.002   4.846   6.367
   39   HD11  LEU   6          1HD1      LEU   6   2.930   5.605   8.671
   40   HD12  LEU   6          2HD1      LEU   6   4.463   6.069   7.935
   41   HD13  LEU   6          3HD1      LEU   6   4.398   4.697   9.041
   42   HD21  LEU   6          1HD2      LEU   6   5.448   3.252   7.167
   43   HD22  LEU   6          2HD2      LEU   6   5.471   4.702   6.163
   44   HD23  LEU   6          3HD2      LEU   6   4.660   3.242   5.590
   45    H    TRP   7           H        TRP   7  -0.052   1.650   5.695
   46    HA   TRP   7           HA       TRP   7  -0.730   0.103   7.981
   47    HB2  TRP   7          2HB       TRP   7  -2.315   1.249   5.722
   48    HB3  TRP   7          1HB       TRP   7  -3.001   0.218   6.961
   49    HD1  TRP   7           HD       TRP   7  -1.521   3.667   6.471
   50    HE1  TRP   7          1HE       TRP   7  -2.135   5.169   8.483
   51    HE3  TRP   7          3HE       TRP   7  -3.645   0.128   9.423
   52    HZ2  TRP   7          2HZ       TRP   7  -3.389   4.837  11.020
   53    HZ3  TRP   7          3HZ       TRP   7  -4.521   0.777  11.624
   54    HH2  TRP   7           HH       TRP   7  -4.391   3.080  12.400
   55    H    LYS   8           H        LYS   8  -1.478  -1.944   7.858
   56    HA   LYS   8           HA       LYS   8  -0.290  -3.731   6.053
   57    HB2  LYS   8          2HB       LYS   8  -0.990  -4.411   8.301
   58    HB3  LYS   8          1HB       LYS   8  -2.669  -4.112   7.885
   59    HG2  LYS   8          2HG       LYS   8  -2.614  -5.933   6.273
   60    HG3  LYS   8          1HG       LYS   8  -0.910  -6.207   6.622
   61    HD2  LYS   8          2HD       LYS   8  -2.300  -7.839   7.790
   62    HD3  LYS   8          1HD       LYS   8  -1.490  -6.783   8.946
   63    HE2  LYS   8          2HE       LYS   8  -3.538  -5.480   9.196
   64    HE3  LYS   8          1HE       LYS   8  -4.345  -6.490   8.003
   65    HZ1  LYS   8          1HZ       LYS   8  -3.267  -7.459  10.594
   66    HZ2  LYS   8          2HZ       LYS   8  -4.151  -8.365   9.469
   67    HZ3  LYS   8          3HZ       LYS   8  -4.880  -7.086  10.281
   68    H    CYS   9           H        CYS   9  -0.879  -4.306   4.036
   69    HA   CYS   9           HA       CYS   9  -3.372  -3.176   3.114
   70    HB2  CYS   9          2HB       CYS   9  -2.418  -3.393   0.941
   71    HB3  CYS   9          1HB       CYS   9  -1.387  -2.462   2.041
   72    H    ASN  10           H        ASN  10  -4.763  -4.315   1.879
   73    HA   ASN  10           HA       ASN  10  -4.561  -7.224   2.031
   74    HB2  ASN  10          2HB       ASN  10  -6.612  -6.140   2.992
   75    HB3  ASN  10          1HB       ASN  10  -6.931  -5.436   1.414
   76   HD21  ASN  10          1HD2      ASN  10  -8.524  -7.283   3.050
   77   HD22  ASN  10          2HD2      ASN  10  -8.868  -8.644   2.054
   78    HA   PRO  11           HA       PRO  11  -3.323  -6.608  -2.285
   79    HB2  PRO  11          2HB       PRO  11  -3.605  -9.559  -2.296
   80    HB3  PRO  11          1HB       PRO  11  -2.221  -8.574  -2.792
   81    HG2  PRO  11          2HG       PRO  11  -2.126  -9.919  -0.526
   82    HG3  PRO  11          1HG       PRO  11  -1.518  -8.254  -0.586
   83    HD2  PRO  11          2HD       PRO  11  -4.132  -9.271   0.473
   84    HD3  PRO  11          1HD       PRO  11  -3.002  -8.089   1.179
   85    H    SER  12           H        SER  12  -6.140  -8.289  -1.138
   86    HA   SER  12           HA       SER  12  -7.245  -8.449  -3.836
   87    HB2  SER  12          2HB       SER  12  -7.100 -10.410  -2.243
   88    HB3  SER  12          1HB       SER  12  -8.350  -9.602  -1.310
   89    HG   SER  12           HG       SER  12  -9.039  -9.621  -3.891
   90    H    ASN  13           H        ASN  13  -7.098  -6.353  -1.367
   91    HA   ASN  13           HA       ASN  13  -9.524  -4.990  -2.067
   92    HB2  ASN  13          2HB       ASN  13 -10.246  -6.577  -0.233
   93    HB3  ASN  13          1HB       ASN  13  -9.115  -5.774   0.832
   94   HD21  ASN  13          1HD2      ASN  13 -12.074  -5.391  -0.914
   95   HD22  ASN  13          2HD2      ASN  13 -12.640  -3.990  -0.095
   96    H    ASP  14           H        ASP  14  -7.587  -4.020  -2.807
   97    HA   ASP  14           HA       ASP  14  -6.038  -2.612  -0.814
   98    HB2  ASP  14          2HB       ASP  14  -4.941  -3.790  -2.619
   99    HB3  ASP  14          1HB       ASP  14  -5.767  -2.811  -3.811
  100    H    LYS  15           H        LYS  15  -7.025  -0.907  -0.130
  101    HA   LYS  15           HA       LYS  15  -8.468   0.743  -2.041
  102    HB2  LYS  15          2HB       LYS  15  -9.405  -0.590   0.164
  103    HB3  LYS  15          1HB       LYS  15  -9.040   1.003   0.813
  104    HG2  LYS  15          2HG       LYS  15 -10.806   0.444  -1.554
  105    HG3  LYS  15          1HG       LYS  15 -11.382   0.804   0.071
  106    HD2  LYS  15          2HD       LYS  15 -10.250   2.969  -0.038
  107    HD3  LYS  15          1HD       LYS  15  -9.708   2.575  -1.665
  108    HE2  LYS  15          2HE       LYS  15 -12.025   2.454  -2.432
  109    HE3  LYS  15          1HE       LYS  15 -12.598   2.795  -0.802
  110    HZ1  LYS  15          1HZ       LYS  15 -11.555   5.001  -0.949
  111    HZ2  LYS  15          2HZ       LYS  15 -12.650   4.769  -2.184
  112    HZ3  LYS  15          3HZ       LYS  15 -11.012   4.647  -2.504
  113    H    CYS  16           H        CYS  16  -5.601   0.615  -1.220
  114    HA   CYS  16           HA       CYS  16  -5.283   2.935   0.378
  115    HB2  CYS  16          2HB       CYS  16  -3.288   1.167  -1.037
  116    HB3  CYS  16          1HB       CYS  16  -2.814   2.619  -0.157
  117    H    CYS  17           H        CYS  17  -3.787   4.679  -0.440
  118    HA   CYS  17           HA       CYS  17  -5.121   5.959  -2.587
  119    HB2  CYS  17          2HB       CYS  17  -2.618   6.742  -1.137
  120    HB3  CYS  17          1HB       CYS  17  -3.582   7.816  -2.150
  121    H    ARG  18           H        ARG  18  -4.409   3.957  -3.958
  122    HA   ARG  18           HA       ARG  18  -1.913   4.251  -5.241
  123    HB2  ARG  18          2HB       ARG  18  -2.862   2.369  -6.701
  124    HB3  ARG  18          1HB       ARG  18  -2.638   2.035  -4.992
  125    HG2  ARG  18          2HG       ARG  18  -5.089   2.561  -4.695
  126    HG3  ARG  18          1HG       ARG  18  -5.199   2.579  -6.457
  127    HD2  ARG  18          2HD       ARG  18  -4.113   0.317  -4.841
  128    HD3  ARG  18          1HD       ARG  18  -5.789   0.416  -5.369
  129    HE   ARG  18           HE       ARG  18  -4.522   0.696  -7.673
  130   HH11  ARG  18          1HH1      ARG  18  -3.698  -1.628  -5.096
  131   HH12  ARG  18          2HH1      ARG  18  -3.377  -2.884  -6.186
  132   HH21  ARG  18          1HH2      ARG  18  -4.097  -1.089  -9.141
  133   HH22  ARG  18          2HH2      ARG  18  -3.664  -2.605  -8.518
  134    HA   PRO  19           HA       PRO  19  -1.402   3.304  -7.736
  135    HB2  PRO  19          2HB       PRO  19  -0.236   5.450  -9.362
  136    HB3  PRO  19          1HB       PRO  19  -0.554   3.761  -9.749
  137    HG2  PRO  19          2HG       PRO  19  -2.077   5.650 -10.811
  138    HG3  PRO  19          1HG       PRO  19  -2.828   4.169 -10.186
  139    HD2  PRO  19          2HD       PRO  19  -2.569   6.846  -8.855
  140    HD3  PRO  19          1HD       PRO  19  -4.018   5.834  -9.042
  141    H    ASN  20           H        ASN  20  -1.067   6.514  -6.587
  142    HA   ASN  20           HA       ASN  20   1.714   6.765  -6.320
  143    HB2  ASN  20          2HB       ASN  20   0.167   8.636  -5.906
  144    HB3  ASN  20          1HB       ASN  20  -0.314   7.902  -4.381
  145   HD21  ASN  20          1HD2      ASN  20   2.992   8.068  -5.679
  146   HD22  ASN  20          2HD2      ASN  20   3.602   9.089  -4.448
  147    H    LEU  21           H        LEU  21  -0.486   5.515  -3.710
  148    HA   LEU  21           HA       LEU  21   1.833   4.056  -2.655
  149    HB2  LEU  21          2HB       LEU  21  -0.714   4.697  -1.225
  150    HB3  LEU  21          1HB       LEU  21   0.680   3.920  -0.615
  151    HG   LEU  21           HG       LEU  21   0.675   6.051   0.404
  152   HD11  LEU  21          1HD1      LEU  21   2.760   7.051  -0.261
  153   HD12  LEU  21          2HD1      LEU  21   2.719   6.143  -1.765
  154   HD13  LEU  21          3HD1      LEU  21   2.862   5.288  -0.224
  155   HD21  LEU  21          1HD2      LEU  21  -0.777   7.312  -1.008
  156   HD22  LEU  21          2HD2      LEU  21   0.377   7.235  -2.336
  157   HD23  LEU  21          3HD2      LEU  21   0.762   8.167  -0.891
  158    H    VAL  22           H        VAL  22   1.419   2.003  -2.219
  159    HA   VAL  22           HA       VAL  22  -1.122   0.836  -2.999
  160    HB   VAL  22           HB       VAL  22   0.081   1.259  -5.114
  161   HG11  VAL  22          1HG1      VAL  22   2.353   0.870  -4.340
  162   HG12  VAL  22          2HG1      VAL  22   1.988  -0.076  -5.783
  163   HG13  VAL  22          3HG1      VAL  22   2.013  -0.856  -4.197
  164   HG21  VAL  22          1HG2      VAL  22  -0.286  -0.960  -6.141
  165   HG22  VAL  22          2HG2      VAL  22  -1.610  -0.462  -5.088
  166   HG23  VAL  22          3HG2      VAL  22  -0.433  -1.649  -4.525
  167    H    CYS  23           H        CYS  23  -1.166  -1.411  -2.634
  168    HA   CYS  23           HA       CYS  23   0.107  -2.257  -0.265
  169    HB2  CYS  23          2HB       CYS  23  -2.018  -3.164  -1.011
  170    HB3  CYS  23          1HB       CYS  23  -1.201  -3.843  -2.424
  171    H    SER  24           H        SER  24   2.041  -2.834  -0.026
  172    HA   SER  24           HA       SER  24   3.700  -3.601  -2.272
  173    HB2  SER  24          2HB       SER  24   4.631  -1.948  -0.769
  174    HB3  SER  24          1HB       SER  24   4.356  -2.998   0.615
  175    HG   SER  24           HG       SER  24   6.470  -2.898  -1.039
  176    H    ARG  25           H        ARG  25   4.181  -5.587  -2.701
  177    HA   ARG  25           HA       ARG  25   3.247  -7.794  -1.138
  178    HB2  ARG  25          2HB       ARG  25   3.360  -7.872  -3.595
  179    HB3  ARG  25          1HB       ARG  25   5.100  -7.657  -3.529
  180    HG2  ARG  25          2HG       ARG  25   5.300  -9.814  -2.367
  181    HG3  ARG  25          1HG       ARG  25   3.556 -10.032  -2.512
  182    HD2  ARG  25          2HD       ARG  25   4.756 -11.240  -4.264
  183    HD3  ARG  25          1HD       ARG  25   3.738  -9.973  -4.941
  184    HE   ARG  25           HE       ARG  25   5.723  -8.648  -5.292
  185   HH11  ARG  25          1HH1      ARG  25   6.357 -12.036  -4.487
  186   HH12  ARG  25          2HH1      ARG  25   7.862 -12.080  -5.265
  187   HH21  ARG  25          1HH2      ARG  25   7.767  -8.699  -6.342
  188   HH22  ARG  25          2HH2      ARG  25   8.695 -10.130  -6.348
  189    H    LYS  26           H        LYS  26   6.135  -5.991  -1.523
  190    HA   LYS  26           HA       LYS  26   7.959  -7.880  -0.377
  191    HB2  LYS  26          2HB       LYS  26   8.466  -6.094  -2.081
  192    HB3  LYS  26          1HB       LYS  26   8.266  -4.934  -0.810
  193    HG2  LYS  26          2HG       LYS  26  10.137  -5.683   0.399
  194    HG3  LYS  26          1HG       LYS  26  10.294  -7.135  -0.591
  195    HD2  LYS  26          2HD       LYS  26  11.996  -5.504  -1.207
  196    HD3  LYS  26          1HD       LYS  26  10.862  -5.732  -2.528
  197    HE2  LYS  26          2HE       LYS  26  11.426  -3.374  -2.258
  198    HE3  LYS  26          1HE       LYS  26   9.726  -3.652  -1.914
  199    HZ1  LYS  26          1HZ       LYS  26  10.973  -2.161  -0.368
  200    HZ2  LYS  26          2HZ       LYS  26  11.743  -3.518   0.273
  201    HZ3  LYS  26          3HZ       LYS  26  10.057  -3.341   0.356
  202    H    ASP  27           H        ASP  27   6.595  -4.795   0.627
  203    HA   ASP  27           HA       ASP  27   7.656  -5.078   3.290
  204    HB2  ASP  27          2HB       ASP  27   6.190  -2.905   1.858
  205    HB3  ASP  27          1HB       ASP  27   6.563  -2.822   3.570
  206    H    LYS  28           H        LYS  28   4.563  -5.677   1.734
  207    HA   LYS  28           HA       LYS  28   2.731  -6.542   2.397
  208    HB2  LYS  28          2HB       LYS  28   3.906  -6.848   5.172
  209    HB3  LYS  28          1HB       LYS  28   2.463  -7.585   4.462
  210    HG2  LYS  28          2HG       LYS  28   3.806  -8.844   2.889
  211    HG3  LYS  28          1HG       LYS  28   5.273  -8.083   3.502
  212    HD2  LYS  28          2HD       LYS  28   5.055 -10.308   4.452
  213    HD3  LYS  28          1HD       LYS  28   4.836  -9.100   5.717
  214    HE2  LYS  28          2HE       LYS  28   2.407  -9.345   5.529
  215    HE3  LYS  28          1HE       LYS  28   2.626 -10.543   4.259
  216    HZ1  LYS  28          1HZ       LYS  28   3.739 -11.973   5.876
  217    HZ2  LYS  28          2HZ       LYS  28   2.186 -11.567   6.380
  218    HZ3  LYS  28          3HZ       LYS  28   3.511 -10.813   7.083
  219    H    TRP  29           H        TRP  29   3.505  -3.665   2.882
  220    HA   TRP  29           HA       TRP  29   0.913  -2.995   3.996
  221    HB2  TRP  29          2HB       TRP  29   1.752  -1.139   5.319
  222    HB3  TRP  29          1HB       TRP  29   2.587  -2.588   5.828
  223    HD1  TRP  29           HD       TRP  29   3.309   0.414   3.443
  224    HE1  TRP  29          1HE       TRP  29   5.721   1.133   3.748
  225    HE3  TRP  29          3HE       TRP  29   4.726  -3.126   6.814
  226    HZ2  TRP  29          2HZ       TRP  29   7.981   0.306   5.269
  227    HZ3  TRP  29          3HZ       TRP  29   7.043  -3.079   7.657
  228    HH2  TRP  29           HH       TRP  29   8.622  -1.397   6.893
  229    H    CYS  30           H        CYS  30   0.277  -0.687   3.275
  230    HA   CYS  30           HA       CYS  30   0.926  -0.435   0.571
  231    HB2  CYS  30          2HB       CYS  30  -0.605   1.259   2.531
  232    HB3  CYS  30          1HB       CYS  30  -0.457   1.632   0.816
  233    H    LYS  31           H        LYS  31   2.560   0.566  -0.288
  234    HA   LYS  31           HA       LYS  31   4.216   2.338   1.391
  235    HB2  LYS  31          2HB       LYS  31   4.981  -0.186   0.854
  236    HB3  LYS  31          1HB       LYS  31   5.335   0.549  -0.704
  237    HG2  LYS  31          2HG       LYS  31   6.853   2.130   0.392
  238    HG3  LYS  31          1HG       LYS  31   6.561   1.291   1.922
  239    HD2  LYS  31          2HD       LYS  31   7.395  -0.786   0.904
  240    HD3  LYS  31          1HD       LYS  31   7.749   0.104  -0.576
  241    HE2  LYS  31          2HE       LYS  31   9.769  -0.143   0.708
  242    HE3  LYS  31          1HE       LYS  31   9.295   1.556   0.720
  243    HZ1  LYS  31          1HZ       LYS  31   8.905  -0.430   2.905
  244    HZ2  LYS  31          2HZ       LYS  31   8.374   1.193   2.964
  245    HZ3  LYS  31          3HZ       LYS  31   9.998   0.853   2.902
  246    H    TYR  32           H        TYR  32   5.888   3.269  -0.434
  247    HA   TYR  32           HA       TYR  32   4.180   4.781  -2.234
  248    HB2  TYR  32          2HB       TYR  32   6.274   5.558  -0.826
  249    HB3  TYR  32          1HB       TYR  32   7.167   4.897  -2.166
  250    HD1  TYR  32          1HD       TYR  32   6.414   5.847  -4.559
  251    HD2  TYR  32          2HD       TYR  32   5.746   7.787  -0.840
  252    HE1  TYR  32          1HE       TYR  32   6.276   7.997  -5.713
  253    HE2  TYR  32          2HE       TYR  32   5.598   9.934  -1.977
  254    HH   TYR  32           HH       TYR  32   6.333  10.957  -4.057
  255    H    GLN  33           H        GLN  33   3.896   4.183  -4.315
  256    HA   GLN  33           HA       GLN  33   5.670   2.158  -5.384
  257    HB2  GLN  33          2HB       GLN  33   3.209   2.008  -5.704
  258    HB3  GLN  33          1HB       GLN  33   3.335   3.474  -6.685
  259    HG2  GLN  33          2HG       GLN  33   4.594   2.355  -8.366
  260    HG3  GLN  33          1HG       GLN  33   4.809   0.932  -7.352
  261   HE21  GLN  33          1HE2      GLN  33   1.732   2.588  -7.605
  262   HE22  GLN  33          2HE2      GLN  33   0.944   1.338  -8.487
  263    H    ILE  34           H        ILE  34   7.170   3.804  -5.005
  264    HA   ILE  34           HA       ILE  34   7.493   5.946  -6.848
  265    HB   ILE  34           HB       ILE  34   8.553   6.178  -4.713
  266   HG12  ILE  34          2HG1      ILE  34  10.913   6.735  -5.326
  267   HG13  ILE  34          1HG1      ILE  34  10.655   5.928  -6.870
  268   HG21  ILE  34          1HG2      ILE  34   8.948   3.925  -4.086
  269   HG22  ILE  34          2HG2      ILE  34  10.455   4.833  -3.951
  270   HG23  ILE  34          3HG2      ILE  34  10.195   3.750  -5.319
  271   HD11  ILE  34          1HD1      ILE  34   9.145   8.334  -5.875
  272   HD12  ILE  34          2HD1      ILE  34   8.923   7.541  -7.436
  273   HD13  ILE  34          3HD1      ILE  34  10.447   8.340  -7.059
  Start of MODEL    7
    1    H1   ASP   1          1HT       ASP   1 -13.054   8.387  -0.897
    2    H2   ASP   1          2HT       ASP   1 -12.893   6.799  -0.339
    3    H3   ASP   1          3HT       ASP   1 -12.196   7.244  -1.801
    4    HA   ASP   1           HA       ASP   1 -10.680   8.721  -0.660
    5    HB2  ASP   1          2HB       ASP   1 -10.519   8.679   1.736
    6    HB3  ASP   1          1HB       ASP   1 -12.170   9.097   1.330
    7    H    CYS   2           H        CYS   2  -8.827   7.768   0.629
    8    HA   CYS   2           HA       CYS   2  -8.696   4.902   0.266
    9    HB2  CYS   2          2HB       CYS   2  -6.425   5.221  -0.762
   10    HB3  CYS   2          1HB       CYS   2  -7.849   5.456  -1.759
   11    H    LEU   3           H        LEU   3  -6.847   3.929   1.106
   12    HA   LEU   3           HA       LEU   3  -6.144   4.906   3.711
   13    HB2  LEU   3          2HB       LEU   3  -5.380   2.431   2.160
   14    HB3  LEU   3          1HB       LEU   3  -4.814   2.808   3.756
   15    HG   LEU   3           HG       LEU   3  -7.724   2.400   3.074
   16   HD11  LEU   3          1HD1      LEU   3  -6.441   0.357   2.649
   17   HD12  LEU   3          2HD1      LEU   3  -7.427   0.191   4.106
   18   HD13  LEU   3          3HD1      LEU   3  -5.696   0.490   4.243
   19   HD21  LEU   3          1HD2      LEU   3  -7.958   2.141   5.473
   20   HD22  LEU   3          2HD2      LEU   3  -7.268   3.718   5.076
   21   HD23  LEU   3          3HD2      LEU   3  -6.232   2.431   5.688
   22    H    GLY   4           H        GLY   4  -4.095   5.380   4.363
   23    HA2  GLY   4          2HA       GLY   4  -2.308   6.396   2.326
   24    HA3  GLY   4          1HA       GLY   4  -2.183   6.656   4.065
   25    H    PHE   5           H        PHE   5   0.163   6.099   3.467
   26    HA   PHE   5           HA       PHE   5   0.472   3.293   3.022
   27    HB2  PHE   5          2HB       PHE   5   2.933   3.826   2.929
   28    HB3  PHE   5          1HB       PHE   5   1.968   4.600   1.691
   29    HD1  PHE   5          1HD       PHE   5   4.257   5.047   4.429
   30    HD2  PHE   5          2HD       PHE   5   1.495   7.069   1.904
   31    HE1  PHE   5          1HE       PHE   5   5.289   7.193   5.020
   32    HE2  PHE   5          2HE       PHE   5   2.521   9.216   2.499
   33    HZ   PHE   5           HZ       PHE   5   4.420   9.281   4.054
   34    H    LEU   6           H        LEU   6   2.140   2.195   4.351
   35    HA   LEU   6           HA       LEU   6   3.002   1.418   6.287
   36    HB2  LEU   6          2HB       LEU   6   1.695   3.704   7.709
   37    HB3  LEU   6          1HB       LEU   6   2.982   2.677   8.341
   38    HG   LEU   6           HG       LEU   6   3.171   4.701   6.132
   39   HD11  LEU   6          1HD1      LEU   6   4.259   4.721   8.936
   40   HD12  LEU   6          2HD1      LEU   6   2.987   5.755   8.282
   41   HD13  LEU   6          3HD1      LEU   6   4.646   5.921   7.704
   42   HD21  LEU   6          1HD2      LEU   6   5.621   4.277   6.197
   43   HD22  LEU   6          2HD2      LEU   6   4.703   2.860   5.690
   44   HD23  LEU   6          3HD2      LEU   6   5.339   2.957   7.332
   45    H    TRP   7           H        TRP   7   0.026   1.379   5.248
   46    HA   TRP   7           HA       TRP   7  -1.133   0.131   7.589
   47    HB2  TRP   7          2HB       TRP   7  -2.284   1.565   5.221
   48    HB3  TRP   7          1HB       TRP   7  -3.250   0.533   6.256
   49    HD1  TRP   7           HD       TRP   7  -0.819   3.519   6.801
   50    HE1  TRP   7          1HE       TRP   7  -1.779   5.046   8.611
   51    HE3  TRP   7          3HE       TRP   7  -5.073   0.911   7.825
   52    HZ2  TRP   7          2HZ       TRP   7  -4.096   5.151  10.257
   53    HZ3  TRP   7          3HZ       TRP   7  -6.618   1.799   9.518
   54    HH2  TRP   7           HH       TRP   7  -6.140   3.873  10.706
   55    H    LYS   8           H        LYS   8  -2.274  -1.808   7.201
   56    HA   LYS   8           HA       LYS   8  -0.851  -3.559   5.502
   57    HB2  LYS   8          2HB       LYS   8  -1.709  -4.209   7.719
   58    HB3  LYS   8          1HB       LYS   8  -3.350  -4.026   7.127
   59    HG2  LYS   8          2HG       LYS   8  -2.796  -6.355   7.170
   60    HG3  LYS   8          1HG       LYS   8  -2.911  -5.827   5.487
   61    HD2  LYS   8          2HD       LYS   8  -0.468  -5.668   5.368
   62    HD3  LYS   8          1HD       LYS   8  -0.347  -6.173   7.053
   63    HE2  LYS   8          2HE       LYS   8   0.113  -8.057   5.614
   64    HE3  LYS   8          1HE       LYS   8  -1.423  -8.320   6.437
   65    HZ1  LYS   8          1HZ       LYS   8  -2.563  -7.592   4.387
   66    HZ2  LYS   8          2HZ       LYS   8  -1.573  -8.907   4.089
   67    HZ3  LYS   8          3HZ       LYS   8  -1.072  -7.380   3.649
   68    H    CYS   9           H        CYS   9  -1.234  -4.011   3.463
   69    HA   CYS   9           HA       CYS   9  -3.583  -3.147   2.127
   70    HB2  CYS   9          2HB       CYS   9  -2.342  -4.336   0.225
   71    HB3  CYS   9          1HB       CYS   9  -1.606  -2.892   0.932
   72    H    ASN  10           H        ASN  10  -4.936  -4.612   0.890
   73    HA   ASN  10           HA       ASN  10  -5.035  -7.351   1.885
   74    HB2  ASN  10          2HB       ASN  10  -6.487  -5.997   3.353
   75    HB3  ASN  10          1HB       ASN  10  -7.370  -5.426   1.944
   76   HD21  ASN  10          1HD2      ASN  10  -6.757  -8.125   4.015
   77   HD22  ASN  10          2HD2      ASN  10  -8.050  -9.116   3.466
   78    HA   PRO  11           HA       PRO  11  -5.490  -7.698  -2.506
   79    HB2  PRO  11          2HB       PRO  11  -6.052 -10.345  -2.689
   80    HB3  PRO  11          1HB       PRO  11  -4.438  -9.717  -2.341
   81    HG2  PRO  11          2HG       PRO  11  -6.498 -10.778  -0.449
   82    HG3  PRO  11          1HG       PRO  11  -4.753 -11.089  -0.498
   83    HD2  PRO  11          2HD       PRO  11  -5.855  -9.333   1.231
   84    HD3  PRO  11          1HD       PRO  11  -4.239  -9.093   0.540
   85    H    SER  12           H        SER  12  -8.135  -8.377  -0.360
   86    HA   SER  12           HA       SER  12  -9.967  -8.781  -2.547
   87    HB2  SER  12          2HB       SER  12 -10.281  -8.925   0.435
   88    HB3  SER  12          1HB       SER  12 -11.457  -9.422  -0.776
   89    HG   SER  12           HG       SER  12 -10.015 -11.014  -1.467
   90    H    ASN  13           H        ASN  13  -8.790  -6.317  -0.416
   91    HA   ASN  13           HA       ASN  13 -10.776  -4.443  -1.186
   92    HB2  ASN  13          2HB       ASN  13 -11.894  -5.622   0.692
   93    HB3  ASN  13          1HB       ASN  13 -10.554  -5.201   1.736
   94   HD21  ASN  13          1HD2      ASN  13 -11.793  -3.987   3.138
   95   HD22  ASN  13          2HD2      ASN  13 -12.444  -2.442   2.752
   96    H    ASP  14           H        ASP  14  -8.776  -3.887  -1.984
   97    HA   ASP  14           HA       ASP  14  -6.795  -2.893  -0.094
   98    HB2  ASP  14          2HB       ASP  14  -6.218  -4.383  -1.969
   99    HB3  ASP  14          1HB       ASP  14  -6.652  -3.106  -3.101
  100    H    LYS  15           H        LYS  15  -7.201  -0.885   0.493
  101    HA   LYS  15           HA       LYS  15  -8.906   0.664  -1.296
  102    HB2  LYS  15          2HB       LYS  15  -9.533  -0.343   1.011
  103    HB3  LYS  15          1HB       LYS  15  -8.603   1.004   1.633
  104    HG2  LYS  15          2HG       LYS  15 -10.098   2.505   0.306
  105    HG3  LYS  15          1HG       LYS  15 -11.033   1.022  -0.038
  106    HD2  LYS  15          2HD       LYS  15 -11.323   0.592   2.292
  107    HD3  LYS  15          1HD       LYS  15 -10.327   1.978   2.705
  108    HE2  LYS  15          2HE       LYS  15 -13.039   2.077   1.347
  109    HE3  LYS  15          1HE       LYS  15 -12.712   2.508   3.022
  110    HZ1  LYS  15          1HZ       LYS  15 -12.783   4.530   1.787
  111    HZ2  LYS  15          2HZ       LYS  15 -11.832   3.911   0.577
  112    HZ3  LYS  15          3HZ       LYS  15 -11.155   4.223   2.101
  113    H    CYS  16           H        CYS  16  -5.862   0.401  -0.822
  114    HA   CYS  16           HA       CYS  16  -5.203   2.902   0.331
  115    HB2  CYS  16          2HB       CYS  16  -3.435   0.914  -1.065
  116    HB3  CYS  16          1HB       CYS  16  -2.836   2.320  -0.186
  117    H    CYS  17           H        CYS  17  -3.897   4.596  -0.726
  118    HA   CYS  17           HA       CYS  17  -5.219   5.585  -3.008
  119    HB2  CYS  17          2HB       CYS  17  -2.713   6.507  -1.652
  120    HB3  CYS  17          1HB       CYS  17  -3.547   7.427  -2.875
  121    H    ARG  18           H        ARG  18  -4.859   4.165  -4.709
  122    HA   ARG  18           HA       ARG  18  -2.178   3.777  -5.555
  123    HB2  ARG  18          2HB       ARG  18  -3.215   2.308  -7.346
  124    HB3  ARG  18          1HB       ARG  18  -3.498   1.801  -5.695
  125    HG2  ARG  18          2HG       ARG  18  -5.519   1.438  -6.843
  126    HG3  ARG  18          1HG       ARG  18  -5.780   2.906  -5.919
  127    HD2  ARG  18          2HD       ARG  18  -6.653   3.053  -8.228
  128    HD3  ARG  18          1HD       ARG  18  -5.412   4.263  -7.886
  129    HE   ARG  18           HE       ARG  18  -4.508   1.793  -9.077
  130   HH11  ARG  18          1HH1      ARG  18  -5.581   5.106  -9.702
  131   HH12  ARG  18          2HH1      ARG  18  -4.731   5.266 -11.169
  132   HH21  ARG  18          1HH2      ARG  18  -3.328   2.017 -11.084
  133   HH22  ARG  18          2HH2      ARG  18  -3.462   3.472 -11.991
  134    HA   PRO  19           HA       PRO  19  -1.347   3.120  -7.640
  135    HB2  PRO  19          2HB       PRO  19   0.242   3.775  -9.593
  136    HB3  PRO  19          1HB       PRO  19  -1.502   3.485  -9.865
  137    HG2  PRO  19          2HG       PRO  19  -0.047   6.099  -9.708
  138    HG3  PRO  19          1HG       PRO  19  -1.282   5.585 -10.871
  139    HD2  PRO  19          2HD       PRO  19  -1.744   7.060  -8.530
  140    HD3  PRO  19          1HD       PRO  19  -2.975   6.201  -9.477
  141    H    ASN  20           H        ASN  20  -0.844   6.100  -6.589
  142    HA   ASN  20           HA       ASN  20   1.879   6.600  -6.271
  143    HB2  ASN  20          2HB       ASN  20  -0.020   7.013  -4.006
  144    HB3  ASN  20          1HB       ASN  20   1.358   7.952  -4.544
  145   HD21  ASN  20          1HD2      ASN  20  -1.296   8.489  -3.909
  146   HD22  ASN  20          2HD2      ASN  20  -1.994   9.441  -5.176
  147    H    LEU  21           H        LEU  21  -0.459   4.862  -4.219
  148    HA   LEU  21           HA       LEU  21   1.778   3.772  -2.844
  149    HB2  LEU  21          2HB       LEU  21  -1.085   3.745  -1.989
  150    HB3  LEU  21          1HB       LEU  21   0.303   3.326  -1.043
  151    HG   LEU  21           HG       LEU  21  -0.351   6.122  -1.968
  152   HD11  LEU  21          1HD1      LEU  21  -0.441   4.895   0.769
  153   HD12  LEU  21          2HD1      LEU  21  -1.836   5.288  -0.224
  154   HD13  LEU  21          3HD1      LEU  21  -0.783   6.577   0.367
  155   HD21  LEU  21          1HD2      LEU  21   1.894   5.090  -0.243
  156   HD22  LEU  21          2HD2      LEU  21   1.492   6.790  -0.480
  157   HD23  LEU  21          3HD2      LEU  21   2.032   5.811  -1.845
  158    H    VAL  22           H        VAL  22   1.607   1.541  -2.480
  159    HA   VAL  22           HA       VAL  22  -0.435  -0.064  -3.727
  160    HB   VAL  22           HB       VAL  22   1.107   0.451  -5.576
  161   HG11  VAL  22          1HG1      VAL  22   3.190   0.710  -4.377
  162   HG12  VAL  22          2HG1      VAL  22   3.385  -0.496  -5.650
  163   HG13  VAL  22          3HG1      VAL  22   3.203  -1.007  -3.972
  164   HG21  VAL  22          1HG2      VAL  22  -0.103  -1.643  -5.710
  165   HG22  VAL  22          2HG2      VAL  22   1.145  -2.460  -4.771
  166   HG23  VAL  22          3HG2      VAL  22   1.512  -1.861  -6.388
  167    H    CYS  23           H        CYS  23  -0.173  -2.245  -3.145
  168    HA   CYS  23           HA       CYS  23   0.857  -2.643  -0.520
  169    HB2  CYS  23          2HB       CYS  23  -1.117  -3.831  -1.318
  170    HB3  CYS  23          1HB       CYS  23  -0.127  -4.641  -2.536
  171    H    SER  24           H        SER  24   2.761  -3.115  -0.038
  172    HA   SER  24           HA       SER  24   4.717  -3.791  -2.065
  173    HB2  SER  24          2HB       SER  24   5.326  -2.058  -0.449
  174    HB3  SER  24          1HB       SER  24   4.988  -3.158   0.885
  175    HG   SER  24           HG       SER  24   7.279  -2.908   0.266
  176    H    ARG  25           H        ARG  25   5.516  -5.749  -2.294
  177    HA   ARG  25           HA       ARG  25   4.392  -7.942  -0.768
  178    HB2  ARG  25          2HB       ARG  25   4.786  -8.061  -3.250
  179    HB3  ARG  25          1HB       ARG  25   6.509  -8.008  -2.931
  180    HG2  ARG  25          2HG       ARG  25   6.411 -10.107  -1.769
  181    HG3  ARG  25          1HG       ARG  25   4.654 -10.144  -1.918
  182    HD2  ARG  25          2HD       ARG  25   6.644 -10.225  -4.178
  183    HD3  ARG  25          1HD       ARG  25   5.710 -11.588  -3.574
  184    HE   ARG  25           HE       ARG  25   4.464  -9.207  -4.790
  185   HH11  ARG  25          1HH1      ARG  25   4.634 -12.724  -4.413
  186   HH12  ARG  25          2HH1      ARG  25   3.440 -13.056  -5.566
  187   HH21  ARG  25          1HH2      ARG  25   2.806  -9.667  -6.413
  188   HH22  ARG  25          2HH2      ARG  25   2.396 -11.278  -6.747
  189    H    LYS  26           H        LYS  26   7.234  -6.098  -1.013
  190    HA   LYS  26           HA       LYS  26   9.031  -7.672   0.505
  191    HB2  LYS  26          2HB       LYS  26   9.702  -5.883  -1.033
  192    HB3  LYS  26          1HB       LYS  26   8.876  -4.718  -0.040
  193    HG2  LYS  26          2HG       LYS  26  10.437  -5.140   1.798
  194    HG3  LYS  26          1HG       LYS  26  11.305  -6.297   0.783
  195    HD2  LYS  26          2HD       LYS  26  11.807  -4.568  -0.819
  196    HD3  LYS  26          1HD       LYS  26  10.871  -3.397   0.107
  197    HE2  LYS  26          2HE       LYS  26  12.417  -3.630   1.975
  198    HE3  LYS  26          1HE       LYS  26  13.343  -4.823   1.064
  199    HZ1  LYS  26          1HZ       LYS  26  13.921  -3.156  -0.540
  200    HZ2  LYS  26          2HZ       LYS  26  14.283  -2.551   0.997
  201    HZ3  LYS  26          3HZ       LYS  26  12.916  -2.026   0.185
  202    H    ASP  27           H        ASP  27   7.372  -4.653   1.251
  203    HA   ASP  27           HA       ASP  27   7.917  -4.813   4.038
  204    HB2  ASP  27          2HB       ASP  27   6.206  -2.896   2.474
  205    HB3  ASP  27          1HB       ASP  27   6.744  -2.707   4.132
  206    H    LYS  28           H        LYS  28   5.126  -5.541   1.951
  207    HA   LYS  28           HA       LYS  28   3.282  -6.523   2.254
  208    HB2  LYS  28          2HB       LYS  28   4.328  -7.214   5.009
  209    HB3  LYS  28          1HB       LYS  28   2.903  -7.880   4.186
  210    HG2  LYS  28          2HG       LYS  28   4.177  -8.945   2.538
  211    HG3  LYS  28          1HG       LYS  28   5.617  -8.016   2.938
  212    HD2  LYS  28          2HD       LYS  28   5.782  -9.197   5.066
  213    HD3  LYS  28          1HD       LYS  28   4.330 -10.118   4.673
  214    HE2  LYS  28          2HE       LYS  28   6.391 -11.400   4.212
  215    HE3  LYS  28          1HE       LYS  28   5.444 -11.114   2.755
  216    HZ1  LYS  28          1HZ       LYS  28   7.861 -10.764   2.469
  217    HZ2  LYS  28          2HZ       LYS  28   7.801  -9.438   3.517
  218    HZ3  LYS  28          3HZ       LYS  28   6.939  -9.429   2.065
  219    H    TRP  29           H        TRP  29   3.650  -3.763   2.853
  220    HA   TRP  29           HA       TRP  29   0.977  -3.357   3.864
  221    HB2  TRP  29          2HB       TRP  29   1.598  -1.362   5.190
  222    HB3  TRP  29          1HB       TRP  29   2.395  -2.783   5.824
  223    HD1  TRP  29           HD       TRP  29   3.374   0.112   3.378
  224    HE1  TRP  29          1HE       TRP  29   5.775   0.853   3.951
  225    HE3  TRP  29          3HE       TRP  29   4.364  -3.166   7.144
  226    HZ2  TRP  29          2HZ       TRP  29   7.805   0.154   5.752
  227    HZ3  TRP  29          3HZ       TRP  29   6.552  -3.060   8.262
  228    HH2  TRP  29           HH       TRP  29   8.240  -1.423   7.571
  229    H    CYS  30           H        CYS  30   0.184  -1.070   3.162
  230    HA   CYS  30           HA       CYS  30   0.839  -0.652   0.474
  231    HB2  CYS  30          2HB       CYS  30  -0.702   0.945   2.523
  232    HB3  CYS  30          1HB       CYS  30  -0.624   1.320   0.808
  233    H    LYS  31           H        LYS  31   2.490   0.490  -0.250
  234    HA   LYS  31           HA       LYS  31   3.805   2.428   1.529
  235    HB2  LYS  31          2HB       LYS  31   4.893   0.007   1.148
  236    HB3  LYS  31          1HB       LYS  31   5.262   0.761  -0.408
  237    HG2  LYS  31          2HG       LYS  31   6.579   2.415   0.563
  238    HG3  LYS  31          1HG       LYS  31   6.145   1.907   2.209
  239    HD2  LYS  31          2HD       LYS  31   7.192  -0.264   1.756
  240    HD3  LYS  31          1HD       LYS  31   7.625   0.300   0.144
  241    HE2  LYS  31          2HE       LYS  31   8.587   1.470   2.756
  242    HE3  LYS  31          1HE       LYS  31   9.498   0.430   1.668
  243    HZ1  LYS  31          1HZ       LYS  31   9.399   2.101  -0.027
  244    HZ2  LYS  31          2HZ       LYS  31  10.048   2.776   1.372
  245    HZ3  LYS  31          3HZ       LYS  31   8.461   3.106   0.950
  246    H    TYR  32           H        TYR  32   5.473   3.574  -0.124
  247    HA   TYR  32           HA       TYR  32   3.743   4.523  -2.281
  248    HB2  TYR  32          2HB       TYR  32   5.000   6.089  -0.635
  249    HB3  TYR  32          1HB       TYR  32   6.433   5.617  -1.510
  250    HD1  TYR  32          1HD       TYR  32   3.294   7.503  -1.755
  251    HD2  TYR  32          2HD       TYR  32   6.865   6.392  -3.757
  252    HE1  TYR  32          1HE       TYR  32   2.864   9.206  -3.456
  253    HE2  TYR  32          2HE       TYR  32   6.449   8.080  -5.457
  254    HH   TYR  32           HH       TYR  32   4.564   9.281  -6.384
  255    H    GLN  33           H        GLN  33   4.263   4.173  -4.356
  256    HA   GLN  33           HA       GLN  33   6.487   2.380  -4.796
  257    HB2  GLN  33          2HB       GLN  33   4.244   1.937  -5.753
  258    HB3  GLN  33          1HB       GLN  33   4.469   3.381  -6.746
  259    HG2  GLN  33          2HG       GLN  33   6.260   2.369  -7.959
  260    HG3  GLN  33          1HG       GLN  33   6.315   1.009  -6.842
  261   HE21  GLN  33          1HE2      GLN  33   4.544   2.485  -9.443
  262   HE22  GLN  33          2HE2      GLN  33   3.606   1.093  -9.843
  263    H    ILE  34           H        ILE  34   7.544   4.277  -4.054
  264    HA   ILE  34           HA       ILE  34   8.293   6.451  -5.648
  265    HB   ILE  34           HB       ILE  34   8.947   6.504  -3.356
  266   HG12  ILE  34          2HG1      ILE  34  11.399   6.986  -3.421
  267   HG13  ILE  34          1HG1      ILE  34  11.454   6.296  -5.036
  268   HG21  ILE  34          1HG2      ILE  34  10.564   5.029  -2.312
  269   HG22  ILE  34          2HG2      ILE  34  10.645   4.079  -3.795
  270   HG23  ILE  34          3HG2      ILE  34   9.132   4.176  -2.888
  271   HD11  ILE  34          1HD1      ILE  34  11.390   8.726  -5.079
  272   HD12  ILE  34          2HD1      ILE  34   9.850   8.700  -4.214
  273   HD13  ILE  34          3HD1      ILE  34   9.963   8.026  -5.839
  Start of MODEL    8
    1    H1   ASP   1          1HT       ASP   1 -13.127   6.997   1.002
    2    H2   ASP   1          2HT       ASP   1 -12.597   7.368  -0.538
    3    H3   ASP   1          3HT       ASP   1 -13.223   8.598   0.429
    4    HA   ASP   1           HA       ASP   1 -10.839   8.726   0.293
    5    HB2  ASP   1          2HB       ASP   1 -11.801   7.663   2.960
    6    HB3  ASP   1          1HB       ASP   1 -10.239   8.414   2.704
    7    H    CYS   2           H        CYS   2  -8.796   7.660   1.036
    8    HA   CYS   2           HA       CYS   2  -8.996   4.769   0.824
    9    HB2  CYS   2          2HB       CYS   2  -6.814   4.986  -0.498
   10    HB3  CYS   2          1HB       CYS   2  -8.345   5.203  -1.318
   11    H    LEU   3           H        LEU   3  -6.982   3.700   1.377
   12    HA   LEU   3           HA       LEU   3  -6.025   4.638   3.893
   13    HB2  LEU   3          2HB       LEU   3  -5.410   2.197   2.244
   14    HB3  LEU   3          1HB       LEU   3  -4.765   2.516   3.831
   15    HG   LEU   3           HG       LEU   3  -7.689   2.120   3.194
   16   HD11  LEU   3          1HD1      LEU   3  -6.404   0.066   2.904
   17   HD12  LEU   3          2HD1      LEU   3  -7.425  -0.029   4.337
   18   HD13  LEU   3          3HD1      LEU   3  -5.697   0.272   4.507
   19   HD21  LEU   3          1HD2      LEU   3  -6.244   2.381   5.834
   20   HD22  LEU   3          2HD2      LEU   3  -7.947   1.975   5.630
   21   HD23  LEU   3          3HD2      LEU   3  -7.359   3.559   5.134
   22    H    GLY   4           H        GLY   4  -3.985   5.167   4.352
   23    HA2  GLY   4          2HA       GLY   4  -2.426   6.213   2.149
   24    HA3  GLY   4          1HA       GLY   4  -2.219   6.579   3.861
   25    H    PHE   5           H        PHE   5   0.073   6.227   3.140
   26    HA   PHE   5           HA       PHE   5   0.816   3.518   2.686
   27    HB2  PHE   5          2HB       PHE   5   3.153   4.531   2.790
   28    HB3  PHE   5          1HB       PHE   5   2.130   5.116   1.492
   29    HD1  PHE   5          1HD       PHE   5   1.077   7.412   1.708
   30    HD2  PHE   5          2HD       PHE   5   4.055   5.995   4.400
   31    HE1  PHE   5          1HE       PHE   5   1.508   9.705   2.432
   32    HE2  PHE   5          2HE       PHE   5   4.473   8.288   5.135
   33    HZ   PHE   5           HZ       PHE   5   3.203  10.153   4.150
   34    H    LEU   6           H        LEU   6   2.389   2.519   4.085
   35    HA   LEU   6           HA       LEU   6   3.322   1.816   5.994
   36    HB2  LEU   6          2HB       LEU   6   1.902   3.974   7.495
   37    HB3  LEU   6          1HB       LEU   6   3.318   3.060   8.025
   38    HG   LEU   6           HG       LEU   6   3.163   5.163   5.887
   39   HD11  LEU   6          1HD1      LEU   6   4.530   5.188   8.578
   40   HD12  LEU   6          2HD1      LEU   6   3.097   6.100   8.111
   41   HD13  LEU   6          3HD1      LEU   6   4.653   6.463   7.366
   42   HD21  LEU   6          1HD2      LEU   6   4.783   3.492   5.212
   43   HD22  LEU   6          2HD2      LEU   6   5.553   3.556   6.794
   44   HD23  LEU   6          3HD2      LEU   6   5.637   4.951   5.719
   45    H    TRP   7           H        TRP   7   0.045   2.128   5.350
   46    HA   TRP   7           HA       TRP   7  -0.906   0.758   7.688
   47    HB2  TRP   7          2HB       TRP   7  -2.221   1.899   5.240
   48    HB3  TRP   7          1HB       TRP   7  -3.078   0.997   6.470
   49    HD1  TRP   7           HD       TRP   7  -1.118   4.285   6.057
   50    HE1  TRP   7          1HE       TRP   7  -1.892   5.948   7.836
   51    HE3  TRP   7          3HE       TRP   7  -4.275   1.226   8.631
   52    HZ2  TRP   7          2HZ       TRP   7  -3.660   5.958  10.060
   53    HZ3  TRP   7          3HZ       TRP   7  -5.480   2.144  10.570
   54    HH2  TRP   7           HH       TRP   7  -5.175   4.454  11.265
   55    H    LYS   8           H        LYS   8  -1.870  -1.229   7.581
   56    HA   LYS   8           HA       LYS   8  -0.607  -3.122   5.942
   57    HB2  LYS   8          2HB       LYS   8  -1.500  -3.584   8.209
   58    HB3  LYS   8          1HB       LYS   8  -3.132  -3.415   7.588
   59    HG2  LYS   8          2HG       LYS   8  -2.572  -5.740   7.810
   60    HG3  LYS   8          1HG       LYS   8  -2.737  -5.319   6.101
   61    HD2  LYS   8          2HD       LYS   8  -0.328  -5.163   5.871
   62    HD3  LYS   8          1HD       LYS   8  -0.115  -5.486   7.588
   63    HE2  LYS   8          2HE       LYS   8  -1.327  -7.357   5.573
   64    HE3  LYS   8          1HE       LYS   8   0.327  -7.439   6.170
   65    HZ1  LYS   8          1HZ       LYS   8  -0.688  -7.729   8.452
   66    HZ2  LYS   8          2HZ       LYS   8  -0.865  -8.979   7.388
   67    HZ3  LYS   8          3HZ       LYS   8  -2.181  -7.970   7.683
   68    H    CYS   9           H        CYS   9  -1.103  -3.732   3.939
   69    HA   CYS   9           HA       CYS   9  -3.581  -2.732   2.806
   70    HB2  CYS   9          2HB       CYS   9  -2.493  -3.092   0.675
   71    HB3  CYS   9          1HB       CYS   9  -1.510  -2.103   1.759
   72    H    ASN  10           H        ASN  10  -4.420  -4.198   1.034
   73    HA   ASN  10           HA       ASN  10  -4.085  -7.017   1.567
   74    HB2  ASN  10          2HB       ASN  10  -6.066  -6.204   2.899
   75    HB3  ASN  10          1HB       ASN  10  -6.776  -5.612   1.405
   76   HD21  ASN  10          1HD2      ASN  10  -7.824  -7.521   3.243
   77   HD22  ASN  10          2HD2      ASN  10  -8.058  -8.993   2.369
   78    HA   PRO  11           HA       PRO  11  -3.785  -6.192  -2.865
   79    HB2  PRO  11          2HB       PRO  11  -3.703  -9.129  -3.089
   80    HB3  PRO  11          1HB       PRO  11  -2.515  -7.935  -3.622
   81    HG2  PRO  11          2HG       PRO  11  -2.044  -9.513  -1.512
   82    HG3  PRO  11          1HG       PRO  11  -1.501  -7.826  -1.547
   83    HD2  PRO  11          2HD       PRO  11  -3.846  -9.034  -0.141
   84    HD3  PRO  11          1HD       PRO  11  -2.692  -7.794   0.410
   85    H    SER  12           H        SER  12  -6.067  -8.324  -1.311
   86    HA   SER  12           HA       SER  12  -7.610  -8.806  -3.700
   87    HB2  SER  12          2HB       SER  12  -8.000  -9.632  -0.854
   88    HB3  SER  12          1HB       SER  12  -8.754 -10.289  -2.307
   89    HG   SER  12           HG       SER  12  -6.451 -10.700  -2.955
   90    H    ASN  13           H        ASN  13  -7.339  -6.478  -1.387
   91    HA   ASN  13           HA       ASN  13  -9.886  -5.314  -1.865
   92    HB2  ASN  13          2HB       ASN  13 -10.400  -7.005  -0.085
   93    HB3  ASN  13          1HB       ASN  13  -9.254  -6.198   0.965
   94   HD21  ASN  13          1HD2      ASN  13 -10.820  -5.667   2.483
   95   HD22  ASN  13          2HD2      ASN  13 -11.984  -4.427   2.227
   96    H    ASP  14           H        ASP  14  -8.117  -4.142  -2.660
   97    HA   ASP  14           HA       ASP  14  -6.336  -2.868  -0.793
   98    HB2  ASP  14          2HB       ASP  14  -5.582  -3.816  -2.904
   99    HB3  ASP  14          1HB       ASP  14  -6.537  -2.631  -3.788
  100    H    LYS  15           H        LYS  15  -6.835  -1.075   0.027
  101    HA   LYS  15           HA       LYS  15  -8.910   0.519  -1.207
  102    HB2  LYS  15          2HB       LYS  15  -8.825  -0.887   1.139
  103    HB3  LYS  15          1HB       LYS  15  -8.631   0.799   1.655
  104    HG2  LYS  15          2HG       LYS  15 -10.885  -0.491   0.131
  105    HG3  LYS  15          1HG       LYS  15 -10.941   0.269   1.723
  106    HD2  LYS  15          2HD       LYS  15 -10.371   2.425   0.639
  107    HD3  LYS  15          1HD       LYS  15 -10.487   1.619  -0.919
  108    HE2  LYS  15          2HE       LYS  15 -12.709   1.919   1.100
  109    HE3  LYS  15          1HE       LYS  15 -12.577   2.768  -0.436
  110    HZ1  LYS  15          1HZ       LYS  15 -12.794   0.642  -1.583
  111    HZ2  LYS  15          2HZ       LYS  15 -14.108   0.894  -0.563
  112    HZ3  LYS  15          3HZ       LYS  15 -12.899  -0.171  -0.112
  113    H    CYS  16           H        CYS  16  -5.821   0.518  -1.246
  114    HA   CYS  16           HA       CYS  16  -5.279   2.862   0.311
  115    HB2  CYS  16          2HB       CYS  16  -3.504   1.122  -1.378
  116    HB3  CYS  16          1HB       CYS  16  -2.946   2.576  -0.558
  117    H    CYS  17           H        CYS  17  -4.133   4.661  -0.676
  118    HA   CYS  17           HA       CYS  17  -5.539   5.651  -2.925
  119    HB2  CYS  17          2HB       CYS  17  -3.114   6.699  -1.519
  120    HB3  CYS  17          1HB       CYS  17  -4.094   7.632  -2.641
  121    H    ARG  18           H        ARG  18  -4.885   3.846  -4.328
  122    HA   ARG  18           HA       ARG  18  -2.248   3.930  -5.354
  123    HB2  ARG  18          2HB       ARG  18  -3.089   2.059  -6.796
  124    HB3  ARG  18          1HB       ARG  18  -3.256   1.785  -5.070
  125    HG2  ARG  18          2HG       ARG  18  -5.659   2.584  -5.333
  126    HG3  ARG  18          1HG       ARG  18  -5.394   2.432  -7.071
  127    HD2  ARG  18          2HD       ARG  18  -4.704   0.082  -6.699
  128    HD3  ARG  18          1HD       ARG  18  -5.106   0.320  -4.995
  129    HE   ARG  18           HE       ARG  18  -7.340   1.046  -6.383
  130   HH11  ARG  18          1HH1      ARG  18  -5.471  -1.959  -6.061
  131   HH12  ARG  18          2HH1      ARG  18  -6.822  -2.969  -6.303
  132   HH21  ARG  18          1HH2      ARG  18  -9.151  -0.329  -6.721
  133   HH22  ARG  18          2HH2      ARG  18  -8.984  -2.017  -6.715
  134    HA   PRO  19           HA       PRO  19  -1.406   3.236  -7.470
  135    HB2  PRO  19          2HB       PRO  19   0.082   4.232  -9.358
  136    HB3  PRO  19          1HB       PRO  19  -1.532   3.543  -9.683
  137    HG2  PRO  19          2HG       PRO  19  -0.771   6.430  -9.450
  138    HG3  PRO  19          1HG       PRO  19  -1.713   5.635 -10.727
  139    HD2  PRO  19          2HD       PRO  19  -2.805   6.916  -8.537
  140    HD3  PRO  19          1HD       PRO  19  -3.628   5.657  -9.480
  141    H    ASN  20           H        ASN  20  -1.503   6.331  -6.480
  142    HA   ASN  20           HA       ASN  20   1.191   7.129  -6.206
  143    HB2  ASN  20          2HB       ASN  20  -0.671   8.682  -5.643
  144    HB3  ASN  20          1HB       ASN  20  -0.988   7.747  -4.191
  145   HD21  ASN  20          1HD2      ASN  20   2.289   8.400  -5.331
  146   HD22  ASN  20          2HD2      ASN  20   2.693   9.481  -4.057
  147    H    LEU  21           H        LEU  21  -0.773   5.364  -3.784
  148    HA   LEU  21           HA       LEU  21   1.741   4.275  -2.824
  149    HB2  LEU  21          2HB       LEU  21  -0.889   4.378  -1.418
  150    HB3  LEU  21          1HB       LEU  21   0.579   3.717  -0.811
  151    HG   LEU  21           HG       LEU  21   0.442   5.694   0.367
  152   HD11  LEU  21          1HD1      LEU  21   2.178   6.393  -1.963
  153   HD12  LEU  21          2HD1      LEU  21   2.636   5.463  -0.539
  154   HD13  LEU  21          3HD1      LEU  21   2.213   7.169  -0.379
  155   HD21  LEU  21          1HD2      LEU  21  -0.050   7.920  -0.631
  156   HD22  LEU  21          2HD2      LEU  21  -1.377   6.775  -0.667
  157   HD23  LEU  21          3HD2      LEU  21  -0.453   7.094  -2.144
  158    H    VAL  22           H        VAL  22   1.762   2.225  -2.546
  159    HA   VAL  22           HA       VAL  22  -0.278   0.614  -3.948
  160    HB   VAL  22           HB       VAL  22   2.640   0.249  -4.352
  161   HG11  VAL  22          1HG1      VAL  22   0.315  -0.988  -5.819
  162   HG12  VAL  22          2HG1      VAL  22   1.415  -1.797  -4.704
  163   HG13  VAL  22          3HG1      VAL  22   2.009  -1.214  -6.260
  164   HG21  VAL  22          1HG2      VAL  22   2.064   2.348  -5.400
  165   HG22  VAL  22          2HG2      VAL  22   0.717   1.592  -6.248
  166   HG23  VAL  22          3HG2      VAL  22   2.375   1.148  -6.654
  167    H    CYS  23           H        CYS  23  -0.564  -1.375  -3.138
  168    HA   CYS  23           HA       CYS  23   0.473  -2.059  -0.581
  169    HB2  CYS  23          2HB       CYS  23  -1.715  -2.810  -1.241
  170    HB3  CYS  23          1HB       CYS  23  -1.022  -3.680  -2.617
  171    H    SER  24           H        SER  24   2.312  -2.792  -0.221
  172    HA   SER  24           HA       SER  24   4.056  -3.724  -2.310
  173    HB2  SER  24          2HB       SER  24   4.891  -2.107  -0.650
  174    HB3  SER  24          1HB       SER  24   4.493  -3.227   0.651
  175    HG   SER  24           HG       SER  24   6.736  -3.226   0.050
  176    H    ARG  25           H        ARG  25   4.212  -5.881  -2.772
  177    HA   ARG  25           HA       ARG  25   3.034  -7.801  -1.115
  178    HB2  ARG  25          2HB       ARG  25   3.935  -9.343  -2.838
  179    HB3  ARG  25          1HB       ARG  25   2.933  -8.050  -3.479
  180    HG2  ARG  25          2HG       ARG  25   4.718  -8.350  -5.012
  181    HG3  ARG  25          1HG       ARG  25   5.083  -6.879  -4.124
  182    HD2  ARG  25          2HD       ARG  25   6.595  -8.239  -2.661
  183    HD3  ARG  25          1HD       ARG  25   6.299  -9.612  -3.727
  184    HE   ARG  25           HE       ARG  25   7.108  -7.814  -5.463
  185   HH11  ARG  25          1HH1      ARG  25   8.566  -8.890  -2.401
  186   HH12  ARG  25          2HH1      ARG  25  10.111  -8.302  -2.768
  187   HH21  ARG  25          1HH2      ARG  25   9.271  -7.069  -5.980
  188   HH22  ARG  25          2HH2      ARG  25  10.516  -7.255  -4.831
  189    H    LYS  26           H        LYS  26   5.916  -6.229  -1.095
  190    HA   LYS  26           HA       LYS  26   7.586  -8.280   0.083
  191    HB2  LYS  26          2HB       LYS  26   8.482  -6.551  -1.430
  192    HB3  LYS  26          1HB       LYS  26   7.951  -5.320  -0.323
  193    HG2  LYS  26          2HG       LYS  26   9.515  -6.088   1.366
  194    HG3  LYS  26          1HG       LYS  26  10.061  -7.379   0.293
  195    HD2  LYS  26          2HD       LYS  26  10.846  -5.754  -1.320
  196    HD3  LYS  26          1HD       LYS  26  10.212  -4.436  -0.340
  197    HE2  LYS  26          2HE       LYS  26  12.601  -4.620  -0.024
  198    HE3  LYS  26          1HE       LYS  26  11.756  -5.056   1.457
  199    HZ1  LYS  26          1HZ       LYS  26  12.088  -7.408   0.874
  200    HZ2  LYS  26          2HZ       LYS  26  13.528  -6.582   1.061
  201    HZ3  LYS  26          3HZ       LYS  26  12.984  -6.950  -0.488
  202    H    ASP  27           H        ASP  27   6.522  -5.046   1.039
  203    HA   ASP  27           HA       ASP  27   7.163  -5.414   3.790
  204    HB2  ASP  27          2HB       ASP  27   5.699  -3.192   2.391
  205    HB3  ASP  27          1HB       ASP  27   6.355  -3.156   4.015
  206    H    LYS  28           H        LYS  28   4.263  -5.687   1.846
  207    HA   LYS  28           HA       LYS  28   2.286  -6.202   2.122
  208    HB2  LYS  28          2HB       LYS  28   2.983  -7.178   4.898
  209    HB3  LYS  28          1HB       LYS  28   1.475  -7.419   4.002
  210    HG2  LYS  28          2HG       LYS  28   2.811  -8.532   2.193
  211    HG3  LYS  28          1HG       LYS  28   4.192  -8.495   3.283
  212    HD2  LYS  28          2HD       LYS  28   3.157 -10.675   3.400
  213    HD3  LYS  28          1HD       LYS  28   2.862  -9.832   4.920
  214    HE2  LYS  28          2HE       LYS  28   0.603  -9.280   4.228
  215    HE3  LYS  28          1HE       LYS  28   0.891  -9.954   2.626
  216    HZ1  LYS  28          1HZ       LYS  28   1.103 -12.145   3.637
  217    HZ2  LYS  28          2HZ       LYS  28  -0.376 -11.448   4.044
  218    HZ3  LYS  28          3HZ       LYS  28   0.859 -11.489   5.176
  219    H    TRP  29           H        TRP  29   3.360  -3.623   3.080
  220    HA   TRP  29           HA       TRP  29   0.720  -2.689   3.905
  221    HB2  TRP  29          2HB       TRP  29   1.727  -0.818   5.142
  222    HB3  TRP  29          1HB       TRP  29   2.251  -2.341   5.826
  223    HD1  TRP  29           HD       TRP  29   3.663   0.327   3.356
  224    HE1  TRP  29          1HE       TRP  29   6.169   0.572   3.811
  225    HE3  TRP  29          3HE       TRP  29   4.152  -3.225   6.990
  226    HZ2  TRP  29          2HZ       TRP  29   8.110  -0.595   5.515
  227    HZ3  TRP  29          3HZ       TRP  29   6.373  -3.583   7.993
  228    HH2  TRP  29           HH       TRP  29   8.303  -2.291   7.263
  229    H    CYS  30           H        CYS  30   0.301  -0.427   3.099
  230    HA   CYS  30           HA       CYS  30   1.173  -0.319   0.429
  231    HB2  CYS  30          2HB       CYS  30  -0.619   1.343   2.160
  232    HB3  CYS  30          1HB       CYS  30  -0.200   1.813   0.517
  233    H    LYS  31           H        LYS  31   2.676   0.898  -0.409
  234    HA   LYS  31           HA       LYS  31   4.149   2.733   1.351
  235    HB2  LYS  31          2HB       LYS  31   5.035   0.198   0.774
  236    HB3  LYS  31          1HB       LYS  31   5.605   1.096  -0.620
  237    HG2  LYS  31          2HG       LYS  31   6.930   2.539   0.766
  238    HG3  LYS  31          1HG       LYS  31   6.328   1.731   2.222
  239    HD2  LYS  31          2HD       LYS  31   7.217  -0.425   1.256
  240    HD3  LYS  31          1HD       LYS  31   7.996   0.542   0.010
  241    HE2  LYS  31          2HE       LYS  31   8.476   0.755   2.976
  242    HE3  LYS  31          1HE       LYS  31   9.529  -0.058   1.835
  243    HZ1  LYS  31          1HZ       LYS  31   8.920   2.854   1.843
  244    HZ2  LYS  31          2HZ       LYS  31   9.929   2.072   0.746
  245    HZ3  LYS  31          3HZ       LYS  31  10.335   2.121   2.374
  246    H    TYR  32           H        TYR  32   5.749   3.837  -0.300
  247    HA   TYR  32           HA       TYR  32   4.215   5.306  -2.201
  248    HB2  TYR  32          2HB       TYR  32   6.420   5.949  -0.993
  249    HB3  TYR  32          1HB       TYR  32   7.200   5.005  -2.218
  250    HD1  TYR  32          1HD       TYR  32   7.674   5.885  -4.380
  251    HD2  TYR  32          2HD       TYR  32   5.089   8.007  -1.754
  252    HE1  TYR  32          1HE       TYR  32   7.752   7.809  -5.879
  253    HE2  TYR  32          2HE       TYR  32   5.154   9.932  -3.242
  254    HH   TYR  32           HH       TYR  32   6.394   9.787  -6.408
  255    H    GLN  33           H        GLN  33   4.399   5.245  -4.528
  256    HA   GLN  33           HA       GLN  33   5.032   2.667  -5.610
  257    HB2  GLN  33          2HB       GLN  33   3.242   4.140  -6.517
  258    HB3  GLN  33          1HB       GLN  33   4.532   5.215  -7.075
  259    HG2  GLN  33          2HG       GLN  33   5.434   3.325  -8.436
  260    HG3  GLN  33          1HG       GLN  33   4.011   2.388  -7.997
  261   HE21  GLN  33          1HE2      GLN  33   2.254   4.734  -8.146
  262   HE22  GLN  33          2HE2      GLN  33   2.078   5.076  -9.822
  263    H    ILE  34           H        ILE  34   7.049   3.041  -4.564
  264    HA   ILE  34           HA       ILE  34   9.261   4.450  -5.491
  265    HB   ILE  34           HB       ILE  34   9.271   1.566  -4.548
  266   HG12  ILE  34          2HG1      ILE  34   8.224   3.107  -2.917
  267   HG13  ILE  34          1HG1      ILE  34   9.729   2.435  -2.315
  268   HG21  ILE  34          1HG2      ILE  34  11.535   3.557  -4.617
  269   HG22  ILE  34          2HG2      ILE  34  11.344   2.155  -5.666
  270   HG23  ILE  34          3HG2      ILE  34  11.604   1.927  -3.937
  271   HD11  ILE  34          1HD1      ILE  34   9.496   4.791  -1.748
  272   HD12  ILE  34          2HD1      ILE  34   9.379   5.205  -3.458
  273   HD13  ILE  34          3HD1      ILE  34  10.871   4.522  -2.814
  Start of MODEL    9
    1    H1   ASP   1          1HT       ASP   1  -9.900   9.707   2.296
    2    H2   ASP   1          2HT       ASP   1 -11.113  10.404   1.382
    3    H3   ASP   1          3HT       ASP   1  -9.507  10.370   0.807
    4    HA   ASP   1           HA       ASP   1 -11.234   8.032   1.325
    5    HB2  ASP   1          2HB       ASP   1 -11.872   9.254  -0.720
    6    HB3  ASP   1          1HB       ASP   1 -10.226   9.128  -1.350
    7    H    CYS   2           H        CYS   2 -10.227   6.145   0.223
    8    HA   CYS   2           HA       CYS   2  -8.895   4.519   0.353
    9    HB2  CYS   2          2HB       CYS   2  -6.741   4.607  -0.519
   10    HB3  CYS   2          1HB       CYS   2  -7.802   5.513  -1.533
   11    H    LEU   3           H        LEU   3  -6.899   3.571   1.111
   12    HA   LEU   3           HA       LEU   3  -6.778   3.980   3.947
   13    HB2  LEU   3          2HB       LEU   3  -5.395   2.028   2.121
   14    HB3  LEU   3          1HB       LEU   3  -5.398   1.978   3.866
   15    HG   LEU   3           HG       LEU   3  -7.825   1.610   2.107
   16   HD11  LEU   3          1HD1      LEU   3  -6.214  -0.409   3.658
   17   HD12  LEU   3          2HD1      LEU   3  -6.280  -0.251   1.902
   18   HD13  LEU   3          3HD1      LEU   3  -7.719  -0.733   2.799
   19   HD21  LEU   3          1HD2      LEU   3  -8.387   2.566   4.287
   20   HD22  LEU   3          2HD2      LEU   3  -7.499   1.274   5.092
   21   HD23  LEU   3          3HD2      LEU   3  -8.951   0.902   4.162
   22    H    GLY   4           H        GLY   4  -4.651   4.140   4.991
   23    HA2  GLY   4          2HA       GLY   4  -3.015   6.070   3.567
   24    HA3  GLY   4          1HA       GLY   4  -2.933   5.701   5.287
   25    H    PHE   5           H        PHE   5  -0.555   5.830   4.504
   26    HA   PHE   5           HA       PHE   5   0.193   3.265   3.439
   27    HB2  PHE   5          2HB       PHE   5   2.435   4.386   2.988
   28    HB3  PHE   5          1HB       PHE   5   1.094   4.950   2.014
   29    HD1  PHE   5          1HD       PHE   5   3.578   5.842   4.525
   30    HD2  PHE   5          2HD       PHE   5   0.170   7.209   2.369
   31    HE1  PHE   5          1HE       PHE   5   4.110   8.161   5.151
   32    HE2  PHE   5          2HE       PHE   5   0.700   9.521   2.987
   33    HZ   PHE   5           HZ       PHE   5   2.670  10.005   4.378
   34    H    LEU   6           H        LEU   6   2.098   2.327   4.338
   35    HA   LEU   6           HA       LEU   6   3.378   1.490   5.954
   36    HB2  LEU   6          2HB       LEU   6   2.306   3.546   7.841
   37    HB3  LEU   6          1HB       LEU   6   3.780   2.597   8.052
   38    HG   LEU   6           HG       LEU   6   3.242   4.813   6.117
   39   HD11  LEU   6          1HD1      LEU   6   5.101   4.663   8.491
   40   HD12  LEU   6          2HD1      LEU   6   3.614   5.605   8.369
   41   HD13  LEU   6          3HD1      LEU   6   5.008   6.021   7.369
   42   HD21  LEU   6          1HD2      LEU   6   4.701   3.187   5.044
   43   HD22  LEU   6          2HD2      LEU   6   5.769   3.173   6.447
   44   HD23  LEU   6          3HD2      LEU   6   5.637   4.625   5.453
   45    H    TRP   7           H        TRP   7   0.198   1.400   5.645
   46    HA   TRP   7           HA       TRP   7  -0.325  -0.128   8.025
   47    HB2  TRP   7          2HB       TRP   7  -2.103   1.153   5.984
   48    HB3  TRP   7          1HB       TRP   7  -2.665   0.093   7.256
   49    HD1  TRP   7           HD       TRP   7  -1.156   3.511   6.697
   50    HE1  TRP   7          1HE       TRP   7  -1.646   5.017   8.721
   51    HE3  TRP   7          3HE       TRP   7  -3.206   0.011   9.739
   52    HZ2  TRP   7          2HZ       TRP   7  -2.786   4.720  11.320
   53    HZ3  TRP   7          3HZ       TRP   7  -3.974   0.675  11.977
   54    HH2  TRP   7           HH       TRP   7  -3.766   2.985  12.749
   55    H    LYS   8           H        LYS   8  -1.119  -2.238   7.680
   56    HA   LYS   8           HA       LYS   8  -0.049  -3.482   5.402
   57    HB2  LYS   8          2HB       LYS   8  -0.128  -4.643   7.551
   58    HB3  LYS   8          1HB       LYS   8  -1.886  -4.689   7.470
   59    HG2  LYS   8          2HG       LYS   8  -1.820  -6.100   5.520
   60    HG3  LYS   8          1HG       LYS   8  -0.067  -5.966   5.440
   61    HD2  LYS   8          2HD       LYS   8  -1.607  -7.214   7.710
   62    HD3  LYS   8          1HD       LYS   8  -0.844  -8.118   6.400
   63    HE2  LYS   8          2HE       LYS   8   0.542  -6.377   8.450
   64    HE3  LYS   8          1HE       LYS   8   0.547  -8.132   8.374
   65    HZ1  LYS   8          1HZ       LYS   8   1.743  -6.346   6.295
   66    HZ2  LYS   8          2HZ       LYS   8   1.733  -8.032   6.290
   67    HZ3  LYS   8          3HZ       LYS   8   2.577  -7.217   7.477
   68    H    CYS   9           H        CYS   9  -0.859  -3.944   3.547
   69    HA   CYS   9           HA       CYS   9  -3.476  -2.997   2.887
   70    HB2  CYS   9          2HB       CYS   9  -2.635  -3.527   0.587
   71    HB3  CYS   9          1HB       CYS   9  -1.693  -2.343   1.493
   72    H    ASN  10           H        ASN  10  -4.915  -4.294   1.627
   73    HA   ASN  10           HA       ASN  10  -4.711  -7.159   2.199
   74    HB2  ASN  10          2HB       ASN  10  -6.578  -5.867   3.318
   75    HB3  ASN  10          1HB       ASN  10  -7.163  -5.481   1.708
   76   HD21  ASN  10          1HD2      ASN  10  -8.386  -7.054   3.936
   77   HD22  ASN  10          2HD2      ASN  10  -8.771  -8.592   3.249
   78    HA   PRO  11           HA       PRO  11  -4.352  -7.096  -2.290
   79    HB2  PRO  11          2HB       PRO  11  -4.355  -9.807  -2.669
   80    HB3  PRO  11          1HB       PRO  11  -2.929  -8.891  -2.180
   81    HG2  PRO  11          2HG       PRO  11  -4.831 -10.462  -0.486
   82    HG3  PRO  11          1HG       PRO  11  -3.060 -10.399  -0.405
   83    HD2  PRO  11          2HD       PRO  11  -4.628  -9.036   1.301
   84    HD3  PRO  11          1HD       PRO  11  -3.071  -8.384   0.743
   85    H    SER  12           H        SER  12  -6.930  -8.565  -0.446
   86    HA   SER  12           HA       SER  12  -8.559  -9.035  -2.783
   87    HB2  SER  12          2HB       SER  12  -8.943  -9.540   0.138
   88    HB3  SER  12          1HB       SER  12 -10.019 -10.035  -1.167
   89    HG   SER  12           HG       SER  12  -7.584 -10.829  -1.802
   90    H    ASN  13           H        ASN  13  -7.877  -6.515  -0.748
   91    HA   ASN  13           HA       ASN  13 -10.268  -5.085  -1.376
   92    HB2  ASN  13          2HB       ASN  13 -10.909  -6.333   0.698
   93    HB3  ASN  13          1HB       ASN  13  -9.588  -5.555   1.546
   94   HD21  ASN  13          1HD2      ASN  13 -11.020  -4.594   3.017
   95   HD22  ASN  13          2HD2      ASN  13 -12.022  -3.249   2.615
   96    H    ASP  14           H        ASP  14  -8.294  -4.499  -2.440
   97    HA   ASP  14           HA       ASP  14  -6.357  -3.004  -0.947
   98    HB2  ASP  14          2HB       ASP  14  -5.791  -4.494  -2.786
   99    HB3  ASP  14          1HB       ASP  14  -6.711  -3.502  -3.901
  100    H    LYS  15           H        LYS  15  -7.058  -1.056  -0.304
  101    HA   LYS  15           HA       LYS  15  -8.400   0.526  -2.316
  102    HB2  LYS  15          2HB       LYS  15  -9.589  -0.453  -0.049
  103    HB3  LYS  15          1HB       LYS  15  -9.093   1.175   0.421
  104    HG2  LYS  15          2HG       LYS  15 -10.833   0.456  -1.945
  105    HG3  LYS  15          1HG       LYS  15 -11.365   1.238  -0.455
  106    HD2  LYS  15          2HD       LYS  15 -10.070   3.182  -0.930
  107    HD3  LYS  15          1HD       LYS  15  -9.274   2.377  -2.272
  108    HE2  LYS  15          2HE       LYS  15 -11.423   2.258  -3.467
  109    HE3  LYS  15          1HE       LYS  15 -12.209   3.068  -2.115
  110    HZ1  LYS  15          1HZ       LYS  15 -11.717   4.554  -3.953
  111    HZ2  LYS  15          2HZ       LYS  15 -10.069   4.270  -3.818
  112    HZ3  LYS  15          3HZ       LYS  15 -10.894   5.073  -2.588
  113    H    CYS  16           H        CYS  16  -5.674   0.348  -1.603
  114    HA   CYS  16           HA       CYS  16  -5.291   2.859  -0.286
  115    HB2  CYS  16          2HB       CYS  16  -3.247   0.882  -1.308
  116    HB3  CYS  16          1HB       CYS  16  -2.788   2.456  -0.664
  117    H    CYS  17           H        CYS  17  -4.159   4.680  -1.402
  118    HA   CYS  17           HA       CYS  17  -5.320   5.050  -3.934
  119    HB2  CYS  17          2HB       CYS  17  -3.542   6.716  -2.245
  120    HB3  CYS  17          1HB       CYS  17  -3.893   7.215  -3.888
  121    H    ARG  18           H        ARG  18  -4.397   3.330  -5.074
  122    HA   ARG  18           HA       ARG  18  -1.711   3.444  -5.892
  123    HB2  ARG  18          2HB       ARG  18  -2.400   1.615  -7.435
  124    HB3  ARG  18          1HB       ARG  18  -2.863   1.324  -5.766
  125    HG2  ARG  18          2HG       ARG  18  -5.139   2.260  -6.404
  126    HG3  ARG  18          1HG       ARG  18  -4.597   2.109  -8.075
  127    HD2  ARG  18          2HD       ARG  18  -4.173  -0.279  -7.702
  128    HD3  ARG  18          1HD       ARG  18  -4.744  -0.077  -6.038
  129    HE   ARG  18           HE       ARG  18  -6.445   0.470  -8.364
  130   HH11  ARG  18          1HH1      ARG  18  -6.022  -1.094  -5.154
  131   HH12  ARG  18          2HH1      ARG  18  -7.612  -1.631  -5.109
  132   HH21  ARG  18          1HH2      ARG  18  -8.639  -0.329  -8.227
  133   HH22  ARG  18          2HH2      ARG  18  -9.113  -1.217  -6.847
  134    HA   PRO  19           HA       PRO  19  -0.626   2.802  -7.702
  135    HB2  PRO  19          2HB       PRO  19   0.984   3.516  -9.607
  136    HB3  PRO  19          1HB       PRO  19  -0.618   2.797  -9.946
  137    HG2  PRO  19          2HG       PRO  19   0.219   5.666 -10.133
  138    HG3  PRO  19          1HG       PRO  19  -0.753   4.720 -11.272
  139    HD2  PRO  19          2HD       PRO  19  -1.744   6.379  -9.243
  140    HD3  PRO  19          1HD       PRO  19  -2.670   5.144 -10.116
  141    H    ASN  20           H        ASN  20  -0.888   5.813  -6.972
  142    HA   ASN  20           HA       ASN  20   1.793   6.756  -6.527
  143    HB2  ASN  20          2HB       ASN  20  -0.166   8.298  -6.484
  144    HB3  ASN  20          1HB       ASN  20  -0.668   7.579  -4.957
  145   HD21  ASN  20          1HD2      ASN  20   0.355   8.209  -3.073
  146   HD22  ASN  20          2HD2      ASN  20   1.562   9.439  -3.039
  147    H    LEU  21           H        LEU  21  -0.510   5.141  -4.404
  148    HA   LEU  21           HA       LEU  21   1.682   4.189  -2.684
  149    HB2  LEU  21          2HB       LEU  21  -1.287   4.289  -2.192
  150    HB3  LEU  21          1HB       LEU  21  -0.057   3.799  -1.073
  151    HG   LEU  21           HG       LEU  21  -0.527   6.621  -2.035
  152   HD11  LEU  21          1HD1      LEU  21  -2.243   5.843  -0.503
  153   HD12  LEU  21          2HD1      LEU  21  -1.211   7.042   0.275
  154   HD13  LEU  21          3HD1      LEU  21  -1.007   5.331   0.646
  155   HD21  LEU  21          1HD2      LEU  21   1.840   6.250  -1.613
  156   HD22  LEU  21          2HD2      LEU  21   1.473   5.542  -0.043
  157   HD23  LEU  21          3HD2      LEU  21   1.150   7.252  -0.336
  158    H    VAL  22           H        VAL  22   1.395   2.013  -2.197
  159    HA   VAL  22           HA       VAL  22  -0.361   0.490  -3.910
  160    HB   VAL  22           HB       VAL  22   1.476   1.040  -5.380
  161   HG11  VAL  22          1HG1      VAL  22   3.298   1.289  -3.820
  162   HG12  VAL  22          2HG1      VAL  22   3.746   0.123  -5.061
  163   HG13  VAL  22          3HG1      VAL  22   3.268  -0.438  -3.457
  164   HG21  VAL  22          1HG2      VAL  22   1.406  -1.895  -4.684
  165   HG22  VAL  22          2HG2      VAL  22   2.070  -1.239  -6.180
  166   HG23  VAL  22          3HG2      VAL  22   0.356  -1.050  -5.822
  167    H    CYS  23           H        CYS  23  -0.408  -1.666  -3.398
  168    HA   CYS  23           HA       CYS  23   0.365  -2.286  -0.685
  169    HB2  CYS  23          2HB       CYS  23  -1.765  -3.097  -1.520
  170    HB3  CYS  23          1HB       CYS  23  -0.906  -3.985  -2.797
  171    H    SER  24           H        SER  24   2.300  -2.539  -0.492
  172    HA   SER  24           HA       SER  24   4.058  -3.487  -2.539
  173    HB2  SER  24          2HB       SER  24   4.740  -1.650  -1.063
  174    HB3  SER  24          1HB       SER  24   4.563  -2.701   0.336
  175    HG   SER  24           HG       SER  24   6.735  -2.422  -0.415
  176    H    ARG  25           H        ARG  25   4.608  -5.539  -2.811
  177    HA   ARG  25           HA       ARG  25   3.663  -7.561  -1.057
  178    HB2  ARG  25          2HB       ARG  25   5.488  -7.672  -3.453
  179    HB3  ARG  25          1HB       ARG  25   4.678  -9.014  -2.674
  180    HG2  ARG  25          2HG       ARG  25   3.366  -6.766  -4.179
  181    HG3  ARG  25          1HG       ARG  25   3.553  -8.428  -4.733
  182    HD2  ARG  25          2HD       ARG  25   2.134  -9.173  -2.837
  183    HD3  ARG  25          1HD       ARG  25   1.910  -7.482  -2.384
  184    HE   ARG  25           HE       ARG  25   1.222  -8.250  -5.087
  185   HH11  ARG  25          1HH1      ARG  25  -0.016  -7.534  -1.844
  186   HH12  ARG  25          2HH1      ARG  25  -1.544  -7.053  -2.419
  187   HH21  ARG  25          1HH2      ARG  25  -0.929  -7.663  -5.814
  188   HH22  ARG  25          2HH2      ARG  25  -2.078  -7.174  -4.666
  189    H    LYS  26           H        LYS  26   6.445  -5.679  -1.596
  190    HA   LYS  26           HA       LYS  26   8.384  -7.356  -0.349
  191    HB2  LYS  26          2HB       LYS  26   8.882  -5.571  -2.027
  192    HB3  LYS  26          1HB       LYS  26   8.383  -4.385  -0.857
  193    HG2  LYS  26          2HG       LYS  26  10.818  -4.539  -0.976
  194    HG3  LYS  26          1HG       LYS  26  10.199  -4.970   0.618
  195    HD2  LYS  26          2HD       LYS  26  10.464  -7.326   0.126
  196    HD3  LYS  26          1HD       LYS  26  10.966  -6.941  -1.524
  197    HE2  LYS  26          2HE       LYS  26  12.423  -6.055   0.959
  198    HE3  LYS  26          1HE       LYS  26  12.852  -7.478   0.012
  199    HZ1  LYS  26          1HZ       LYS  26  12.832  -4.680  -1.004
  200    HZ2  LYS  26          2HZ       LYS  26  13.251  -6.038  -1.882
  201    HZ3  LYS  26          3HZ       LYS  26  14.205  -5.562  -0.589
  202    H    ASP  27           H        ASP  27   6.954  -4.238   0.562
  203    HA   ASP  27           HA       ASP  27   7.808  -4.358   3.251
  204    HB2  ASP  27          2HB       ASP  27   5.714  -2.632   1.933
  205    HB3  ASP  27          1HB       ASP  27   6.375  -2.405   3.536
  206    H    LYS  28           H        LYS  28   4.882  -5.339   1.538
  207    HA   LYS  28           HA       LYS  28   3.088  -6.331   2.022
  208    HB2  LYS  28          2HB       LYS  28   4.551  -7.135   4.533
  209    HB3  LYS  28          1HB       LYS  28   2.963  -7.728   4.014
  210    HG2  LYS  28          2HG       LYS  28   3.858  -8.743   2.065
  211    HG3  LYS  28          1HG       LYS  28   5.419  -7.965   2.300
  212    HD2  LYS  28          2HD       LYS  28   4.230 -10.020   4.167
  213    HD3  LYS  28          1HD       LYS  28   5.385 -10.381   2.889
  214    HE2  LYS  28          2HE       LYS  28   5.880  -8.518   5.220
  215    HE3  LYS  28          1HE       LYS  28   6.470 -10.167   5.079
  216    HZ1  LYS  28          1HZ       LYS  28   7.206  -7.952   3.208
  217    HZ2  LYS  28          2HZ       LYS  28   7.794  -9.514   3.161
  218    HZ3  LYS  28          3HZ       LYS  28   8.132  -8.518   4.473
  219    H    TRP  29           H        TRP  29   3.288  -3.710   2.409
  220    HA   TRP  29           HA       TRP  29   0.838  -3.228   3.715
  221    HB2  TRP  29          2HB       TRP  29   1.567  -1.481   5.251
  222    HB3  TRP  29          1HB       TRP  29   2.428  -2.947   5.656
  223    HD1  TRP  29           HD       TRP  29   3.150   0.190   3.488
  224    HE1  TRP  29          1HE       TRP  29   5.510   0.956   3.928
  225    HE3  TRP  29          3HE       TRP  29   4.493  -3.414   6.815
  226    HZ2  TRP  29          2HZ       TRP  29   7.727   0.155   5.550
  227    HZ3  TRP  29          3HZ       TRP  29   6.756  -3.337   7.781
  228    HH2  TRP  29           HH       TRP  29   8.330  -1.589   7.158
  229    H    CYS  30           H        CYS  30   0.231  -0.785   3.271
  230    HA   CYS  30           HA       CYS  30   0.872  -0.325   0.579
  231    HB2  CYS  30          2HB       CYS  30  -0.732   1.145   2.653
  232    HB3  CYS  30          1HB       CYS  30  -0.531   1.709   0.999
  233    H    LYS  31           H        LYS  31   2.462   0.798  -0.154
  234    HA   LYS  31           HA       LYS  31   4.022   2.519   1.669
  235    HB2  LYS  31          2HB       LYS  31   4.990   0.139   0.952
  236    HB3  LYS  31          1HB       LYS  31   5.047   0.925  -0.615
  237    HG2  LYS  31          2HG       LYS  31   7.226   0.887   0.304
  238    HG3  LYS  31          1HG       LYS  31   6.672   2.550   0.225
  239    HD2  LYS  31          2HD       LYS  31   6.205   2.508   2.613
  240    HD3  LYS  31          1HD       LYS  31   6.616   0.788   2.653
  241    HE2  LYS  31          2HE       LYS  31   8.527   2.995   1.908
  242    HE3  LYS  31          1HE       LYS  31   8.435   2.223   3.489
  243    HZ1  LYS  31          1HZ       LYS  31  10.196   1.237   2.222
  244    HZ2  LYS  31          2HZ       LYS  31   9.220   0.982   0.910
  245    HZ3  LYS  31          3HZ       LYS  31   8.968   0.071   2.319
  246    H    TYR  32           H        TYR  32   5.478   3.732  -0.052
  247    HA   TYR  32           HA       TYR  32   3.650   4.993  -1.968
  248    HB2  TYR  32          2HB       TYR  32   5.526   6.103  -0.348
  249    HB3  TYR  32          1HB       TYR  32   6.533   5.736  -1.726
  250    HD1  TYR  32          1HD       TYR  32   5.882   6.729  -4.012
  251    HD2  TYR  32          2HD       TYR  32   4.172   8.018  -0.335
  252    HE1  TYR  32          1HE       TYR  32   5.136   8.795  -5.085
  253    HE2  TYR  32          2HE       TYR  32   3.422  10.087  -1.397
  254    HH   TYR  32           HH       TYR  32   3.253  10.463  -4.675
  255    H    GLN  33           H        GLN  33   4.203   4.863  -4.241
  256    HA   GLN  33           HA       GLN  33   5.862   2.585  -4.803
  257    HB2  GLN  33          2HB       GLN  33   3.809   3.003  -6.078
  258    HB3  GLN  33          1HB       GLN  33   4.584   4.453  -6.741
  259    HG2  GLN  33          2HG       GLN  33   6.287   3.088  -7.807
  260    HG3  GLN  33          1HG       GLN  33   5.582   1.631  -7.114
  261   HE21  GLN  33          1HE2      GLN  33   3.681   0.858  -7.938
  262   HE22  GLN  33          2HE2      GLN  33   3.055   1.351  -9.464
  263    H    ILE  34           H        ILE  34   7.447   3.700  -3.745
  264    HA   ILE  34           HA       ILE  34   9.035   5.544  -5.264
  265    HB   ILE  34           HB       ILE  34   8.990   5.952  -2.901
  266   HG12  ILE  34          2HG1      ILE  34  11.415   5.907  -2.277
  267   HG13  ILE  34          1HG1      ILE  34  11.712   4.911  -3.697
  268   HG21  ILE  34          1HG2      ILE  34  10.051   3.186  -2.434
  269   HG22  ILE  34          2HG2      ILE  34   8.447   3.798  -2.029
  270   HG23  ILE  34          3HG2      ILE  34   9.868   4.432  -1.199
  271   HD11  ILE  34          1HD1      ILE  34  10.598   7.706  -3.715
  272   HD12  ILE  34          2HD1      ILE  34  10.939   6.716  -5.135
  273   HD13  ILE  34          3HD1      ILE  34  12.257   7.248  -4.092
  Start of MODEL   10
    1    H1   ASP   1          1HT       ASP   1 -11.060   7.893   3.813
    2    H2   ASP   1          2HT       ASP   1 -11.957   8.009   2.392
    3    H3   ASP   1          3HT       ASP   1 -11.386   9.411   3.132
    4    HA   ASP   1           HA       ASP   1 -10.087   8.824   1.192
    5    HB2  ASP   1          2HB       ASP   1  -8.709   8.559   3.862
    6    HB3  ASP   1          1HB       ASP   1  -7.820   8.507   2.351
    7    H    CYS   2           H        CYS   2  -8.156   7.420   0.642
    8    HA   CYS   2           HA       CYS   2  -8.906   4.641   0.899
    9    HB2  CYS   2          2HB       CYS   2  -6.805   4.598  -0.700
   10    HB3  CYS   2          1HB       CYS   2  -8.405   4.969  -1.305
   11    H    LEU   3           H        LEU   3  -6.920   3.169   1.117
   12    HA   LEU   3           HA       LEU   3  -5.832   3.658   3.661
   13    HB2  LEU   3          2HB       LEU   3  -5.029   1.604   1.590
   14    HB3  LEU   3          1HB       LEU   3  -4.553   1.647   3.259
   15    HG   LEU   3           HG       LEU   3  -7.383   1.281   2.321
   16   HD11  LEU   3          1HD1      LEU   3  -7.082  -1.054   3.018
   17   HD12  LEU   3          2HD1      LEU   3  -5.380  -0.731   3.345
   18   HD13  LEU   3          3HD1      LEU   3  -5.998  -0.621   1.697
   19   HD21  LEU   3          1HD2      LEU   3  -7.221   2.288   4.540
   20   HD22  LEU   3          2HD2      LEU   3  -6.131   0.998   5.049
   21   HD23  LEU   3          3HD2      LEU   3  -7.804   0.628   4.639
   22    H    GLY   4           H        GLY   4  -4.017   4.529   4.244
   23    HA2  GLY   4          2HA       GLY   4  -2.482   5.946   2.264
   24    HA3  GLY   4          1HA       GLY   4  -2.382   6.130   4.014
   25    H    PHE   5           H        PHE   5   0.004   6.144   3.385
   26    HA   PHE   5           HA       PHE   5   0.976   3.537   2.748
   27    HB2  PHE   5          2HB       PHE   5   3.224   4.672   2.810
   28    HB3  PHE   5          1HB       PHE   5   2.134   5.347   1.613
   29    HD1  PHE   5          1HD       PHE   5   1.083   7.575   2.047
   30    HD2  PHE   5          2HD       PHE   5   4.112   5.966   4.563
   31    HE1  PHE   5          1HE       PHE   5   1.487   9.793   2.979
   32    HE2  PHE   5          2HE       PHE   5   4.503   8.189   5.513
   33    HZ   PHE   5           HZ       PHE   5   3.196  10.107   4.726
   34    H    LEU   6           H        LEU   6   2.380   2.492   4.136
   35    HA   LEU   6           HA       LEU   6   3.211   1.695   6.059
   36    HB2  LEU   6          2HB       LEU   6   1.904   3.914   7.575
   37    HB3  LEU   6          1HB       LEU   6   3.260   2.913   8.100
   38    HG   LEU   6           HG       LEU   6   3.234   5.067   6.024
   39   HD11  LEU   6          1HD1      LEU   6   3.190   5.928   8.296
   40   HD12  LEU   6          2HD1      LEU   6   4.771   6.250   7.583
   41   HD13  LEU   6          3HD1      LEU   6   4.576   4.930   8.738
   42   HD21  LEU   6          1HD2      LEU   6   4.795   3.341   5.328
   43   HD22  LEU   6          2HD2      LEU   6   5.544   3.328   6.924
   44   HD23  LEU   6          3HD2      LEU   6   5.707   4.745   5.887
   45    H    TRP   7           H        TRP   7   0.121   1.989   5.096
   46    HA   TRP   7           HA       TRP   7  -1.112   0.658   7.340
   47    HB2  TRP   7          2HB       TRP   7  -2.130   1.702   4.715
   48    HB3  TRP   7          1HB       TRP   7  -3.109   0.836   5.867
   49    HD1  TRP   7           HD       TRP   7  -0.792   3.958   6.196
   50    HE1  TRP   7          1HE       TRP   7  -2.044   5.757   7.496
   51    HE3  TRP   7          3HE       TRP   7  -5.185   1.472   6.949
   52    HZ2  TRP   7          2HZ       TRP   7  -4.590   6.105   8.686
   53    HZ3  TRP   7          3HZ       TRP   7  -6.983   2.616   8.172
   54    HH2  TRP   7           HH       TRP   7  -6.681   4.889   9.020
   55    H    LYS   8           H        LYS   8  -1.788  -1.380   7.171
   56    HA   LYS   8           HA       LYS   8  -0.288  -3.085   5.457
   57    HB2  LYS   8          2HB       LYS   8  -0.854  -3.760   7.745
   58    HB3  LYS   8          1HB       LYS   8  -2.562  -3.759   7.324
   59    HG2  LYS   8          2HG       LYS   8  -2.217  -5.571   5.766
   60    HG3  LYS   8          1HG       LYS   8  -0.487  -5.540   6.073
   61    HD2  LYS   8          2HD       LYS   8  -1.536  -7.360   7.285
   62    HD3  LYS   8          1HD       LYS   8  -0.894  -6.164   8.410
   63    HE2  LYS   8          2HE       LYS   8  -3.143  -5.255   8.723
   64    HE3  LYS   8          1HE       LYS   8  -3.779  -6.417   7.559
   65    HZ1  LYS   8          1HZ       LYS   8  -3.144  -8.198   9.012
   66    HZ2  LYS   8          2HZ       LYS   8  -4.127  -7.091   9.842
   67    HZ3  LYS   8          3HZ       LYS   8  -2.464  -7.107  10.116
   68    H    CYS   9           H        CYS   9  -0.757  -3.666   3.453
   69    HA   CYS   9           HA       CYS   9  -3.303  -2.930   2.395
   70    HB2  CYS   9          2HB       CYS   9  -2.295  -3.579   0.245
   71    HB3  CYS   9          1HB       CYS   9  -1.428  -2.329   1.140
   72    H    ASN  10           H        ASN  10  -4.670  -4.240   1.285
   73    HA   ASN  10           HA       ASN  10  -4.573  -7.087   1.996
   74    HB2  ASN  10          2HB       ASN  10  -6.277  -5.708   3.212
   75    HB3  ASN  10          1HB       ASN  10  -6.957  -5.263   1.654
   76   HD21  ASN  10          1HD2      ASN  10  -8.129  -6.593   3.929
   77   HD22  ASN  10          2HD2      ASN  10  -8.768  -8.099   3.388
   78    HA   PRO  11           HA       PRO  11  -4.486  -7.181  -2.504
   79    HB2  PRO  11          2HB       PRO  11  -4.775  -9.891  -2.791
   80    HB3  PRO  11          1HB       PRO  11  -3.242  -9.103  -2.406
   81    HG2  PRO  11          2HG       PRO  11  -5.186 -10.458  -0.581
   82    HG3  PRO  11          1HG       PRO  11  -3.415 -10.533  -0.583
   83    HD2  PRO  11          2HD       PRO  11  -4.794  -9.006   1.150
   84    HD3  PRO  11          1HD       PRO  11  -3.208  -8.513   0.519
   85    H    SER  12           H        SER  12  -7.078  -8.520  -0.544
   86    HA   SER  12           HA       SER  12  -8.791  -8.978  -2.829
   87    HB2  SER  12          2HB       SER  12  -9.043  -9.540   0.102
   88    HB3  SER  12          1HB       SER  12 -10.132 -10.082  -1.176
   89    HG   SER  12           HG       SER  12  -7.811 -10.767  -2.005
   90    H    ASN  13           H        ASN  13  -8.003  -6.544  -0.819
   91    HA   ASN  13           HA       ASN  13 -10.433  -5.095  -1.239
   92    HB2  ASN  13          2HB       ASN  13 -10.789  -6.361   0.965
   93    HB3  ASN  13          1HB       ASN  13  -9.442  -5.441   1.617
   94   HD21  ASN  13          1HD2      ASN  13 -12.194  -5.486   2.477
   95   HD22  ASN  13          2HD2      ASN  13 -12.788  -3.880   2.379
   96    H    ASP  14           H        ASP  14  -8.783  -4.433  -2.501
   97    HA   ASP  14           HA       ASP  14  -6.423  -3.197  -1.407
   98    HB2  ASP  14          2HB       ASP  14  -6.378  -4.621  -3.348
   99    HB3  ASP  14          1HB       ASP  14  -7.474  -3.532  -4.197
  100    H    LYS  15           H        LYS  15  -7.001  -1.351  -0.472
  101    HA   LYS  15           HA       LYS  15  -8.841   0.383  -1.924
  102    HB2  LYS  15          2HB       LYS  15  -9.435  -1.009   0.177
  103    HB3  LYS  15          1HB       LYS  15  -8.528   0.234   1.013
  104    HG2  LYS  15          2HG       LYS  15 -10.025   1.908  -0.032
  105    HG3  LYS  15          1HG       LYS  15 -10.926   0.508  -0.672
  106    HD2  LYS  15          2HD       LYS  15 -11.190  -0.363   1.519
  107    HD3  LYS  15          1HD       LYS  15 -10.324   1.016   2.187
  108    HE2  LYS  15          2HE       LYS  15 -12.748   1.377   2.459
  109    HE3  LYS  15          1HE       LYS  15 -12.069   2.537   1.320
  110    HZ1  LYS  15          1HZ       LYS  15 -12.895   1.116  -0.502
  111    HZ2  LYS  15          2HZ       LYS  15 -14.124   1.679   0.482
  112    HZ3  LYS  15          3HZ       LYS  15 -13.602   0.084   0.632
  113    H    CYS  16           H        CYS  16  -5.877   0.127  -1.705
  114    HA   CYS  16           HA       CYS  16  -5.084   2.417  -0.126
  115    HB2  CYS  16          2HB       CYS  16  -3.462   0.676  -1.978
  116    HB3  CYS  16          1HB       CYS  16  -2.791   2.061  -1.124
  117    H    CYS  17           H        CYS  17  -3.979   4.292  -0.957
  118    HA   CYS  17           HA       CYS  17  -5.393   5.429  -3.145
  119    HB2  CYS  17          2HB       CYS  17  -2.985   6.473  -1.668
  120    HB3  CYS  17          1HB       CYS  17  -4.011   7.416  -2.724
  121    H    ARG  18           H        ARG  18  -4.654   3.642  -4.591
  122    HA   ARG  18           HA       ARG  18  -2.028   3.710  -5.618
  123    HB2  ARG  18          2HB       ARG  18  -2.946   2.037  -7.226
  124    HB3  ARG  18          1HB       ARG  18  -3.235   1.633  -5.541
  125    HG2  ARG  18          2HG       ARG  18  -5.520   2.612  -5.783
  126    HG3  ARG  18          1HG       ARG  18  -5.210   2.755  -7.511
  127    HD2  ARG  18          2HD       ARG  18  -5.095   0.229  -5.912
  128    HD3  ARG  18          1HD       ARG  18  -6.469   0.752  -6.881
  129    HE   ARG  18           HE       ARG  18  -4.637   0.746  -8.731
  130   HH11  ARG  18          1HH1      ARG  18  -5.070  -1.678  -6.148
  131   HH12  ARG  18          2HH1      ARG  18  -4.602  -2.987  -7.126
  132   HH21  ARG  18          1HH2      ARG  18  -3.986  -1.143 -10.063
  133   HH22  ARG  18          2HH2      ARG  18  -3.964  -2.691  -9.338
  134    HA   PRO  19           HA       PRO  19  -1.073   3.216  -7.492
  135    HB2  PRO  19          2HB       PRO  19   0.394   4.025  -9.513
  136    HB3  PRO  19          1HB       PRO  19  -1.189   3.242  -9.750
  137    HG2  PRO  19          2HG       PRO  19  -0.477   6.130  -9.987
  138    HG3  PRO  19          1HG       PRO  19  -1.552   5.148 -10.996
  139    HD2  PRO  19          2HD       PRO  19  -2.325   6.809  -8.855
  140    HD3  PRO  19          1HD       PRO  19  -3.337   5.594  -9.661
  141    H    ASN  20           H        ASN  20  -1.333   6.226  -6.761
  142    HA   ASN  20           HA       ASN  20   1.262   7.342  -6.460
  143    HB2  ASN  20          2HB       ASN  20  -0.790   8.677  -6.108
  144    HB3  ASN  20          1HB       ASN  20  -1.145   7.759  -4.654
  145   HD21  ASN  20          1HD2      ASN  20  -0.124   8.295  -2.776
  146   HD22  ASN  20          2HD2      ASN  20   0.898   9.650  -2.584
  147    H    LEU  21           H        LEU  21  -0.656   5.379  -4.208
  148    HA   LEU  21           HA       LEU  21   1.828   4.509  -2.913
  149    HB2  LEU  21          2HB       LEU  21  -0.959   4.152  -1.935
  150    HB3  LEU  21          1HB       LEU  21   0.528   3.970  -1.075
  151    HG   LEU  21           HG       LEU  21  -0.560   6.650  -1.943
  152   HD11  LEU  21          1HD1      LEU  21  -0.420   5.415   0.788
  153   HD12  LEU  21          2HD1      LEU  21  -1.882   5.633  -0.166
  154   HD13  LEU  21          3HD1      LEU  21  -0.978   7.041   0.401
  155   HD21  LEU  21          1HD2      LEU  21   1.842   6.675  -1.878
  156   HD22  LEU  21          2HD2      LEU  21   1.853   5.903  -0.299
  157   HD23  LEU  21          3HD2      LEU  21   1.224   7.546  -0.474
  158    H    VAL  22           H        VAL  22   1.995   2.371  -2.722
  159    HA   VAL  22           HA       VAL  22   0.214   0.665  -4.350
  160    HB   VAL  22           HB       VAL  22   3.182   0.538  -4.371
  161   HG11  VAL  22          1HG1      VAL  22   2.219  -1.620  -4.814
  162   HG12  VAL  22          2HG1      VAL  22   2.919  -1.010  -6.312
  163   HG13  VAL  22          3HG1      VAL  22   1.173  -0.944  -6.061
  164   HG21  VAL  22          1HG2      VAL  22   1.413   1.644  -6.549
  165   HG22  VAL  22          2HG2      VAL  22   3.154   1.386  -6.698
  166   HG23  VAL  22          3HG2      VAL  22   2.530   2.556  -5.537
  167    H    CYS  23           H        CYS  23   0.014  -1.392  -3.568
  168    HA   CYS  23           HA       CYS  23   0.816  -1.899  -0.876
  169    HB2  CYS  23          2HB       CYS  23  -1.236  -2.823  -1.522
  170    HB3  CYS  23          1HB       CYS  23  -0.534  -3.576  -2.964
  171    H    SER  24           H        SER  24   2.635  -2.592  -0.307
  172    HA   SER  24           HA       SER  24   4.451  -3.750  -2.233
  173    HB2  SER  24          2HB       SER  24   5.323  -2.056  -0.707
  174    HB3  SER  24          1HB       SER  24   4.796  -3.007   0.677
  175    HG   SER  24           HG       SER  24   7.054  -3.187   0.130
  176    H    ARG  25           H        ARG  25   4.360  -5.826  -2.544
  177    HA   ARG  25           HA       ARG  25   3.031  -7.630  -0.763
  178    HB2  ARG  25          2HB       ARG  25   3.089  -7.899  -3.233
  179    HB3  ARG  25          1HB       ARG  25   4.819  -8.176  -3.144
  180    HG2  ARG  25          2HG       ARG  25   4.390 -10.193  -1.790
  181    HG3  ARG  25          1HG       ARG  25   2.658  -9.909  -1.982
  182    HD2  ARG  25          2HD       ARG  25   2.889 -10.085  -4.398
  183    HD3  ARG  25          1HD       ARG  25   4.625 -10.340  -4.211
  184    HE   ARG  25           HE       ARG  25   2.735 -12.185  -2.965
  185   HH11  ARG  25          1HH1      ARG  25   5.207 -11.571  -5.422
  186   HH12  ARG  25          2HH1      ARG  25   5.473 -13.228  -5.750
  187   HH21  ARG  25          1HH2      ARG  25   3.129 -14.464  -3.441
  188   HH22  ARG  25          2HH2      ARG  25   4.291 -14.883  -4.628
  189    H    LYS  26           H        LYS  26   6.108  -6.325  -1.108
  190    HA   LYS  26           HA       LYS  26   7.631  -8.426   0.127
  191    HB2  LYS  26          2HB       LYS  26   8.434  -6.642  -1.530
  192    HB3  LYS  26          1HB       LYS  26   8.399  -5.547  -0.177
  193    HG2  LYS  26          2HG       LYS  26   9.961  -6.971   1.065
  194    HG3  LYS  26          1HG       LYS  26  10.069  -8.044  -0.328
  195    HD2  LYS  26          2HD       LYS  26  10.872  -5.131  -0.269
  196    HD3  LYS  26          1HD       LYS  26  11.971  -6.500  -0.229
  197    HE2  LYS  26          2HE       LYS  26  11.166  -7.193  -2.445
  198    HE3  LYS  26          1HE       LYS  26  10.103  -5.790  -2.491
  199    HZ1  LYS  26          1HZ       LYS  26  12.053  -4.359  -2.400
  200    HZ2  LYS  26          2HZ       LYS  26  12.178  -5.438  -3.698
  201    HZ3  LYS  26          3HZ       LYS  26  13.055  -5.707  -2.302
  202    H    ASP  27           H        ASP  27   6.567  -5.144   1.011
  203    HA   ASP  27           HA       ASP  27   7.447  -5.450   3.724
  204    HB2  ASP  27          2HB       ASP  27   6.002  -3.214   2.323
  205    HB3  ASP  27          1HB       ASP  27   6.600  -3.167   3.968
  206    H    LYS  28           H        LYS  28   4.445  -5.912   1.986
  207    HA   LYS  28           HA       LYS  28   2.479  -6.393   2.444
  208    HB2  LYS  28          2HB       LYS  28   3.492  -7.065   5.199
  209    HB3  LYS  28          1HB       LYS  28   1.824  -7.214   4.648
  210    HG2  LYS  28          2HG       LYS  28   2.735  -9.402   4.421
  211    HG3  LYS  28          1HG       LYS  28   2.647  -8.681   2.813
  212    HD2  LYS  28          2HD       LYS  28   4.717  -9.876   3.050
  213    HD3  LYS  28          1HD       LYS  28   5.036  -8.150   2.925
  214    HE2  LYS  28          2HE       LYS  28   5.342  -8.009   5.336
  215    HE3  LYS  28          1HE       LYS  28   4.958  -9.722   5.507
  216    HZ1  LYS  28          1HZ       LYS  28   6.929 -10.248   4.230
  217    HZ2  LYS  28          2HZ       LYS  28   7.353  -9.269   5.543
  218    HZ3  LYS  28          3HZ       LYS  28   7.268  -8.611   4.004
  219    H    TRP  29           H        TRP  29   3.420  -3.710   2.749
  220    HA   TRP  29           HA       TRP  29   0.886  -2.754   3.673
  221    HB2  TRP  29          2HB       TRP  29   1.764  -0.894   4.999
  222    HB3  TRP  29          1HB       TRP  29   2.300  -2.411   5.680
  223    HD1  TRP  29           HD       TRP  29   3.773   0.350   3.347
  224    HE1  TRP  29          1HE       TRP  29   6.230   0.706   3.996
  225    HE3  TRP  29          3HE       TRP  29   4.170  -3.232   6.967
  226    HZ2  TRP  29          2HZ       TRP  29   8.090  -0.377   5.823
  227    HZ3  TRP  29          3HZ       TRP  29   6.318  -3.493   8.131
  228    HH2  TRP  29           HH       TRP  29   8.237  -2.091   7.571
  229    H    CYS  30           H        CYS  30   0.405  -0.555   2.838
  230    HA   CYS  30           HA       CYS  30   1.496  -0.297   0.236
  231    HB2  CYS  30          2HB       CYS  30  -0.665   1.058   1.815
  232    HB3  CYS  30          1HB       CYS  30  -0.131   1.676   0.259
  233    H    LYS  31           H        LYS  31   2.990   1.211  -0.455
  234    HA   LYS  31           HA       LYS  31   3.872   3.151   1.442
  235    HB2  LYS  31          2HB       LYS  31   6.028   2.614   0.618
  236    HB3  LYS  31          1HB       LYS  31   5.330   1.222   1.485
  237    HG2  LYS  31          2HG       LYS  31   4.762   0.372  -0.875
  238    HG3  LYS  31          1HG       LYS  31   5.856   1.623  -1.463
  239    HD2  LYS  31          2HD       LYS  31   6.556  -0.650   0.404
  240    HD3  LYS  31          1HD       LYS  31   7.022  -0.509  -1.287
  241    HE2  LYS  31          2HE       LYS  31   8.369   1.460  -0.742
  242    HE3  LYS  31          1HE       LYS  31   7.869   1.342   0.943
  243    HZ1  LYS  31          1HZ       LYS  31  10.019   0.318   0.704
  244    HZ2  LYS  31          2HZ       LYS  31   9.491  -0.588  -0.592
  245    HZ3  LYS  31          3HZ       LYS  31   8.887  -0.935   0.938
  246    H    TYR  32           H        TYR  32   5.170   4.784   0.093
  247    HA   TYR  32           HA       TYR  32   3.637   5.588  -2.184
  248    HB2  TYR  32          2HB       TYR  32   4.881   7.118  -0.553
  249    HB3  TYR  32          1HB       TYR  32   6.351   6.606  -1.322
  250    HD1  TYR  32          1HD       TYR  32   3.224   8.475  -1.853
  251    HD2  TYR  32          2HD       TYR  32   7.035   7.498  -3.454
  252    HE1  TYR  32          1HE       TYR  32   2.961  10.217  -3.550
  253    HE2  TYR  32          2HE       TYR  32   6.786   9.228  -5.144
  254    HH   TYR  32           HH       TYR  32   4.973  10.415  -6.257
  255    H    GLN  33           H        GLN  33   4.317   5.577  -4.352
  256    HA   GLN  33           HA       GLN  33   6.213   3.515  -5.022
  257    HB2  GLN  33          2HB       GLN  33   4.106   3.918  -6.288
  258    HB3  GLN  33          1HB       GLN  33   4.824   5.448  -6.815
  259    HG2  GLN  33          2HG       GLN  33   6.645   4.209  -7.907
  260    HG3  GLN  33          1HG       GLN  33   5.892   2.695  -7.428
  261   HE21  GLN  33          1HE2      GLN  33   6.520   3.732 -10.047
  262   HE22  GLN  33          2HE2      GLN  33   5.037   3.758 -10.934
  263    H    ILE  34           H        ILE  34   7.555   5.012  -3.715
  264    HA   ILE  34           HA       ILE  34   9.004   7.180  -4.780
  265    HB   ILE  34           HB       ILE  34  10.192   5.028  -2.989
  266   HG12  ILE  34          2HG1      ILE  34   8.754   7.569  -2.172
  267   HG13  ILE  34          1HG1      ILE  34   8.074   5.944  -2.087
  268   HG21  ILE  34          1HG2      ILE  34  11.672   6.826  -2.230
  269   HG22  ILE  34          2HG2      ILE  34  10.918   7.929  -3.383
  270   HG23  ILE  34          3HG2      ILE  34  11.836   6.538  -3.962
  271   HD11  ILE  34          1HD1      ILE  34   8.846   6.722   0.087
  272   HD12  ILE  34          2HD1      ILE  34  10.475   6.928  -0.560
  273   HD13  ILE  34          3HD1      ILE  34   9.766   5.317  -0.455
  Start of MODEL   11
    1    H1   ASP   1          1HT       ASP   1 -11.907   9.497   1.750
    2    H2   ASP   1          2HT       ASP   1 -12.334   7.862   1.893
    3    H3   ASP   1          3HT       ASP   1 -11.572   8.399   0.514
    4    HA   ASP   1           HA       ASP   1  -9.590   8.866   1.662
    5    HB2  ASP   1          2HB       ASP   1 -11.085   7.833   4.084
    6    HB3  ASP   1          1HB       ASP   1  -9.337   8.011   4.018
    7    H    CYS   2           H        CYS   2  -8.061   7.118   2.353
    8    HA   CYS   2           HA       CYS   2  -8.986   4.447   1.720
    9    HB2  CYS   2          2HB       CYS   2  -7.123   4.195   0.163
   10    HB3  CYS   2          1HB       CYS   2  -8.345   5.286  -0.434
   11    H    LEU   3           H        LEU   3  -6.871   3.139   1.738
   12    HA   LEU   3           HA       LEU   3  -5.649   3.402   4.280
   13    HB2  LEU   3          2HB       LEU   3  -4.912   1.739   1.867
   14    HB3  LEU   3          1HB       LEU   3  -4.209   1.595   3.453
   15    HG   LEU   3           HG       LEU   3  -7.125   1.079   2.864
   16   HD11  LEU   3          1HD1      LEU   3  -4.850  -0.864   3.229
   17   HD12  LEU   3          2HD1      LEU   3  -5.703  -0.546   1.717
   18   HD13  LEU   3          3HD1      LEU   3  -6.554  -1.289   3.073
   19   HD21  LEU   3          1HD2      LEU   3  -5.412   0.495   5.278
   20   HD22  LEU   3          2HD2      LEU   3  -7.095   0.014   5.070
   21   HD23  LEU   3          3HD2      LEU   3  -6.675   1.722   5.173
   22    H    GLY   4           H        GLY   4  -3.873   4.538   4.756
   23    HA2  GLY   4          2HA       GLY   4  -2.600   6.077   2.657
   24    HA3  GLY   4          1HA       GLY   4  -2.309   6.237   4.390
   25    H    PHE   5           H        PHE   5   0.027   6.309   3.460
   26    HA   PHE   5           HA       PHE   5   0.911   3.716   2.682
   27    HB2  PHE   5          2HB       PHE   5   3.140   4.868   2.453
   28    HB3  PHE   5          1HB       PHE   5   1.893   5.551   1.428
   29    HD1  PHE   5          1HD       PHE   5   0.835   7.739   2.112
   30    HD2  PHE   5          2HD       PHE   5   4.310   6.187   4.015
   31    HE1  PHE   5          1HE       PHE   5   1.343   9.969   3.003
   32    HE2  PHE   5          2HE       PHE   5   4.809   8.408   4.913
   33    HZ   PHE   5           HZ       PHE   5   3.333  10.302   4.409
   34    H    LEU   6           H        LEU   6   2.385   2.603   3.897
   35    HA   LEU   6           HA       LEU   6   3.399   1.750   5.712
   36    HB2  LEU   6          2HB       LEU   6   2.481   4.090   7.328
   37    HB3  LEU   6          1HB       LEU   6   3.837   3.021   7.691
   38    HG   LEU   6           HG       LEU   6   3.620   5.112   5.553
   39   HD11  LEU   6          1HD1      LEU   6   5.487   6.220   6.778
   40   HD12  LEU   6          2HD1      LEU   6   5.391   4.961   8.009
   41   HD13  LEU   6          3HD1      LEU   6   4.032   6.054   7.759
   42   HD21  LEU   6          1HD2      LEU   6   4.918   3.266   4.668
   43   HD22  LEU   6          2HD2      LEU   6   5.938   3.237   6.105
   44   HD23  LEU   6          3HD2      LEU   6   5.998   4.615   5.006
   45    H    TRP   7           H        TRP   7   0.303   2.044   5.068
   46    HA   TRP   7           HA       TRP   7  -0.662   0.831   7.506
   47    HB2  TRP   7          2HB       TRP   7  -2.002   2.197   5.192
   48    HB3  TRP   7          1HB       TRP   7  -2.872   1.274   6.394
   49    HD1  TRP   7           HD       TRP   7  -0.466   4.328   6.321
   50    HE1  TRP   7          1HE       TRP   7  -1.187   5.979   8.124
   51    HE3  TRP   7          3HE       TRP   7  -4.329   1.653   8.324
   52    HZ2  TRP   7          2HZ       TRP   7  -3.171   6.146  10.153
   53    HZ3  TRP   7          3HZ       TRP   7  -5.594   2.636  10.190
   54    HH2  TRP   7           HH       TRP   7  -5.024   4.837  11.081
   55    H    LYS   8           H        LYS   8  -1.708  -1.095   7.315
   56    HA   LYS   8           HA       LYS   8  -0.552  -2.928   5.494
   57    HB2  LYS   8          2HB       LYS   8  -1.218  -3.492   7.792
   58    HB3  LYS   8          1HB       LYS   8  -2.907  -3.328   7.340
   59    HG2  LYS   8          2HG       LYS   8  -2.629  -5.177   5.731
   60    HG3  LYS   8          1HG       LYS   8  -0.960  -5.360   6.264
   61    HD2  LYS   8          2HD       LYS   8  -3.429  -5.702   7.979
   62    HD3  LYS   8          1HD       LYS   8  -2.421  -6.999   7.349
   63    HE2  LYS   8          2HE       LYS   8  -1.520  -4.859   9.292
   64    HE3  LYS   8          1HE       LYS   8  -1.939  -6.511   9.715
   65    HZ1  LYS   8          1HZ       LYS   8  -0.102  -7.291   8.368
   66    HZ2  LYS   8          2HZ       LYS   8   0.454  -6.197   9.522
   67    HZ3  LYS   8          3HZ       LYS   8   0.300  -5.717   7.928
   68    H    CYS   9           H        CYS   9  -1.108  -3.297   3.454
   69    HA   CYS   9           HA       CYS   9  -3.647  -2.436   2.423
   70    HB2  CYS   9          2HB       CYS   9  -2.616  -3.144   0.244
   71    HB3  CYS   9          1HB       CYS   9  -1.698  -1.933   1.140
   72    H    ASN  10           H        ASN  10  -4.837  -3.986   0.955
   73    HA   ASN  10           HA       ASN  10  -4.835  -6.678   2.183
   74    HB2  ASN  10          2HB       ASN  10  -6.678  -5.164   3.023
   75    HB3  ASN  10          1HB       ASN  10  -7.271  -5.071   1.371
   76   HD21  ASN  10          1HD2      ASN  10  -7.050  -6.985   4.200
   77   HD22  ASN  10          2HD2      ASN  10  -8.069  -8.270   3.666
   78    HA   PRO  11           HA       PRO  11  -4.835  -7.789  -2.129
   79    HB2  PRO  11          2HB       PRO  11  -5.050 -10.439  -1.937
   80    HB3  PRO  11          1HB       PRO  11  -3.601  -9.584  -1.399
   81    HG2  PRO  11          2HG       PRO  11  -5.860 -10.673   0.227
   82    HG3  PRO  11          1HG       PRO  11  -4.121 -10.714   0.559
   83    HD2  PRO  11          2HD       PRO  11  -5.889  -8.894   1.655
   84    HD3  PRO  11          1HD       PRO  11  -4.140  -8.634   1.496
   85    H    SER  12           H        SER  12  -7.614  -8.500  -0.081
   86    HA   SER  12           HA       SER  12  -9.120  -9.633  -2.284
   87    HB2  SER  12          2HB       SER  12  -9.628  -9.537   0.673
   88    HB3  SER  12          1HB       SER  12 -10.483 -10.499  -0.529
   89    HG   SER  12           HG       SER  12  -8.309 -11.389  -1.006
   90    H    ASN  13           H        ASN  13  -8.938  -6.845  -0.167
   91    HA   ASN  13           HA       ASN  13 -11.132  -5.519  -1.416
   92    HB2  ASN  13          2HB       ASN  13 -12.224  -6.914   0.385
   93    HB3  ASN  13          1HB       ASN  13 -11.199  -6.121   1.567
   94   HD21  ASN  13          1HD2      ASN  13 -14.061  -6.157   1.502
   95   HD22  ASN  13          2HD2      ASN  13 -14.594  -4.523   1.376
   96    H    ASP  14           H        ASP  14  -9.330  -4.388  -1.955
   97    HA   ASP  14           HA       ASP  14  -7.783  -3.239   0.176
   98    HB2  ASP  14          2HB       ASP  14  -6.669  -4.428  -1.537
   99    HB3  ASP  14          1HB       ASP  14  -7.355  -3.390  -2.776
  100    H    LYS  15           H        LYS  15  -7.959  -1.248   0.605
  101    HA   LYS  15           HA       LYS  15  -9.761   0.351  -1.023
  102    HB2  LYS  15          2HB       LYS  15 -10.238  -0.783   1.380
  103    HB3  LYS  15          1HB       LYS  15  -9.589   0.782   1.873
  104    HG2  LYS  15          2HG       LYS  15 -11.885   0.303   0.016
  105    HG3  LYS  15          1HG       LYS  15 -12.054   0.793   1.707
  106    HD2  LYS  15          2HD       LYS  15 -10.750   2.840   1.173
  107    HD3  LYS  15          1HD       LYS  15 -10.734   2.338  -0.513
  108    HE2  LYS  15          2HE       LYS  15 -13.180   2.459  -0.591
  109    HE3  LYS  15          1HE       LYS  15 -13.222   2.920   1.108
  110    HZ1  LYS  15          1HZ       LYS  15 -12.032   4.507  -1.106
  111    HZ2  LYS  15          2HZ       LYS  15 -11.981   4.954   0.507
  112    HZ3  LYS  15          3HZ       LYS  15 -13.455   4.860  -0.288
  113    H    CYS  16           H        CYS  16  -6.986   0.080  -1.152
  114    HA   CYS  16           HA       CYS  16  -5.838   2.382   0.196
  115    HB2  CYS  16          2HB       CYS  16  -4.667   0.041  -0.264
  116    HB3  CYS  16          1HB       CYS  16  -4.515   0.781  -1.869
  117    H    CYS  17           H        CYS  17  -4.419   3.664  -1.322
  118    HA   CYS  17           HA       CYS  17  -6.073   4.467  -3.601
  119    HB2  CYS  17          2HB       CYS  17  -4.115   5.987  -1.955
  120    HB3  CYS  17          1HB       CYS  17  -4.588   6.584  -3.535
  121    H    ARG  18           H        ARG  18  -5.205   2.665  -4.748
  122    HA   ARG  18           HA       ARG  18  -2.527   3.072  -5.584
  123    HB2  ARG  18          2HB       ARG  18  -2.828   0.831  -6.792
  124    HB3  ARG  18          1HB       ARG  18  -2.904   0.781  -5.047
  125    HG2  ARG  18          2HG       ARG  18  -4.575  -0.669  -5.764
  126    HG3  ARG  18          1HG       ARG  18  -5.448   0.798  -5.344
  127    HD2  ARG  18          2HD       ARG  18  -6.303  -0.074  -7.426
  128    HD3  ARG  18          1HD       ARG  18  -5.416   1.424  -7.735
  129    HE   ARG  18           HE       ARG  18  -3.629  -0.676  -8.011
  130   HH11  ARG  18          1HH1      ARG  18  -6.368   0.714  -9.746
  131   HH12  ARG  18          2HH1      ARG  18  -5.994  -0.051 -11.223
  132   HH21  ARG  18          1HH2      ARG  18  -3.105  -1.692  -9.986
  133   HH22  ARG  18          2HH2      ARG  18  -4.070  -1.482 -11.377
  134    HA   PRO  19           HA       PRO  19  -1.432   2.178  -7.520
  135    HB2  PRO  19          2HB       PRO  19  -0.139   2.956  -9.637
  136    HB3  PRO  19          1HB       PRO  19  -1.622   1.961  -9.746
  137    HG2  PRO  19          2HG       PRO  19  -1.293   4.893 -10.223
  138    HG3  PRO  19          1HG       PRO  19  -2.167   3.701 -11.202
  139    HD2  PRO  19          2HD       PRO  19  -3.295   5.340  -9.241
  140    HD3  PRO  19          1HD       PRO  19  -4.029   3.870  -9.913
  141    H    ASN  20           H        ASN  20  -2.100   5.250  -7.097
  142    HA   ASN  20           HA       ASN  20   0.371   6.688  -7.008
  143    HB2  ASN  20          2HB       ASN  20  -1.901   7.755  -6.630
  144    HB3  ASN  20          1HB       ASN  20  -1.865   7.110  -4.992
  145   HD21  ASN  20          1HD2      ASN  20  -0.361   8.027  -3.503
  146   HD22  ASN  20          2HD2      ASN  20   0.382   9.551  -3.807
  147    H    LEU  21           H        LEU  21  -1.242   4.778  -4.495
  148    HA   LEU  21           HA       LEU  21   1.363   4.283  -3.287
  149    HB2  LEU  21          2HB       LEU  21  -1.415   4.006  -2.153
  150    HB3  LEU  21          1HB       LEU  21   0.021   3.433  -1.373
  151    HG   LEU  21           HG       LEU  21  -0.496   5.357  -0.200
  152   HD11  LEU  21          1HD1      LEU  21   1.825   5.332  -0.758
  153   HD12  LEU  21          2HD1      LEU  21   1.225   6.982  -0.627
  154   HD13  LEU  21          3HD1      LEU  21   1.511   6.275  -2.217
  155   HD21  LEU  21          1HD2      LEU  21  -1.119   6.682  -2.821
  156   HD22  LEU  21          2HD2      LEU  21  -0.995   7.556  -1.295
  157   HD23  LEU  21          3HD2      LEU  21  -2.227   6.311  -1.496
  158    H    VAL  22           H        VAL  22   1.585   2.143  -2.775
  159    HA   VAL  22           HA       VAL  22   0.033   0.321  -4.526
  160    HB   VAL  22           HB       VAL  22   2.967   0.108  -4.210
  161   HG11  VAL  22          1HG1      VAL  22   2.858  -1.236  -6.287
  162   HG12  VAL  22          2HG1      VAL  22   1.108  -1.023  -6.280
  163   HG13  VAL  22          3HG1      VAL  22   1.893  -1.892  -4.962
  164   HG21  VAL  22          1HG2      VAL  22   3.299   1.139  -6.453
  165   HG22  VAL  22          2HG2      VAL  22   2.676   2.270  -5.251
  166   HG23  VAL  22          3HG2      VAL  22   1.590   1.579  -6.454
  167    H    CYS  23           H        CYS  23  -0.305  -1.681  -3.657
  168    HA   CYS  23           HA       CYS  23   0.481  -2.141  -0.942
  169    HB2  CYS  23          2HB       CYS  23  -1.623  -3.040  -1.852
  170    HB3  CYS  23          1HB       CYS  23  -0.673  -4.027  -2.982
  171    H    SER  24           H        SER  24   2.385  -2.585  -0.518
  172    HA   SER  24           HA       SER  24   4.302  -3.312  -2.489
  173    HB2  SER  24          2HB       SER  24   4.977  -1.800  -0.746
  174    HB3  SER  24          1HB       SER  24   4.571  -3.003   0.482
  175    HG   SER  24           HG       SER  24   6.871  -2.803  -0.169
  176    H    ARG  25           H        ARG  25   5.002  -5.139  -3.012
  177    HA   ARG  25           HA       ARG  25   3.897  -7.577  -2.118
  178    HB2  ARG  25          2HB       ARG  25   4.764  -7.106  -4.406
  179    HB3  ARG  25          1HB       ARG  25   6.382  -7.106  -3.741
  180    HG2  ARG  25          2HG       ARG  25   6.320  -9.406  -3.287
  181    HG3  ARG  25          1HG       ARG  25   4.572  -9.479  -3.528
  182    HD2  ARG  25          2HD       ARG  25   6.638  -8.876  -5.646
  183    HD3  ARG  25          1HD       ARG  25   5.740 -10.385  -5.464
  184    HE   ARG  25           HE       ARG  25   3.898  -8.313  -5.633
  185   HH11  ARG  25          1HH1      ARG  25   6.207  -9.943  -7.742
  186   HH12  ARG  25          2HH1      ARG  25   5.398  -9.560  -9.183
  187   HH21  ARG  25          1HH2      ARG  25   2.758  -7.780  -7.607
  188   HH22  ARG  25          2HH2      ARG  25   3.386  -8.279  -9.097
  189    H    LYS  26           H        LYS  26   6.850  -5.857  -1.433
  190    HA   LYS  26           HA       LYS  26   7.972  -8.007   0.140
  191    HB2  LYS  26          2HB       LYS  26   9.402  -6.539  -1.196
  192    HB3  LYS  26          1HB       LYS  26   8.841  -5.173  -0.282
  193    HG2  LYS  26          2HG       LYS  26   9.859  -5.936   1.724
  194    HG3  LYS  26          1HG       LYS  26  10.318  -7.465   0.972
  195    HD2  LYS  26          2HD       LYS  26  11.861  -6.367  -0.471
  196    HD3  LYS  26          1HD       LYS  26  11.269  -4.781   0.010
  197    HE2  LYS  26          2HE       LYS  26  13.426  -5.386   1.081
  198    HE3  LYS  26          1HE       LYS  26  12.131  -5.063   2.229
  199    HZ1  LYS  26          1HZ       LYS  26  13.016  -7.764   1.375
  200    HZ2  LYS  26          2HZ       LYS  26  11.838  -7.409   2.546
  201    HZ3  LYS  26          3HZ       LYS  26  13.448  -7.005   2.812
  202    H    ASP  27           H        ASP  27   7.141  -4.636   0.759
  203    HA   ASP  27           HA       ASP  27   7.453  -4.786   3.535
  204    HB2  ASP  27          2HB       ASP  27   5.844  -2.770   1.957
  205    HB3  ASP  27          1HB       ASP  27   6.456  -2.603   3.586
  206    H    LYS  28           H        LYS  28   4.622  -5.229   1.415
  207    HA   LYS  28           HA       LYS  28   2.664  -5.886   1.625
  208    HB2  LYS  28          2HB       LYS  28   3.455  -7.074   4.291
  209    HB3  LYS  28          1HB       LYS  28   2.013  -7.420   3.326
  210    HG2  LYS  28          2HG       LYS  28   3.480  -8.180   1.472
  211    HG3  LYS  28          1HG       LYS  28   4.860  -8.000   2.549
  212    HD2  LYS  28          2HD       LYS  28   3.796  -9.632   4.092
  213    HD3  LYS  28          1HD       LYS  28   2.512  -9.859   2.905
  214    HE2  LYS  28          2HE       LYS  28   5.449 -10.483   2.548
  215    HE3  LYS  28          1HE       LYS  28   4.124 -11.633   2.663
  216    HZ1  LYS  28          1HZ       LYS  28   3.266 -10.743   0.529
  217    HZ2  LYS  28          2HZ       LYS  28   4.816 -11.368   0.397
  218    HZ3  LYS  28          3HZ       LYS  28   4.615  -9.719   0.432
  219    H    TRP  29           H        TRP  29   3.359  -3.336   2.482
  220    HA   TRP  29           HA       TRP  29   0.752  -2.735   3.555
  221    HB2  TRP  29          2HB       TRP  29   1.608  -0.843   4.902
  222    HB3  TRP  29          1HB       TRP  29   2.292  -2.353   5.461
  223    HD1  TRP  29           HD       TRP  29   3.420   0.544   3.094
  224    HE1  TRP  29          1HE       TRP  29   5.893   1.044   3.576
  225    HE3  TRP  29          3HE       TRP  29   4.293  -3.025   6.637
  226    HZ2  TRP  29          2HZ       TRP  29   7.946   0.066   5.243
  227    HZ3  TRP  29          3HZ       TRP  29   6.539  -3.160   7.637
  228    HH2  TRP  29           HH       TRP  29   8.321  -1.649   6.950
  229    H    CYS  30           H        CYS  30   0.104  -0.392   2.901
  230    HA   CYS  30           HA       CYS  30   0.667  -0.016   0.188
  231    HB2  CYS  30          2HB       CYS  30  -0.654   1.615   2.337
  232    HB3  CYS  30          1HB       CYS  30  -0.475   2.190   0.694
  233    H    LYS  31           H        LYS  31   2.331   1.065  -0.668
  234    HA   LYS  31           HA       LYS  31   3.818   2.911   1.051
  235    HB2  LYS  31          2HB       LYS  31   4.782   0.412   0.723
  236    HB3  LYS  31          1HB       LYS  31   5.212   1.144  -0.827
  237    HG2  LYS  31          2HG       LYS  31   6.625   2.744   0.179
  238    HG3  LYS  31          1HG       LYS  31   6.117   2.255   1.802
  239    HD2  LYS  31          2HD       LYS  31   7.044   0.008   1.389
  240    HD3  LYS  31          1HD       LYS  31   7.593   0.540  -0.199
  241    HE2  LYS  31          2HE       LYS  31   9.051   2.180   0.834
  242    HE3  LYS  31          1HE       LYS  31   8.445   1.735   2.429
  243    HZ1  LYS  31          1HZ       LYS  31  10.564   0.701   1.998
  244    HZ2  LYS  31          2HZ       LYS  31   9.988  -0.034   0.596
  245    HZ3  LYS  31          3HZ       LYS  31   9.377  -0.502   2.092
  246    H    TYR  32           H        TYR  32   5.400   3.969  -0.420
  247    HA   TYR  32           HA       TYR  32   4.066   4.863  -2.887
  248    HB2  TYR  32          2HB       TYR  32   4.798   6.468  -1.024
  249    HB3  TYR  32          1HB       TYR  32   6.435   6.015  -1.408
  250    HD1  TYR  32          1HD       TYR  32   7.639   7.195  -3.019
  251    HD2  TYR  32          2HD       TYR  32   3.401   7.540  -2.942
  252    HE1  TYR  32          1HE       TYR  32   7.772   8.999  -4.641
  253    HE2  TYR  32          2HE       TYR  32   3.516   9.356  -4.584
  254    HH   TYR  32           HH       TYR  32   5.227  11.064  -5.245
  255    H    GLN  33           H        GLN  33   5.555   4.972  -4.798
  256    HA   GLN  33           HA       GLN  33   7.499   2.835  -4.615
  257    HB2  GLN  33          2HB       GLN  33   5.914   3.008  -6.560
  258    HB3  GLN  33          1HB       GLN  33   6.826   4.451  -7.034
  259    HG2  GLN  33          2HG       GLN  33   8.847   3.134  -7.312
  260    HG3  GLN  33          1HG       GLN  33   8.010   1.699  -6.741
  261   HE21  GLN  33          1HE2      GLN  33   6.601   0.654  -8.081
  262   HE22  GLN  33          2HE2      GLN  33   6.549   0.936  -9.775
  263    H    ILE  34           H        ILE  34   8.308   4.403  -3.140
  264    HA   ILE  34           HA       ILE  34  10.004   6.493  -4.035
  265    HB   ILE  34           HB       ILE  34   9.155   6.655  -1.798
  266   HG12  ILE  34          2HG1      ILE  34  12.121   6.088  -1.603
  267   HG13  ILE  34          1HG1      ILE  34  11.414   7.593  -2.180
  268   HG21  ILE  34          1HG2      ILE  34   9.730   5.116   0.019
  269   HG22  ILE  34          2HG2      ILE  34  10.520   4.058  -1.150
  270   HG23  ILE  34          3HG2      ILE  34   8.784   4.348  -1.258
  271   HD11  ILE  34          1HD1      ILE  34  12.153   7.799   0.125
  272   HD12  ILE  34          2HD1      ILE  34  11.115   6.439   0.578
  273   HD13  ILE  34          3HD1      ILE  34  10.395   7.940   0.001
  Start of MODEL   12
    1    H1   ASP   1          1HT       ASP   1 -10.352  11.300   1.774
    2    H2   ASP   1          2HT       ASP   1  -8.761  10.867   1.336
    3    H3   ASP   1          3HT       ASP   1  -9.382  10.370   2.789
    4    HA   ASP   1           HA       ASP   1 -10.942   8.921   1.743
    5    HB2  ASP   1          2HB       ASP   1  -9.676   9.966  -0.795
    6    HB3  ASP   1          1HB       ASP   1 -10.738   8.566  -0.714
    7    H    CYS   2           H        CYS   2 -10.253   6.822   0.713
    8    HA   CYS   2           HA       CYS   2  -9.092   5.071   0.832
    9    HB2  CYS   2          2HB       CYS   2  -6.897   5.161  -0.384
   10    HB3  CYS   2          1HB       CYS   2  -8.361   5.475  -1.277
   11    H    LEU   3           H        LEU   3  -7.018   3.860   1.298
   12    HA   LEU   3           HA       LEU   3  -6.274   4.561   3.961
   13    HB2  LEU   3          2HB       LEU   3  -5.459   2.257   2.184
   14    HB3  LEU   3          1HB       LEU   3  -5.087   2.444   3.873
   15    HG   LEU   3           HG       LEU   3  -7.871   2.107   2.762
   16   HD11  LEU   3          1HD1      LEU   3  -6.072   0.137   4.167
   17   HD12  LEU   3          2HD1      LEU   3  -6.543   0.090   2.468
   18   HD13  LEU   3          3HD1      LEU   3  -7.757  -0.137   3.727
   19   HD21  LEU   3          1HD2      LEU   3  -6.849   2.109   5.606
   20   HD22  LEU   3          2HD2      LEU   3  -8.499   1.742   5.108
   21   HD23  LEU   3          3HD2      LEU   3  -7.845   3.359   4.859
   22    H    GLY   4           H        GLY   4  -4.261   5.131   4.587
   23    HA2  GLY   4          2HA       GLY   4  -2.587   6.385   2.601
   24    HA3  GLY   4          1HA       GLY   4  -2.378   6.452   4.346
   25    H    PHE   5           H        PHE   5  -0.026   6.102   3.585
   26    HA   PHE   5           HA       PHE   5   0.379   3.369   2.817
   27    HB2  PHE   5          2HB       PHE   5   2.747   4.068   2.407
   28    HB3  PHE   5          1HB       PHE   5   1.570   4.904   1.417
   29    HD1  PHE   5          1HD       PHE   5   1.011   7.313   1.964
   30    HD2  PHE   5          2HD       PHE   5   4.232   5.221   3.797
   31    HE1  PHE   5          1HE       PHE   5   2.039   9.447   2.601
   32    HE2  PHE   5          2HE       PHE   5   5.250   7.344   4.437
   33    HZ   PHE   5           HZ       PHE   5   4.155   9.470   3.844
   34    H    LEU   6           H        LEU   6   2.236   2.303   3.870
   35    HA   LEU   6           HA       LEU   6   3.311   1.445   5.648
   36    HB2  LEU   6          2HB       LEU   6   2.093   3.570   7.360
   37    HB3  LEU   6          1HB       LEU   6   3.453   2.536   7.800
   38    HG   LEU   6           HG       LEU   6   3.366   4.770   5.799
   39   HD11  LEU   6          1HD1      LEU   6   4.841   4.461   8.416
   40   HD12  LEU   6          2HD1      LEU   6   3.483   5.536   8.094
   41   HD13  LEU   6          3HD1      LEU   6   5.038   5.817   7.309
   42   HD21  LEU   6          1HD2      LEU   6   5.803   4.389   5.482
   43   HD22  LEU   6          2HD2      LEU   6   4.833   3.020   4.942
   44   HD23  LEU   6          3HD2      LEU   6   5.686   2.942   6.484
   45    H    TRP   7           H        TRP   7   0.061   1.809   5.230
   46    HA   TRP   7           HA       TRP   7  -0.729   0.168   7.445
   47    HB2  TRP   7          2HB       TRP   7  -2.211   1.418   5.141
   48    HB3  TRP   7          1HB       TRP   7  -2.959   0.443   6.389
   49    HD1  TRP   7           HD       TRP   7  -0.987   3.764   6.096
   50    HE1  TRP   7          1HE       TRP   7  -1.728   5.332   7.955
   51    HE3  TRP   7          3HE       TRP   7  -4.200   0.623   8.516
   52    HZ2  TRP   7          2HZ       TRP   7  -3.491   5.267  10.184
   53    HZ3  TRP   7          3HZ       TRP   7  -5.389   1.464  10.501
   54    HH2  TRP   7           HH       TRP   7  -5.036   3.740  11.311
   55    H    LYS   8           H        LYS   8  -1.428  -1.862   7.166
   56    HA   LYS   8           HA       LYS   8   0.051  -3.400   5.325
   57    HB2  LYS   8          2HB       LYS   8  -0.547  -4.132   7.610
   58    HB3  LYS   8          1HB       LYS   8  -2.222  -4.269   7.105
   59    HG2  LYS   8          2HG       LYS   8  -1.620  -6.008   5.520
   60    HG3  LYS   8          1HG       LYS   8   0.074  -5.842   5.968
   61    HD2  LYS   8          2HD       LYS   8  -0.481  -6.492   8.269
   62    HD3  LYS   8          1HD       LYS   8  -2.168  -6.698   7.792
   63    HE2  LYS   8          2HE       LYS   8   0.174  -8.202   6.640
   64    HE3  LYS   8          1HE       LYS   8  -0.941  -8.830   7.854
   65    HZ1  LYS   8          1HZ       LYS   8  -2.732  -8.625   6.245
   66    HZ2  LYS   8          2HZ       LYS   8  -1.484  -9.586   5.649
   67    HZ3  LYS   8          3HZ       LYS   8  -1.661  -8.021   5.081
   68    H    CYS   9           H        CYS   9  -0.445  -4.032   3.311
   69    HA   CYS   9           HA       CYS   9  -2.994  -3.256   2.330
   70    HB2  CYS   9          2HB       CYS   9  -2.078  -3.849   0.121
   71    HB3  CYS   9          1HB       CYS   9  -1.182  -2.613   1.019
   72    H    ASN  10           H        ASN  10  -4.420  -4.490   1.358
   73    HA   ASN  10           HA       ASN  10  -4.329  -7.360   2.024
   74    HB2  ASN  10          2HB       ASN  10  -6.038  -6.018   3.259
   75    HB3  ASN  10          1HB       ASN  10  -6.725  -5.517   1.726
   76   HD21  ASN  10          1HD2      ASN  10  -8.027  -6.879   3.885
   77   HD22  ASN  10          2HD2      ASN  10  -8.605  -8.380   3.265
   78    HA   PRO  11           HA       PRO  11  -4.272  -7.592  -2.486
   79    HB2  PRO  11          2HB       PRO  11  -4.574 -10.306  -2.680
   80    HB3  PRO  11          1HB       PRO  11  -3.033  -9.524  -2.323
   81    HG2  PRO  11          2HG       PRO  11  -4.987 -10.799  -0.449
   82    HG3  PRO  11          1HG       PRO  11  -3.217 -10.893  -0.458
   83    HD2  PRO  11          2HD       PRO  11  -4.563  -9.296   1.235
   84    HD3  PRO  11          1HD       PRO  11  -2.978  -8.842   0.577
   85    H    SER  12           H        SER  12  -6.829  -8.813  -0.433
   86    HA   SER  12           HA       SER  12  -8.579  -9.357  -2.664
   87    HB2  SER  12          2HB       SER  12  -8.802  -9.836   0.277
   88    HB3  SER  12          1HB       SER  12  -9.864 -10.432  -0.997
   89    HG   SER  12           HG       SER  12  -7.509 -11.128  -1.760
   90    H    ASN  13           H        ASN  13  -7.773  -6.853  -0.603
   91    HA   ASN  13           HA       ASN  13 -10.194  -5.431  -1.084
   92    HB2  ASN  13          2HB       ASN  13 -10.733  -6.836   0.956
   93    HB3  ASN  13          1HB       ASN  13  -9.467  -5.975   1.810
   94   HD21  ASN  13          1HD2      ASN  13 -12.318  -6.044   2.419
   95   HD22  ASN  13          2HD2      ASN  13 -12.845  -4.407   2.380
   96    H    ASP  14           H        ASP  14  -8.394  -4.560  -2.148
   97    HA   ASP  14           HA       ASP  14  -6.548  -3.060  -0.498
   98    HB2  ASP  14          2HB       ASP  14  -5.743  -4.450  -2.293
   99    HB3  ASP  14          1HB       ASP  14  -6.632  -3.499  -3.467
  100    H    LYS  15           H        LYS  15  -7.166  -1.078   0.032
  101    HA   LYS  15           HA       LYS  15  -8.592   0.470  -1.967
  102    HB2  LYS  15          2HB       LYS  15  -9.854  -0.726   0.100
  103    HB3  LYS  15          1HB       LYS  15  -9.397   0.813   0.833
  104    HG2  LYS  15          2HG       LYS  15 -10.924   0.540  -1.747
  105    HG3  LYS  15          1HG       LYS  15 -11.685   0.822  -0.181
  106    HD2  LYS  15          2HD       LYS  15 -10.513   2.906   0.060
  107    HD3  LYS  15          1HD       LYS  15  -9.587   2.564  -1.394
  108    HE2  LYS  15          2HE       LYS  15 -12.589   2.857  -1.397
  109    HE3  LYS  15          1HE       LYS  15 -11.514   4.232  -1.648
  110    HZ1  LYS  15          1HZ       LYS  15 -11.682   1.799  -3.370
  111    HZ2  LYS  15          2HZ       LYS  15 -10.605   3.074  -3.572
  112    HZ3  LYS  15          3HZ       LYS  15 -12.239   3.351  -3.746
  113    H    CYS  16           H        CYS  16  -5.918   0.394  -1.199
  114    HA   CYS  16           HA       CYS  16  -5.450   2.798   0.312
  115    HB2  CYS  16          2HB       CYS  16  -3.545   1.073  -1.293
  116    HB3  CYS  16          1HB       CYS  16  -3.049   2.489  -0.369
  117    H    CYS  17           H        CYS  17  -4.153   4.589  -0.745
  118    HA   CYS  17           HA       CYS  17  -5.748   5.636  -2.804
  119    HB2  CYS  17          2HB       CYS  17  -3.103   6.521  -1.732
  120    HB3  CYS  17          1HB       CYS  17  -4.119   7.500  -2.786
  121    H    ARG  18           H        ARG  18  -5.655   4.378  -4.619
  122    HA   ARG  18           HA       ARG  18  -3.146   3.809  -5.851
  123    HB2  ARG  18          2HB       ARG  18  -5.894   3.390  -7.048
  124    HB3  ARG  18          1HB       ARG  18  -4.406   2.592  -7.512
  125    HG2  ARG  18          2HG       ARG  18  -5.934   2.188  -4.943
  126    HG3  ARG  18          1HG       ARG  18  -5.839   1.072  -6.299
  127    HD2  ARG  18          2HD       ARG  18  -3.558   1.923  -4.515
  128    HD3  ARG  18          1HD       ARG  18  -4.395   0.374  -4.464
  129    HE   ARG  18           HE       ARG  18  -2.917   1.260  -6.843
  130   HH11  ARG  18          1HH1      ARG  18  -3.587  -1.265  -4.400
  131   HH12  ARG  18          2HH1      ARG  18  -2.452  -2.345  -5.057
  132   HH21  ARG  18          1HH2      ARG  18  -1.400  -0.247  -7.697
  133   HH22  ARG  18          2HH2      ARG  18  -1.206  -1.775  -6.972
  134    HA   PRO  19           HA       PRO  19  -2.163   3.685  -7.683
  135    HB2  PRO  19          2HB       PRO  19  -0.715   4.558  -9.656
  136    HB3  PRO  19          1HB       PRO  19  -2.419   4.079  -9.902
  137    HG2  PRO  19          2HG       PRO  19  -1.256   6.836  -9.710
  138    HG3  PRO  19          1HG       PRO  19  -2.465   6.222 -10.850
  139    HD2  PRO  19          2HD       PRO  19  -2.991   7.571  -8.450
  140    HD3  PRO  19          1HD       PRO  19  -4.161   6.633  -9.397
  141    H    ASN  20           H        ASN  20  -2.083   6.443  -6.421
  142    HA   ASN  20           HA       ASN  20   0.563   7.446  -6.193
  143    HB2  ASN  20          2HB       ASN  20  -1.385   8.708  -5.368
  144    HB3  ASN  20          1HB       ASN  20  -1.604   7.528  -4.088
  145   HD21  ASN  20          1HD2      ASN  20   1.523   8.828  -5.142
  146   HD22  ASN  20          2HD2      ASN  20   1.839   9.662  -3.668
  147    H    LEU  21           H        LEU  21  -1.113   5.042  -4.304
  148    HA   LEU  21           HA       LEU  21   1.409   4.175  -3.073
  149    HB2  LEU  21          2HB       LEU  21  -1.427   3.769  -2.207
  150    HB3  LEU  21          1HB       LEU  21   0.024   3.328  -1.336
  151    HG   LEU  21           HG       LEU  21  -0.970   6.122  -1.862
  152   HD11  LEU  21          1HD1      LEU  21  -2.239   4.977  -0.181
  153   HD12  LEU  21          2HD1      LEU  21  -1.232   6.225   0.554
  154   HD13  LEU  21          3HD1      LEU  21  -0.760   4.532   0.667
  155   HD21  LEU  21          1HD2      LEU  21   1.415   6.193  -1.922
  156   HD22  LEU  21          2HD2      LEU  21   1.544   5.162  -0.514
  157   HD23  LEU  21          3HD2      LEU  21   0.911   6.808  -0.345
  158    H    VAL  22           H        VAL  22   1.516   1.994  -2.796
  159    HA   VAL  22           HA       VAL  22  -0.036   0.290  -4.565
  160    HB   VAL  22           HB       VAL  22   1.729   1.136  -5.970
  161   HG11  VAL  22          1HG1      VAL  22   3.691   0.019  -3.965
  162   HG12  VAL  22          2HG1      VAL  22   3.434   1.718  -4.358
  163   HG13  VAL  22          3HG1      VAL  22   4.132   0.632  -5.559
  164   HG21  VAL  22          1HG2      VAL  22   1.055  -1.109  -6.452
  165   HG22  VAL  22          2HG2      VAL  22   2.183  -1.754  -5.260
  166   HG23  VAL  22          3HG2      VAL  22   2.793  -0.982  -6.724
  167    H    CYS  23           H        CYS  23   0.305  -1.914  -4.058
  168    HA   CYS  23           HA       CYS  23   0.881  -2.249  -1.236
  169    HB2  CYS  23          2HB       CYS  23  -1.110  -3.317  -1.980
  170    HB3  CYS  23          1HB       CYS  23  -0.262  -4.128  -3.294
  171    H    SER  24           H        SER  24   2.636  -2.939  -0.501
  172    HA   SER  24           HA       SER  24   4.695  -3.915  -2.299
  173    HB2  SER  24          2HB       SER  24   5.284  -2.093  -0.737
  174    HB3  SER  24          1HB       SER  24   4.786  -3.093   0.623
  175    HG   SER  24           HG       SER  24   7.061  -3.024   0.253
  176    H    ARG  25           H        ARG  25   4.769  -6.061  -2.560
  177    HA   ARG  25           HA       ARG  25   3.438  -7.903  -0.845
  178    HB2  ARG  25          2HB       ARG  25   3.803  -8.264  -3.280
  179    HB3  ARG  25          1HB       ARG  25   5.526  -8.376  -2.992
  180    HG2  ARG  25          2HG       ARG  25   5.184 -10.418  -1.699
  181    HG3  ARG  25          1HG       ARG  25   3.443 -10.290  -1.959
  182    HD2  ARG  25          2HD       ARG  25   5.516 -10.563  -4.142
  183    HD3  ARG  25          1HD       ARG  25   4.510 -11.875  -3.534
  184    HE   ARG  25           HE       ARG  25   2.717 -10.006  -4.281
  185   HH11  ARG  25          1HH1      ARG  25   5.394 -11.545  -6.036
  186   HH12  ARG  25          2HH1      ARG  25   4.661 -11.412  -7.560
  187   HH21  ARG  25          1HH2      ARG  25   1.700  -9.838  -6.346
  188   HH22  ARG  25          2HH2      ARG  25   2.479 -10.413  -7.741
  189    H    LYS  26           H        LYS  26   6.576  -6.582  -1.060
  190    HA   LYS  26           HA       LYS  26   8.055  -8.388   0.566
  191    HB2  LYS  26          2HB       LYS  26   8.990  -6.728  -1.072
  192    HB3  LYS  26          1HB       LYS  26   8.526  -5.468   0.031
  193    HG2  LYS  26          2HG       LYS  26  10.873  -5.868   0.303
  194    HG3  LYS  26          1HG       LYS  26  10.026  -6.407   1.754
  195    HD2  LYS  26          2HD       LYS  26  10.152  -8.723   0.954
  196    HD3  LYS  26          1HD       LYS  26  10.982  -8.167  -0.501
  197    HE2  LYS  26          2HE       LYS  26  11.987  -7.906   2.332
  198    HE3  LYS  26          1HE       LYS  26  12.563  -9.061   1.133
  199    HZ1  LYS  26          1HZ       LYS  26  14.053  -7.217   1.272
  200    HZ2  LYS  26          2HZ       LYS  26  12.849  -6.095   1.030
  201    HZ3  LYS  26          3HZ       LYS  26  13.296  -7.128  -0.221
  202    H    ASP  27           H        ASP  27   6.847  -5.094   1.166
  203    HA   ASP  27           HA       ASP  27   7.475  -5.220   3.947
  204    HB2  ASP  27          2HB       ASP  27   5.987  -3.172   2.340
  205    HB3  ASP  27          1HB       ASP  27   6.503  -2.996   4.006
  206    H    LYS  28           H        LYS  28   4.678  -5.847   2.010
  207    HA   LYS  28           HA       LYS  28   2.714  -6.599   2.349
  208    HB2  LYS  28          2HB       LYS  28   3.307  -6.714   5.310
  209    HB3  LYS  28          1HB       LYS  28   1.980  -7.432   4.401
  210    HG2  LYS  28          2HG       LYS  28   3.375  -8.984   3.312
  211    HG3  LYS  28          1HG       LYS  28   4.835  -8.158   3.851
  212    HD2  LYS  28          2HD       LYS  28   2.889  -9.421   5.774
  213    HD3  LYS  28          1HD       LYS  28   4.198 -10.332   5.039
  214    HE2  LYS  28          2HE       LYS  28   4.844  -9.585   7.262
  215    HE3  LYS  28          1HE       LYS  28   5.838  -8.798   6.050
  216    HZ1  LYS  28          1HZ       LYS  28   5.086  -7.337   7.883
  217    HZ2  LYS  28          2HZ       LYS  28   3.500  -7.530   7.403
  218    HZ3  LYS  28          3HZ       LYS  28   4.601  -6.753   6.388
  219    H    TRP  29           H        TRP  29   3.625  -3.719   2.824
  220    HA   TRP  29           HA       TRP  29   0.969  -2.862   3.659
  221    HB2  TRP  29          2HB       TRP  29   1.823  -0.886   4.765
  222    HB3  TRP  29          1HB       TRP  29   2.583  -2.297   5.461
  223    HD1  TRP  29           HD       TRP  29   3.557   0.284   2.684
  224    HE1  TRP  29          1HE       TRP  29   5.988   0.983   3.055
  225    HE3  TRP  29          3HE       TRP  29   4.590  -2.636   6.719
  226    HZ2  TRP  29          2HZ       TRP  29   8.094   0.378   4.858
  227    HZ3  TRP  29          3HZ       TRP  29   6.839  -2.505   7.724
  228    HH2  TRP  29           HH       TRP  29   8.546  -1.029   6.803
  229    H    CYS  30           H        CYS  30   0.270  -0.767   2.772
  230    HA   CYS  30           HA       CYS  30   0.934  -0.511   0.061
  231    HB2  CYS  30          2HB       CYS  30  -0.667   1.147   2.013
  232    HB3  CYS  30          1HB       CYS  30  -0.545   1.490   0.294
  233    H    LYS  31           H        LYS  31   2.497   0.699  -0.753
  234    HA   LYS  31           HA       LYS  31   4.123   2.273   1.117
  235    HB2  LYS  31          2HB       LYS  31   4.905  -0.034  -0.089
  236    HB3  LYS  31          1HB       LYS  31   5.153   1.128  -1.388
  237    HG2  LYS  31          2HG       LYS  31   6.700   2.390  -0.018
  238    HG3  LYS  31          1HG       LYS  31   6.485   1.215   1.287
  239    HD2  LYS  31          2HD       LYS  31   7.266  -0.563  -0.266
  240    HD3  LYS  31          1HD       LYS  31   7.604   0.685  -1.464
  241    HE2  LYS  31          2HE       LYS  31   9.656   0.140  -0.343
  242    HE3  LYS  31          1HE       LYS  31   9.152   1.741   0.184
  243    HZ1  LYS  31          1HZ       LYS  31   9.927   0.362   1.998
  244    HZ2  LYS  31          2HZ       LYS  31   8.729  -0.787   1.674
  245    HZ3  LYS  31          3HZ       LYS  31   8.304   0.760   2.218
  246    H    TYR  32           H        TYR  32   5.473   3.740  -0.436
  247    HA   TYR  32           HA       TYR  32   3.526   5.317  -1.906
  248    HB2  TYR  32          2HB       TYR  32   5.528   6.154  -0.384
  249    HB3  TYR  32          1HB       TYR  32   6.443   5.894  -1.831
  250    HD1  TYR  32          1HD       TYR  32   6.434   7.419  -3.652
  251    HD2  TYR  32          2HD       TYR  32   3.582   7.832  -0.523
  252    HE1  TYR  32          1HE       TYR  32   5.764   9.584  -4.563
  253    HE2  TYR  32          2HE       TYR  32   2.904   9.998  -1.417
  254    HH   TYR  32           HH       TYR  32   3.710  11.769  -2.854
  255    H    GLN  33           H        GLN  33   3.617   5.666  -4.108
  256    HA   GLN  33           HA       GLN  33   5.129   3.794  -5.641
  257    HB2  GLN  33          2HB       GLN  33   2.894   4.446  -6.309
  258    HB3  GLN  33          1HB       GLN  33   3.444   6.114  -6.472
  259    HG2  GLN  33          2HG       GLN  33   3.145   4.902  -8.637
  260    HG3  GLN  33          1HG       GLN  33   4.754   5.573  -8.391
  261   HE21  GLN  33          1HE2      GLN  33   6.472   4.216  -8.269
  262   HE22  GLN  33          2HE2      GLN  33   6.382   2.525  -8.553
  263    H    ILE  34           H        ILE  34   6.878   4.585  -4.569
  264    HA   ILE  34           HA       ILE  34   8.491   6.781  -5.084
  265    HB   ILE  34           HB       ILE  34   9.412   3.895  -4.932
  266   HG12  ILE  34          2HG1      ILE  34   8.120   4.531  -2.955
  267   HG13  ILE  34          1HG1      ILE  34   9.817   4.340  -2.543
  268   HG21  ILE  34          1HG2      ILE  34  11.582   4.779  -4.208
  269   HG22  ILE  34          2HG2      ILE  34  10.994   6.417  -4.487
  270   HG23  ILE  34          3HG2      ILE  34  11.167   5.303  -5.843
  271   HD11  ILE  34          1HD1      ILE  34   8.365   6.949  -2.948
  272   HD12  ILE  34          2HD1      ILE  34  10.080   6.781  -2.590
  273   HD13  ILE  34          3HD1      ILE  34   8.878   6.253  -1.410
  Start of MODEL   13
    1    H1   ASP   1          1HT       ASP   1 -12.960   6.553   3.257
    2    H2   ASP   1          2HT       ASP   1 -11.637   5.714   3.905
    3    H3   ASP   1          3HT       ASP   1 -12.633   4.957   2.794
    4    HA   ASP   1           HA       ASP   1 -11.930   6.440   1.064
    5    HB2  ASP   1          2HB       ASP   1 -11.524   8.374   2.596
    6    HB3  ASP   1          1HB       ASP   1 -10.118   7.548   3.251
    7    H    CYS   2           H        CYS   2  -9.276   6.429   0.538
    8    HA   CYS   2           HA       CYS   2  -8.760   3.614   0.580
    9    HB2  CYS   2          2HB       CYS   2  -6.640   4.313  -0.625
   10    HB3  CYS   2          1HB       CYS   2  -8.154   4.557  -1.457
   11    H    LEU   3           H        LEU   3  -6.449   2.943   0.976
   12    HA   LEU   3           HA       LEU   3  -5.852   3.617   3.701
   13    HB2  LEU   3          2HB       LEU   3  -4.747   1.551   1.811
   14    HB3  LEU   3          1HB       LEU   3  -4.260   1.762   3.469
   15    HG   LEU   3           HG       LEU   3  -7.022   1.000   2.555
   16   HD11  LEU   3          1HD1      LEU   3  -5.406  -0.768   2.094
   17   HD12  LEU   3          2HD1      LEU   3  -6.469  -1.230   3.424
   18   HD13  LEU   3          3HD1      LEU   3  -4.825  -0.688   3.758
   19   HD21  LEU   3          1HD2      LEU   3  -7.370   0.451   4.942
   20   HD22  LEU   3          2HD2      LEU   3  -7.075   2.167   4.679
   21   HD23  LEU   3          3HD2      LEU   3  -5.787   1.137   5.309
   22    H    GLY   4           H        GLY   4  -4.329   4.924   4.234
   23    HA2  GLY   4          2HA       GLY   4  -2.628   6.165   2.277
   24    HA3  GLY   4          1HA       GLY   4  -2.645   6.506   4.004
   25    H    PHE   5           H        PHE   5  -0.169   6.467   3.601
   26    HA   PHE   5           HA       PHE   5   0.784   3.839   3.052
   27    HB2  PHE   5          2HB       PHE   5   3.045   4.948   3.150
   28    HB3  PHE   5          1HB       PHE   5   1.989   5.567   1.895
   29    HD1  PHE   5          1HD       PHE   5   3.941   6.352   4.820
   30    HD2  PHE   5          2HD       PHE   5   0.888   7.810   2.230
   31    HE1  PHE   5          1HE       PHE   5   4.327   8.629   5.638
   32    HE2  PHE   5          2HE       PHE   5   1.284  10.086   3.051
   33    HZ   PHE   5           HZ       PHE   5   2.998  10.497   4.750
   34    H    LEU   6           H        LEU   6   2.212   2.824   4.439
   35    HA   LEU   6           HA       LEU   6   3.118   2.102   6.366
   36    HB2  LEU   6          2HB       LEU   6   1.664   4.262   7.825
   37    HB3  LEU   6          1HB       LEU   6   3.025   3.316   8.437
   38    HG   LEU   6           HG       LEU   6   3.040   5.407   6.280
   39   HD11  LEU   6          1HD1      LEU   6   4.244   5.418   9.057
   40   HD12  LEU   6          2HD1      LEU   6   2.842   6.342   8.520
   41   HD13  LEU   6          3HD1      LEU   6   4.439   6.700   7.862
   42   HD21  LEU   6          1HD2      LEU   6   5.346   3.788   7.383
   43   HD22  LEU   6          2HD2      LEU   6   5.508   5.155   6.281
   44   HD23  LEU   6          3HD2      LEU   6   4.676   3.692   5.754
   45    H    TRP   7           H        TRP   7  -0.151   2.438   5.636
   46    HA   TRP   7           HA       TRP   7  -1.068   1.016   7.900
   47    HB2  TRP   7          2HB       TRP   7  -2.425   1.986   5.426
   48    HB3  TRP   7          1HB       TRP   7  -3.235   1.141   6.729
   49    HD1  TRP   7           HD       TRP   7  -1.616   4.427   5.926
   50    HE1  TRP   7          1HE       TRP   7  -2.202   6.170   7.771
   51    HE3  TRP   7          3HE       TRP   7  -3.909   1.325   9.196
   52    HZ2  TRP   7          2HZ       TRP   7  -3.465   6.162  10.270
   53    HZ3  TRP   7          3HZ       TRP   7  -4.772   2.253  11.301
   54    HH2  TRP   7           HH       TRP   7  -4.552   4.621  11.816
   55    H    LYS   8           H        LYS   8  -1.761  -1.048   7.876
   56    HA   LYS   8           HA       LYS   8  -0.401  -2.940   6.330
   57    HB2  LYS   8          2HB       LYS   8  -1.314  -3.326   8.600
   58    HB3  LYS   8          1HB       LYS   8  -2.939  -3.258   7.947
   59    HG2  LYS   8          2HG       LYS   8  -2.371  -5.533   8.304
   60    HG3  LYS   8          1HG       LYS   8  -2.399  -5.242   6.563
   61    HD2  LYS   8          2HD       LYS   8   0.047  -5.053   6.555
   62    HD3  LYS   8          1HD       LYS   8   0.074  -5.334   8.296
   63    HE2  LYS   8          2HE       LYS   8  -0.934  -7.269   6.211
   64    HE3  LYS   8          1HE       LYS   8   0.625  -7.359   7.023
   65    HZ1  LYS   8          1HZ       LYS   8  -2.038  -7.595   8.332
   66    HZ2  LYS   8          2HZ       LYS   8  -0.577  -7.638   9.142
   67    HZ3  LYS   8          3HZ       LYS   8  -0.965  -8.845   8.029
   68    H    CYS   9           H        CYS   9  -0.765  -3.476   4.223
   69    HA   CYS   9           HA       CYS   9  -3.332  -2.795   3.092
   70    HB2  CYS   9          2HB       CYS   9  -2.245  -3.122   0.931
   71    HB3  CYS   9          1HB       CYS   9  -1.334  -2.025   1.966
   72    H    ASN  10           H        ASN  10  -3.887  -4.493   1.192
   73    HA   ASN  10           HA       ASN  10  -3.716  -7.192   2.235
   74    HB2  ASN  10          2HB       ASN  10  -5.725  -6.095   3.251
   75    HB3  ASN  10          1HB       ASN  10  -6.305  -5.728   1.639
   76   HD21  ASN  10          1HD2      ASN  10  -7.481  -7.246   3.799
   77   HD22  ASN  10          2HD2      ASN  10  -7.831  -8.812   3.184
   78    HA   PRO  11           HA       PRO  11  -3.136  -7.369  -2.218
   79    HB2  PRO  11          2HB       PRO  11  -2.949 -10.073  -2.448
   80    HB3  PRO  11          1HB       PRO  11  -1.629  -9.043  -1.897
   81    HG2  PRO  11          2HG       PRO  11  -3.534 -10.695  -0.287
   82    HG3  PRO  11          1HG       PRO  11  -1.789 -10.470  -0.071
   83    HD2  PRO  11          2HD       PRO  11  -3.627  -9.176   1.429
   84    HD3  PRO  11          1HD       PRO  11  -2.056  -8.458   1.016
   85    H    SER  12           H        SER  12  -5.720  -8.905  -0.464
   86    HA   SER  12           HA       SER  12  -7.095  -9.718  -2.879
   87    HB2  SER  12          2HB       SER  12  -7.570 -10.139   0.042
   88    HB3  SER  12          1HB       SER  12  -8.530 -10.808  -1.276
   89    HG   SER  12           HG       SER  12  -5.908 -11.272  -1.662
   90    H    ASN  13           H        ASN  13  -6.753  -7.045  -1.076
   91    HA   ASN  13           HA       ASN  13  -9.194  -5.831  -1.844
   92    HB2  ASN  13          2HB       ASN  13  -9.818  -7.065   0.286
   93    HB3  ASN  13          1HB       ASN  13  -8.658  -6.059   1.131
   94   HD21  ASN  13          1HD2      ASN  13 -11.465  -6.180   1.618
   95   HD22  ASN  13          2HD2      ASN  13 -12.106  -4.599   1.347
   96    H    ASP  14           H        ASP  14  -7.337  -4.996  -2.824
   97    HA   ASP  14           HA       ASP  14  -5.517  -3.478  -1.189
   98    HB2  ASP  14          2HB       ASP  14  -4.813  -4.829  -3.077
   99    HB3  ASP  14          1HB       ASP  14  -5.666  -3.762  -4.183
  100    H    LYS  15           H        LYS  15  -6.223  -1.690  -0.494
  101    HA   LYS  15           HA       LYS  15  -7.872  -0.040  -2.193
  102    HB2  LYS  15          2HB       LYS  15  -8.376  -1.261   0.292
  103    HB3  LYS  15          1HB       LYS  15  -8.302   0.484   0.551
  104    HG2  LYS  15          2HG       LYS  15 -10.078  -0.982  -1.399
  105    HG3  LYS  15          1HG       LYS  15 -10.592  -0.219   0.107
  106    HD2  LYS  15          2HD       LYS  15  -9.863   1.942  -0.750
  107    HD3  LYS  15          1HD       LYS  15  -9.352   1.169  -2.247
  108    HE2  LYS  15          2HE       LYS  15 -11.685   0.428  -2.626
  109    HE3  LYS  15          1HE       LYS  15 -12.166   1.301  -1.174
  110    HZ1  LYS  15          1HZ       LYS  15 -12.571   2.576  -3.194
  111    HZ2  LYS  15          2HZ       LYS  15 -10.938   2.529  -3.572
  112    HZ3  LYS  15          3HZ       LYS  15 -11.457   3.361  -2.205
  113    H    CYS  16           H        CYS  16  -4.926  -0.159  -1.682
  114    HA   CYS  16           HA       CYS  16  -4.295   2.029   0.017
  115    HB2  CYS  16          2HB       CYS  16  -2.652   0.895  -2.264
  116    HB3  CYS  16          1HB       CYS  16  -2.060   1.909  -0.951
  117    H    CYS  17           H        CYS  17  -3.631   4.184  -0.677
  118    HA   CYS  17           HA       CYS  17  -5.376   5.232  -2.639
  119    HB2  CYS  17          2HB       CYS  17  -3.089   6.563  -1.217
  120    HB3  CYS  17          1HB       CYS  17  -4.243   7.407  -2.221
  121    H    ARG  18           H        ARG  18  -4.651   3.895  -4.407
  122    HA   ARG  18           HA       ARG  18  -2.216   4.347  -5.678
  123    HB2  ARG  18          2HB       ARG  18  -3.246   3.132  -7.626
  124    HB3  ARG  18          1HB       ARG  18  -3.322   2.272  -6.105
  125    HG2  ARG  18          2HG       ARG  18  -5.377   1.901  -7.253
  126    HG3  ARG  18          1HG       ARG  18  -5.730   3.014  -5.938
  127    HD2  ARG  18          2HD       ARG  18  -6.852   3.628  -8.057
  128    HD3  ARG  18          1HD       ARG  18  -5.749   4.874  -7.475
  129    HE   ARG  18           HE       ARG  18  -4.553   3.052  -9.334
  130   HH11  ARG  18          1HH1      ARG  18  -6.461   6.025  -9.068
  131   HH12  ARG  18          2HH1      ARG  18  -5.979   6.652 -10.576
  132   HH21  ARG  18          1HH2      ARG  18  -3.842   3.926 -11.400
  133   HH22  ARG  18          2HH2      ARG  18  -4.463   5.409 -11.942
  134    HA   PRO  19           HA       PRO  19  -1.501   4.171  -7.801
  135    HB2  PRO  19          2HB       PRO  19  -0.101   5.387  -9.657
  136    HB3  PRO  19          1HB       PRO  19  -1.787   4.882  -9.945
  137    HG2  PRO  19          2HG       PRO  19  -0.741   7.617  -9.334
  138    HG3  PRO  19          1HG       PRO  19  -1.915   7.122 -10.568
  139    HD2  PRO  19          2HD       PRO  19  -2.556   8.107  -8.040
  140    HD3  PRO  19          1HD       PRO  19  -3.647   7.170  -9.081
  141    H    ASN  20           H        ASN  20  -1.373   6.982  -6.304
  142    HA   ASN  20           HA       ASN  20   1.308   7.724  -6.000
  143    HB2  ASN  20          2HB       ASN  20  -0.583   7.874  -3.689
  144    HB3  ASN  20          1HB       ASN  20   0.609   9.026  -4.276
  145   HD21  ASN  20          1HD2      ASN  20  -2.562   7.813  -4.608
  146   HD22  ASN  20          2HD2      ASN  20  -3.208   9.109  -5.562
  147    H    LEU  21           H        LEU  21  -0.824   5.688  -3.959
  148    HA   LEU  21           HA       LEU  21   1.548   4.479  -2.835
  149    HB2  LEU  21          2HB       LEU  21  -1.196   4.516  -1.675
  150    HB3  LEU  21          1HB       LEU  21   0.289   4.061  -0.915
  151    HG   LEU  21           HG       LEU  21  -0.354   6.903  -1.716
  152   HD11  LEU  21          1HD1      LEU  21  -0.585   7.359   0.632
  153   HD12  LEU  21          2HD1      LEU  21  -0.261   5.673   1.012
  154   HD13  LEU  21          3HD1      LEU  21  -1.731   6.106   0.151
  155   HD21  LEU  21          1HD2      LEU  21   2.019   6.513  -1.791
  156   HD22  LEU  21          2HD2      LEU  21   1.983   5.719  -0.222
  157   HD23  LEU  21          3HD2      LEU  21   1.648   7.449  -0.340
  158    H    VAL  22           H        VAL  22   1.401   2.290  -2.524
  159    HA   VAL  22           HA       VAL  22  -0.673   0.706  -3.850
  160    HB   VAL  22           HB       VAL  22   2.244   0.442  -4.474
  161   HG11  VAL  22          1HG1      VAL  22  -0.089  -1.086  -5.631
  162   HG12  VAL  22          2HG1      VAL  22   1.148  -1.727  -4.550
  163   HG13  VAL  22          3HG1      VAL  22   1.577  -1.237  -6.189
  164   HG21  VAL  22          1HG2      VAL  22   1.719   1.086  -6.811
  165   HG22  VAL  22          2HG2      VAL  22   1.378   2.372  -5.650
  166   HG23  VAL  22          3HG2      VAL  22   0.059   1.409  -6.311
  167    H    CYS  23           H        CYS  23  -0.657  -1.492  -3.049
  168    HA   CYS  23           HA       CYS  23   0.349  -1.826  -0.430
  169    HB2  CYS  23          2HB       CYS  23  -1.668  -2.953  -1.096
  170    HB3  CYS  23          1HB       CYS  23  -0.825  -3.766  -2.412
  171    H    SER  24           H        SER  24   2.188  -2.477   0.149
  172    HA   SER  24           HA       SER  24   4.119  -3.317  -1.840
  173    HB2  SER  24          2HB       SER  24   4.818  -1.591  -0.248
  174    HB3  SER  24          1HB       SER  24   4.451  -2.669   1.098
  175    HG   SER  24           HG       SER  24   6.700  -2.621   0.553
  176    H    ARG  25           H        ARG  25   4.365  -5.396  -2.244
  177    HA   ARG  25           HA       ARG  25   3.291  -7.388  -0.474
  178    HB2  ARG  25          2HB       ARG  25   3.214  -7.627  -2.953
  179    HB3  ARG  25          1HB       ARG  25   4.966  -7.727  -2.979
  180    HG2  ARG  25          2HG       ARG  25   4.928  -9.807  -1.803
  181    HG3  ARG  25          1HG       ARG  25   3.189  -9.700  -1.554
  182    HD2  ARG  25          2HD       ARG  25   2.903  -9.734  -4.026
  183    HD3  ARG  25          1HD       ARG  25   4.641  -9.990  -4.178
  184    HE   ARG  25           HE       ARG  25   3.880 -11.968  -2.520
  185   HH11  ARG  25          1HH1      ARG  25   2.752 -10.971  -5.760
  186   HH12  ARG  25          2HH1      ARG  25   2.224 -12.545  -6.153
  187   HH21  ARG  25          1HH2      ARG  25   3.162 -14.125  -3.160
  188   HH22  ARG  25          2HH2      ARG  25   2.487 -14.328  -4.707
  189    H    LYS  26           H        LYS  26   6.144  -5.718  -0.735
  190    HA   LYS  26           HA       LYS  26   7.909  -7.695   0.418
  191    HB2  LYS  26          2HB       LYS  26   8.603  -5.797  -1.129
  192    HB3  LYS  26          1HB       LYS  26   8.265  -4.717   0.187
  193    HG2  LYS  26          2HG       LYS  26  10.628  -5.080   0.162
  194    HG3  LYS  26          1HG       LYS  26   9.956  -5.873   1.584
  195    HD2  LYS  26          2HD       LYS  26  11.620  -7.307   0.546
  196    HD3  LYS  26          1HD       LYS  26  10.027  -8.039   0.369
  197    HE2  LYS  26          2HE       LYS  26   9.888  -7.223  -1.923
  198    HE3  LYS  26          1HE       LYS  26  11.437  -6.407  -1.745
  199    HZ1  LYS  26          1HZ       LYS  26  11.644  -8.497  -2.922
  200    HZ2  LYS  26          2HZ       LYS  26  11.003  -9.348  -1.646
  201    HZ3  LYS  26          3HZ       LYS  26  12.496  -8.564  -1.474
  202    H    ASP  27           H        ASP  27   6.521  -4.585   1.392
  203    HA   ASP  27           HA       ASP  27   7.410  -4.865   4.110
  204    HB2  ASP  27          2HB       ASP  27   5.795  -2.718   2.777
  205    HB3  ASP  27          1HB       ASP  27   6.546  -2.644   4.358
  206    H    LYS  28           H        LYS  28   4.382  -5.241   2.342
  207    HA   LYS  28           HA       LYS  28   2.439  -5.877   2.782
  208    HB2  LYS  28          2HB       LYS  28   3.304  -6.477   5.618
  209    HB3  LYS  28          1HB       LYS  28   1.778  -6.878   4.821
  210    HG2  LYS  28          2HG       LYS  28   4.482  -7.913   3.995
  211    HG3  LYS  28          1HG       LYS  28   3.255  -8.826   4.877
  212    HD2  LYS  28          2HD       LYS  28   1.707  -8.530   2.965
  213    HD3  LYS  28          1HD       LYS  28   2.983  -7.687   2.089
  214    HE2  LYS  28          2HE       LYS  28   2.926  -9.943   1.324
  215    HE3  LYS  28          1HE       LYS  28   4.383  -9.715   2.279
  216    HZ1  LYS  28          1HZ       LYS  28   1.884 -10.949   3.278
  217    HZ2  LYS  28          2HZ       LYS  28   3.339 -10.819   4.133
  218    HZ3  LYS  28          3HZ       LYS  28   3.244 -11.795   2.768
  219    H    TRP  29           H        TRP  29   3.459  -3.118   3.453
  220    HA   TRP  29           HA       TRP  29   0.816  -2.304   4.357
  221    HB2  TRP  29          2HB       TRP  29   1.730  -0.300   5.451
  222    HB3  TRP  29          1HB       TRP  29   2.397  -1.748   6.170
  223    HD1  TRP  29           HD       TRP  29   3.466   1.071   3.709
  224    HE1  TRP  29          1HE       TRP  29   6.002   1.476   4.013
  225    HE3  TRP  29          3HE       TRP  29   4.506  -2.660   7.043
  226    HZ2  TRP  29          2HZ       TRP  29   8.134   0.372   5.459
  227    HZ3  TRP  29          3HZ       TRP  29   6.812  -2.906   7.839
  228    HH2  TRP  29           HH       TRP  29   8.588  -1.424   7.064
  229    H    CYS  30           H        CYS  30   0.044  -0.222   3.419
  230    HA   CYS  30           HA       CYS  30   0.641  -0.001   0.694
  231    HB2  CYS  30          2HB       CYS  30  -0.721   1.880   2.628
  232    HB3  CYS  30          1HB       CYS  30  -0.755   1.986   0.880
  233    H    LYS  31           H        LYS  31   2.192   1.211  -0.217
  234    HA   LYS  31           HA       LYS  31   3.564   3.196   1.430
  235    HB2  LYS  31          2HB       LYS  31   4.668   0.757   1.267
  236    HB3  LYS  31          1HB       LYS  31   5.050   1.371  -0.346
  237    HG2  LYS  31          2HG       LYS  31   6.378   3.118   0.502
  238    HG3  LYS  31          1HG       LYS  31   5.877   2.768   2.159
  239    HD2  LYS  31          2HD       LYS  31   8.102   1.887   1.763
  240    HD3  LYS  31          1HD       LYS  31   6.966   0.562   1.983
  241    HE2  LYS  31          2HE       LYS  31   6.860   0.224  -0.422
  242    HE3  LYS  31          1HE       LYS  31   7.931   1.601  -0.679
  243    HZ1  LYS  31          1HZ       LYS  31   8.600  -0.899   0.755
  244    HZ2  LYS  31          2HZ       LYS  31   9.661   0.410   0.523
  245    HZ3  LYS  31          3HZ       LYS  31   9.116  -0.488  -0.798
  246    H    TYR  32           H        TYR  32   5.180   4.195  -0.222
  247    HA   TYR  32           HA       TYR  32   3.656   5.340  -2.360
  248    HB2  TYR  32          2HB       TYR  32   5.526   6.470  -1.079
  249    HB3  TYR  32          1HB       TYR  32   6.638   5.412  -1.900
  250    HD1  TYR  32          1HD       TYR  32   4.109   8.073  -2.564
  251    HD2  TYR  32          2HD       TYR  32   7.549   6.008  -3.959
  252    HE1  TYR  32          1HE       TYR  32   4.349   9.699  -4.384
  253    HE2  TYR  32          2HE       TYR  32   7.795   7.604  -5.766
  254    HH   TYR  32           HH       TYR  32   6.216  10.539  -5.825
  255    H    GLN  33           H        GLN  33   4.107   5.075  -4.603
  256    HA   GLN  33           HA       GLN  33   5.006   2.405  -5.271
  257    HB2  GLN  33          2HB       GLN  33   3.052   3.592  -6.405
  258    HB3  GLN  33          1HB       GLN  33   4.296   4.563  -7.204
  259    HG2  GLN  33          2HG       GLN  33   5.260   2.525  -8.190
  260    HG3  GLN  33          1HG       GLN  33   4.003   1.569  -7.427
  261   HE21  GLN  33          1HE2      GLN  33   1.940   3.650  -8.008
  262   HE22  GLN  33          2HE2      GLN  33   1.601   3.441  -9.679
  263    H    ILE  34           H        ILE  34   6.863   3.336  -4.210
  264    HA   ILE  34           HA       ILE  34   8.839   4.766  -5.645
  265    HB   ILE  34           HB       ILE  34   8.943   4.698  -3.238
  266   HG12  ILE  34          2HG1      ILE  34  11.300   3.172  -4.347
  267   HG13  ILE  34          1HG1      ILE  34  11.084   4.918  -4.441
  268   HG21  ILE  34          1HG2      ILE  34   9.336   1.728  -3.427
  269   HG22  ILE  34          2HG2      ILE  34   7.933   2.574  -2.775
  270   HG23  ILE  34          3HG2      ILE  34   9.492   2.688  -1.956
  271   HD11  ILE  34          1HD1      ILE  34  11.387   3.281  -1.949
  272   HD12  ILE  34          2HD1      ILE  34  11.068   5.010  -2.002
  273   HD13  ILE  34          3HD1      ILE  34  12.591   4.375  -2.651
  Start of MODEL   14
    1    H1   ASP   1          1HT       ASP   1 -12.120   7.705   3.077
    2    H2   ASP   1          2HT       ASP   1 -11.810   9.363   3.229
    3    H3   ASP   1          3HT       ASP   1 -10.740   8.209   3.867
    4    HA   ASP   1           HA       ASP   1 -11.293   8.528   0.991
    5    HB2  ASP   1          2HB       ASP   1  -8.883   9.259   2.677
    6    HB3  ASP   1          1HB       ASP   1  -8.880   9.216   0.921
    7    H    CYS   2           H        CYS   2  -8.951   7.535   0.121
    8    HA   CYS   2           HA       CYS   2  -9.144   4.761   0.705
    9    HB2  CYS   2          2HB       CYS   2  -6.990   4.832  -0.725
   10    HB3  CYS   2          1HB       CYS   2  -8.542   5.088  -1.484
   11    H    LEU   3           H        LEU   3  -7.094   3.541   1.157
   12    HA   LEU   3           HA       LEU   3  -6.126   4.431   3.656
   13    HB2  LEU   3          2HB       LEU   3  -5.291   2.055   1.986
   14    HB3  LEU   3          1HB       LEU   3  -4.852   2.385   3.633
   15    HG   LEU   3           HG       LEU   3  -7.664   1.851   2.699
   16   HD11  LEU   3          1HD1      LEU   3  -6.250  -0.121   2.477
   17   HD12  LEU   3          2HD1      LEU   3  -7.393  -0.314   3.806
   18   HD13  LEU   3          3HD1      LEU   3  -5.706   0.069   4.143
   19   HD21  LEU   3          1HD2      LEU   3  -6.491   2.084   5.470
   20   HD22  LEU   3          2HD2      LEU   3  -8.152   1.631   5.084
   21   HD23  LEU   3          3HD2      LEU   3  -7.566   3.249   4.695
   22    H    GLY   4           H        GLY   4  -4.328   5.375   4.132
   23    HA2  GLY   4          2HA       GLY   4  -2.603   6.459   2.135
   24    HA3  GLY   4          1HA       GLY   4  -2.462   6.659   3.878
   25    H    PHE   5           H        PHE   5  -0.072   6.373   3.248
   26    HA   PHE   5           HA       PHE   5   0.556   3.657   2.619
   27    HB2  PHE   5          2HB       PHE   5   2.927   4.476   2.602
   28    HB3  PHE   5          1HB       PHE   5   1.903   5.291   1.435
   29    HD1  PHE   5          1HD       PHE   5   1.194   7.664   1.901
   30    HD2  PHE   5          2HD       PHE   5   4.074   5.632   4.292
   31    HE1  PHE   5          1HE       PHE   5   1.988   9.812   2.782
   32    HE2  PHE   5          2HE       PHE   5   4.854   7.778   5.179
   33    HZ   PHE   5           HZ       PHE   5   3.817   9.869   4.427
   34    H    LEU   6           H        LEU   6   2.151   2.593   3.971
   35    HA   LEU   6           HA       LEU   6   2.948   1.750   5.890
   36    HB2  LEU   6          2HB       LEU   6   1.569   3.921   7.414
   37    HB3  LEU   6          1HB       LEU   6   2.886   2.893   7.982
   38    HG   LEU   6           HG       LEU   6   3.013   5.082   5.936
   39   HD11  LEU   6          1HD1      LEU   6   4.426   6.238   7.605
   40   HD12  LEU   6          2HD1      LEU   6   4.161   4.907   8.731
   41   HD13  LEU   6          3HD1      LEU   6   2.805   5.911   8.217
   42   HD21  LEU   6          1HD2      LEU   6   4.592   3.308   5.364
   43   HD22  LEU   6          2HD2      LEU   6   5.242   3.325   7.005
   44   HD23  LEU   6          3HD2      LEU   6   5.466   4.722   5.952
   45    H    TRP   7           H        TRP   7  -0.088   1.899   4.836
   46    HA   TRP   7           HA       TRP   7  -1.249   0.458   7.048
   47    HB2  TRP   7          2HB       TRP   7  -2.362   1.601   4.505
   48    HB3  TRP   7          1HB       TRP   7  -3.288   0.653   5.639
   49    HD1  TRP   7           HD       TRP   7  -1.200   3.933   5.756
   50    HE1  TRP   7          1HE       TRP   7  -2.312   5.560   7.365
   51    HE3  TRP   7          3HE       TRP   7  -5.076   0.987   7.290
   52    HZ2  TRP   7          2HZ       TRP   7  -4.582   5.618   9.070
   53    HZ3  TRP   7          3HZ       TRP   7  -6.685   1.915   8.911
   54    HH2  TRP   7           HH       TRP   7  -6.435   4.181   9.775
   55    H    LYS   8           H        LYS   8  -1.830  -1.585   6.801
   56    HA   LYS   8           HA       LYS   8  -0.239  -3.242   5.151
   57    HB2  LYS   8          2HB       LYS   8  -1.031  -3.979   7.343
   58    HB3  LYS   8          1HB       LYS   8  -2.693  -3.921   6.769
   59    HG2  LYS   8          2HG       LYS   8  -2.175  -5.695   5.145
   60    HG3  LYS   8          1HG       LYS   8  -0.530  -5.768   5.770
   61    HD2  LYS   8          2HD       LYS   8  -1.863  -7.556   6.733
   62    HD3  LYS   8          1HD       LYS   8  -1.422  -6.391   7.979
   63    HE2  LYS   8          2HE       LYS   8  -3.648  -5.388   7.853
   64    HE3  LYS   8          1HE       LYS   8  -4.087  -6.490   6.549
   65    HZ1  LYS   8          1HZ       LYS   8  -3.841  -8.333   8.094
   66    HZ2  LYS   8          2HZ       LYS   8  -4.944  -7.203   8.699
   67    HZ3  LYS   8          3HZ       LYS   8  -3.395  -7.275   9.326
   68    H    CYS   9           H        CYS   9  -0.563  -3.925   3.121
   69    HA   CYS   9           HA       CYS   9  -3.099  -3.267   1.971
   70    HB2  CYS   9          2HB       CYS   9  -1.989  -3.645  -0.173
   71    HB3  CYS   9          1HB       CYS   9  -1.199  -2.439   0.854
   72    H    ASN  10           H        ASN  10  -4.270  -4.667   0.781
   73    HA   ASN  10           HA       ASN  10  -3.813  -7.505   1.310
   74    HB2  ASN  10          2HB       ASN  10  -5.486  -6.760   2.888
   75    HB3  ASN  10          1HB       ASN  10  -6.349  -5.891   1.629
   76   HD21  ASN  10          1HD2      ASN  10  -8.193  -7.014   2.267
   77   HD22  ASN  10          2HD2      ASN  10  -8.505  -8.639   1.794
   78    HA   PRO  11           HA       PRO  11  -4.025  -7.252  -3.181
   79    HB2  PRO  11          2HB       PRO  11  -4.282 -10.173  -3.012
   80    HB3  PRO  11          1HB       PRO  11  -3.082  -9.204  -3.865
   81    HG2  PRO  11          2HG       PRO  11  -2.481 -10.559  -1.616
   82    HG3  PRO  11          1HG       PRO  11  -1.723  -9.013  -2.009
   83    HD2  PRO  11          2HD       PRO  11  -3.852  -9.635  -0.028
   84    HD3  PRO  11          1HD       PRO  11  -2.555  -8.423   0.031
   85    H    SER  12           H        SER  12  -6.358  -8.847  -1.147
   86    HA   SER  12           HA       SER  12  -8.173  -9.376  -3.314
   87    HB2  SER  12          2HB       SER  12  -8.265  -9.852  -0.355
   88    HB3  SER  12          1HB       SER  12  -9.507 -10.336  -1.504
   89    HG   SER  12           HG       SER  12  -6.793 -11.115  -1.809
   90    H    ASN  13           H        ASN  13  -7.412  -6.820  -1.178
   91    HA   ASN  13           HA       ASN  13  -9.715  -5.340  -1.813
   92    HB2  ASN  13          2HB       ASN  13 -10.582  -6.771   0.011
   93    HB3  ASN  13          1HB       ASN  13  -9.321  -6.166   1.064
   94   HD21  ASN  13          1HD2      ASN  13 -10.605  -5.168   2.515
   95   HD22  ASN  13          2HD2      ASN  13 -11.556  -3.768   2.216
   96    H    ASP  14           H        ASP  14  -7.849  -4.439  -2.594
   97    HA   ASP  14           HA       ASP  14  -6.075  -3.251  -0.650
   98    HB2  ASP  14          2HB       ASP  14  -5.167  -4.432  -2.557
   99    HB3  ASP  14          1HB       ASP  14  -5.898  -3.284  -3.664
  100    H    LYS  15           H        LYS  15  -6.791  -1.422   0.140
  101    HA   LYS  15           HA       LYS  15  -8.757   0.020  -1.464
  102    HB2  LYS  15          2HB       LYS  15  -9.090  -1.261   0.805
  103    HB3  LYS  15          1HB       LYS  15  -8.485   0.251   1.459
  104    HG2  LYS  15          2HG       LYS  15 -10.257   1.424   0.204
  105    HG3  LYS  15          1HG       LYS  15 -10.839  -0.191  -0.271
  106    HD2  LYS  15          2HD       LYS  15 -11.040  -0.822   2.020
  107    HD3  LYS  15          1HD       LYS  15 -10.477   0.768   2.527
  108    HE2  LYS  15          2HE       LYS  15 -13.013   0.218   0.957
  109    HE3  LYS  15          1HE       LYS  15 -12.947   0.627   2.669
  110    HZ1  LYS  15          1HZ       LYS  15 -13.497   2.528   1.269
  111    HZ2  LYS  15          2HZ       LYS  15 -12.035   2.389   0.463
  112    HZ3  LYS  15          3HZ       LYS  15 -12.065   2.773   2.112
  113    H    CYS  16           H        CYS  16  -5.759   0.182  -1.077
  114    HA   CYS  16           HA       CYS  16  -5.401   2.666   0.190
  115    HB2  CYS  16          2HB       CYS  16  -3.481   1.011  -1.417
  116    HB3  CYS  16          1HB       CYS  16  -3.035   2.544  -0.670
  117    H    CYS  17           H        CYS  17  -4.170   4.458  -0.947
  118    HA   CYS  17           HA       CYS  17  -5.807   5.409  -3.060
  119    HB2  CYS  17          2HB       CYS  17  -3.286   6.544  -1.887
  120    HB3  CYS  17          1HB       CYS  17  -4.377   7.411  -2.959
  121    H    ARG  18           H        ARG  18  -5.507   4.077  -4.850
  122    HA   ARG  18           HA       ARG  18  -2.901   4.304  -6.017
  123    HB2  ARG  18          2HB       ARG  18  -3.268   2.255  -7.277
  124    HB3  ARG  18          1HB       ARG  18  -3.489   1.935  -5.567
  125    HG2  ARG  18          2HG       ARG  18  -5.770   2.472  -7.420
  126    HG3  ARG  18          1HG       ARG  18  -5.115   0.838  -7.224
  127    HD2  ARG  18          2HD       ARG  18  -5.672   0.994  -4.827
  128    HD3  ARG  18          1HD       ARG  18  -6.326   2.606  -5.095
  129    HE   ARG  18           HE       ARG  18  -7.526   0.732  -6.821
  130   HH11  ARG  18          1HH1      ARG  18  -7.643   1.932  -3.482
  131   HH12  ARG  18          2HH1      ARG  18  -9.221   1.291  -3.207
  132   HH21  ARG  18          1HH2      ARG  18  -9.653  -0.078  -6.396
  133   HH22  ARG  18          2HH2      ARG  18 -10.371   0.147  -4.872
  134    HA   PRO  19           HA       PRO  19  -1.986   4.127  -7.866
  135    HB2  PRO  19          2HB       PRO  19  -1.415   5.784 -10.135
  136    HB3  PRO  19          1HB       PRO  19  -1.513   4.020 -10.067
  137    HG2  PRO  19          2HG       PRO  19  -3.307   5.505 -11.446
  138    HG3  PRO  19          1HG       PRO  19  -3.691   3.968 -10.607
  139    HD2  PRO  19          2HD       PRO  19  -4.089   6.771  -9.587
  140    HD3  PRO  19          1HD       PRO  19  -5.290   5.457  -9.715
  141    H    ASN  20           H        ASN  20  -1.103   5.102  -6.320
  142    HA   ASN  20           HA       ASN  20   0.439   7.483  -6.687
  143    HB2  ASN  20          2HB       ASN  20  -1.809   8.398  -6.011
  144    HB3  ASN  20          1HB       ASN  20  -1.631   7.521  -4.497
  145   HD21  ASN  20          1HD2      ASN  20  -0.278   8.353  -2.895
  146   HD22  ASN  20          2HD2      ASN  20   0.513   9.872  -3.032
  147    H    LEU  21           H        LEU  21  -1.041   5.328  -4.328
  148    HA   LEU  21           HA       LEU  21   1.611   4.696  -3.263
  149    HB2  LEU  21          2HB       LEU  21  -1.080   4.231  -2.060
  150    HB3  LEU  21          1HB       LEU  21   0.472   4.034  -1.313
  151    HG   LEU  21           HG       LEU  21  -0.623   6.730  -2.115
  152   HD11  LEU  21          1HD1      LEU  21  -0.928   7.126   0.259
  153   HD12  LEU  21          2HD1      LEU  21  -0.441   5.467   0.601
  154   HD13  LEU  21          3HD1      LEU  21  -1.921   5.782  -0.303
  155   HD21  LEU  21          1HD2      LEU  21   1.824   5.944  -0.529
  156   HD22  LEU  21          2HD2      LEU  21   1.239   7.591  -0.742
  157   HD23  LEU  21          3HD2      LEU  21   1.799   6.669  -2.136
  158    H    VAL  22           H        VAL  22   1.924   2.585  -2.983
  159    HA   VAL  22           HA       VAL  22   0.287   0.816  -4.652
  160    HB   VAL  22           HB       VAL  22   3.256   0.833  -4.696
  161   HG11  VAL  22          1HG1      VAL  22   2.996  -0.498  -6.779
  162   HG12  VAL  22          2HG1      VAL  22   1.251  -0.478  -6.513
  163   HG13  VAL  22          3HG1      VAL  22   2.315  -1.261  -5.343
  164   HG21  VAL  22          1HG2      VAL  22   3.198   1.896  -6.948
  165   HG22  VAL  22          2HG2      VAL  22   2.607   2.959  -5.671
  166   HG23  VAL  22          3HG2      VAL  22   1.465   2.149  -6.742
  167    H    CYS  23           H        CYS  23   0.191  -1.212  -3.879
  168    HA   CYS  23           HA       CYS  23   1.034  -1.709  -1.222
  169    HB2  CYS  23          2HB       CYS  23  -0.954  -2.707  -1.801
  170    HB3  CYS  23          1HB       CYS  23  -0.311  -3.349  -3.322
  171    H    SER  24           H        SER  24   2.868  -2.285  -0.639
  172    HA   SER  24           HA       SER  24   4.780  -3.468  -2.477
  173    HB2  SER  24          2HB       SER  24   5.510  -1.616  -0.967
  174    HB3  SER  24          1HB       SER  24   5.026  -2.599   0.417
  175    HG   SER  24           HG       SER  24   7.264  -2.741   0.054
  176    H    ARG  25           H        ARG  25   4.693  -5.635  -2.626
  177    HA   ARG  25           HA       ARG  25   3.400  -7.135  -0.521
  178    HB2  ARG  25          2HB       ARG  25   3.196  -7.608  -3.057
  179    HB3  ARG  25          1HB       ARG  25   4.797  -8.318  -2.920
  180    HG2  ARG  25          2HG       ARG  25   4.001  -9.929  -1.349
  181    HG3  ARG  25          1HG       ARG  25   2.400  -9.193  -1.334
  182    HD2  ARG  25          2HD       ARG  25   2.217  -9.711  -3.752
  183    HD3  ARG  25          1HD       ARG  25   3.759 -10.559  -3.651
  184    HE   ARG  25           HE       ARG  25   1.604 -11.346  -1.854
  185   HH11  ARG  25          1HH1      ARG  25   3.676 -12.203  -4.593
  186   HH12  ARG  25          2HH1      ARG  25   3.117 -13.808  -4.669
  187   HH21  ARG  25          1HH2      ARG  25   0.828 -13.518  -2.002
  188   HH22  ARG  25          2HH2      ARG  25   1.450 -14.576  -3.178
  189    H    LYS  26           H        LYS  26   6.386  -6.019  -1.289
  190    HA   LYS  26           HA       LYS  26   8.173  -7.864  -0.059
  191    HB2  LYS  26          2HB       LYS  26   8.829  -6.056  -1.630
  192    HB3  LYS  26          1HB       LYS  26   8.316  -4.875  -0.456
  193    HG2  LYS  26          2HG       LYS  26  10.046  -5.757   1.113
  194    HG3  LYS  26          1HG       LYS  26  10.643  -6.760  -0.212
  195    HD2  LYS  26          2HD       LYS  26  10.985  -4.720  -1.567
  196    HD3  LYS  26          1HD       LYS  26  10.445  -3.751  -0.204
  197    HE2  LYS  26          2HE       LYS  26  12.875  -3.775  -0.305
  198    HE3  LYS  26          1HE       LYS  26  12.310  -4.586   1.144
  199    HZ1  LYS  26          1HZ       LYS  26  14.095  -5.803   0.082
  200    HZ2  LYS  26          2HZ       LYS  26  13.236  -5.941  -1.342
  201    HZ3  LYS  26          3HZ       LYS  26  12.690  -6.719   0.053
  202    H    ASP  27           H        ASP  27   6.877  -4.711   0.911
  203    HA   ASP  27           HA       ASP  27   7.676  -4.975   3.637
  204    HB2  ASP  27          2HB       ASP  27   6.081  -2.884   2.174
  205    HB3  ASP  27          1HB       ASP  27   6.571  -2.776   3.849
  206    H    LYS  28           H        LYS  28   4.761  -5.549   1.778
  207    HA   LYS  28           HA       LYS  28   2.877  -6.316   2.117
  208    HB2  LYS  28          2HB       LYS  28   3.598  -6.739   5.022
  209    HB3  LYS  28          1HB       LYS  28   2.071  -7.129   4.225
  210    HG2  LYS  28          2HG       LYS  28   3.220  -9.184   4.251
  211    HG3  LYS  28          1HG       LYS  28   3.432  -8.533   2.622
  212    HD2  LYS  28          2HD       LYS  28   5.642  -7.693   3.256
  213    HD3  LYS  28          1HD       LYS  28   5.425  -8.387   4.862
  214    HE2  LYS  28          2HE       LYS  28   5.217 -10.615   3.838
  215    HE3  LYS  28          1HE       LYS  28   5.504  -9.883   2.259
  216    HZ1  LYS  28          1HZ       LYS  28   7.686  -9.123   3.107
  217    HZ2  LYS  28          2HZ       LYS  28   7.542 -10.784   3.062
  218    HZ3  LYS  28          3HZ       LYS  28   7.409  -9.989   4.531
  219    H    TRP  29           H        TRP  29   3.638  -3.476   2.595
  220    HA   TRP  29           HA       TRP  29   0.940  -2.750   3.339
  221    HB2  TRP  29          2HB       TRP  29   1.679  -0.788   4.652
  222    HB3  TRP  29          1HB       TRP  29   2.180  -2.297   5.388
  223    HD1  TRP  29           HD       TRP  29   3.752   0.493   3.168
  224    HE1  TRP  29          1HE       TRP  29   6.203   0.796   3.899
  225    HE3  TRP  29          3HE       TRP  29   3.989  -3.190   6.697
  226    HZ2  TRP  29          2HZ       TRP  29   7.988  -0.372   5.751
  227    HZ3  TRP  29          3HZ       TRP  29   6.098  -3.526   7.916
  228    HH2  TRP  29           HH       TRP  29   8.054  -2.143   7.451
  229    H    CYS  30           H        CYS  30   0.310  -0.586   2.580
  230    HA   CYS  30           HA       CYS  30   1.206  -0.085  -0.039
  231    HB2  CYS  30          2HB       CYS  30  -0.538   1.441   1.882
  232    HB3  CYS  30          1HB       CYS  30  -0.367   1.754   0.158
  233    H    LYS  31           H        LYS  31   2.596   1.395  -0.711
  234    HA   LYS  31           HA       LYS  31   3.810   3.226   1.183
  235    HB2  LYS  31          2HB       LYS  31   5.001   0.878   1.124
  236    HB3  LYS  31          1HB       LYS  31   5.393   1.340  -0.522
  237    HG2  LYS  31          2HG       LYS  31   6.741   3.185   0.249
  238    HG3  LYS  31          1HG       LYS  31   6.312   2.811   1.923
  239    HD2  LYS  31          2HD       LYS  31   8.509   1.923   1.384
  240    HD3  LYS  31          1HD       LYS  31   7.381   0.603   1.674
  241    HE2  LYS  31          2HE       LYS  31   7.125   0.287  -0.756
  242    HE3  LYS  31          1HE       LYS  31   8.236   1.623  -1.048
  243    HZ1  LYS  31          1HZ       LYS  31   8.901  -0.917   0.344
  244    HZ2  LYS  31          2HZ       LYS  31   9.993   0.345  -0.013
  245    HZ3  LYS  31          3HZ       LYS  31   9.306  -0.543  -1.256
  246    H    TYR  32           H        TYR  32   5.599   4.197  -0.393
  247    HA   TYR  32           HA       TYR  32   4.182   5.219  -2.746
  248    HB2  TYR  32          2HB       TYR  32   5.718   6.513  -0.990
  249    HB3  TYR  32          1HB       TYR  32   6.988   5.854  -1.953
  250    HD1  TYR  32          1HD       TYR  32   7.832   7.034  -3.751
  251    HD2  TYR  32          2HD       TYR  32   3.867   7.827  -2.431
  252    HE1  TYR  32          1HE       TYR  32   7.676   8.881  -5.344
  253    HE2  TYR  32          2HE       TYR  32   3.697   9.673  -4.017
  254    HH   TYR  32           HH       TYR  32   5.189  11.201  -5.232
  255    H    GLN  33           H        GLN  33   5.442   5.065  -4.869
  256    HA   GLN  33           HA       GLN  33   6.822   2.529  -4.876
  257    HB2  GLN  33          2HB       GLN  33   5.225   3.553  -6.741
  258    HB3  GLN  33          1HB       GLN  33   6.773   4.237  -7.258
  259    HG2  GLN  33          2HG       GLN  33   6.073   1.312  -7.029
  260    HG3  GLN  33          1HG       GLN  33   6.394   2.208  -8.507
  261   HE21  GLN  33          1HE2      GLN  33   8.561   2.781  -8.967
  262   HE22  GLN  33          2HE2      GLN  33   9.878   1.963  -8.208
  263    H    ILE  34           H        ILE  34   8.220   3.471  -3.475
  264    HA   ILE  34           HA       ILE  34  10.364   5.172  -4.280
  265    HB   ILE  34           HB       ILE  34  10.447   3.032  -2.123
  266   HG12  ILE  34          2HG1      ILE  34   9.584   5.924  -1.860
  267   HG13  ILE  34          1HG1      ILE  34   8.507   4.530  -1.851
  268   HG21  ILE  34          1HG2      ILE  34  12.002   5.607  -2.435
  269   HG22  ILE  34          2HG2      ILE  34  12.628   3.985  -2.716
  270   HG23  ILE  34          3HG2      ILE  34  12.144   4.472  -1.092
  271   HD11  ILE  34          1HD1      ILE  34  10.668   5.075   0.162
  272   HD12  ILE  34          2HD1      ILE  34   9.537   3.719   0.180
  273   HD13  ILE  34          3HD1      ILE  34   8.945   5.366   0.392
  Start of MODEL   15
    1    H1   ASP   1          1HT       ASP   1 -12.040   9.667   0.787
    2    H2   ASP   1          2HT       ASP   1 -12.220   8.202   1.626
    3    H3   ASP   1          3HT       ASP   1 -11.998   8.188  -0.024
    4    HA   ASP   1           HA       ASP   1  -9.811   8.993   0.145
    5    HB2  ASP   1          2HB       ASP   1  -8.718   9.145   2.388
    6    HB3  ASP   1          1HB       ASP   1  -9.953  10.370   2.149
    7    H    CYS   2           H        CYS   2  -7.963   7.569   1.150
    8    HA   CYS   2           HA       CYS   2  -8.978   4.788   0.959
    9    HB2  CYS   2          2HB       CYS   2  -6.975   4.270  -0.241
   10    HB3  CYS   2          1HB       CYS   2  -7.866   5.517  -1.084
   11    H    LEU   3           H        LEU   3  -6.982   3.375   1.420
   12    HA   LEU   3           HA       LEU   3  -6.158   3.768   4.119
   13    HB2  LEU   3          2HB       LEU   3  -5.225   1.849   1.995
   14    HB3  LEU   3          1HB       LEU   3  -4.847   1.763   3.696
   15    HG   LEU   3           HG       LEU   3  -7.582   1.478   2.515
   16   HD11  LEU   3          1HD1      LEU   3  -5.669  -0.610   3.574
   17   HD12  LEU   3          2HD1      LEU   3  -6.157  -0.400   1.894
   18   HD13  LEU   3          3HD1      LEU   3  -7.339  -0.916   3.097
   19   HD21  LEU   3          1HD2      LEU   3  -7.662   2.328   4.786
   20   HD22  LEU   3          2HD2      LEU   3  -6.568   1.053   5.323
   21   HD23  LEU   3          3HD2      LEU   3  -8.186   0.643   4.758
   22    H    GLY   4           H        GLY   4  -4.327   4.735   4.728
   23    HA2  GLY   4          2HA       GLY   4  -2.759   6.073   2.737
   24    HA3  GLY   4          1HA       GLY   4  -2.577   6.204   4.481
   25    H    PHE   5           H        PHE   5  -0.260   6.092   3.733
   26    HA   PHE   5           HA       PHE   5   0.627   3.519   2.952
   27    HB2  PHE   5          2HB       PHE   5   2.900   4.660   3.325
   28    HB3  PHE   5          1HB       PHE   5   1.904   5.260   2.013
   29    HD1  PHE   5          1HD       PHE   5   0.772   7.459   2.214
   30    HD2  PHE   5          2HD       PHE   5   3.475   6.059   5.201
   31    HE1  PHE   5          1HE       PHE   5   0.984   9.734   3.087
   32    HE2  PHE   5          2HE       PHE   5   3.668   8.340   6.083
   33    HZ   PHE   5           HZ       PHE   5   2.430  10.179   5.027
   34    H    LEU   6           H        LEU   6   2.033   2.300   4.233
   35    HA   LEU   6           HA       LEU   6   2.964   1.374   6.067
   36    HB2  LEU   6          2HB       LEU   6   1.551   3.345   7.798
   37    HB3  LEU   6          1HB       LEU   6   2.953   2.363   8.229
   38    HG   LEU   6           HG       LEU   6   2.815   4.700   6.367
   39   HD11  LEU   6          1HD1      LEU   6   4.179   4.382   9.046
   40   HD12  LEU   6          2HD1      LEU   6   2.739   5.338   8.691
   41   HD13  LEU   6          3HD1      LEU   6   4.296   5.807   8.010
   42   HD21  LEU   6          1HD2      LEU   6   5.308   4.505   6.202
   43   HD22  LEU   6          2HD2      LEU   6   4.432   3.159   5.478
   44   HD23  LEU   6          3HD2      LEU   6   5.192   2.960   7.055
   45    H    TRP   7           H        TRP   7  -0.222   1.692   5.295
   46    HA   TRP   7           HA       TRP   7  -1.291   0.127   7.434
   47    HB2  TRP   7          2HB       TRP   7  -2.415   1.218   4.865
   48    HB3  TRP   7          1HB       TRP   7  -3.329   0.231   5.979
   49    HD1  TRP   7           HD       TRP   7  -1.232   3.493   6.344
   50    HE1  TRP   7          1HE       TRP   7  -2.507   5.119   7.823
   51    HE3  TRP   7          3HE       TRP   7  -5.325   0.610   7.298
   52    HZ2  TRP   7          2HZ       TRP   7  -4.982   5.198   9.222
   53    HZ3  TRP   7          3HZ       TRP   7  -7.109   1.534   8.708
   54    HH2  TRP   7           HH       TRP   7  -6.937   3.787   9.652
   55    H    LYS   8           H        LYS   8  -1.919  -1.925   7.184
   56    HA   LYS   8           HA       LYS   8  -0.151  -3.527   5.673
   57    HB2  LYS   8          2HB       LYS   8  -1.070  -4.128   7.903
   58    HB3  LYS   8          1HB       LYS   8  -2.638  -4.371   7.154
   59    HG2  LYS   8          2HG       LYS   8  -1.751  -6.194   5.827
   60    HG3  LYS   8          1HG       LYS   8  -0.145  -5.930   6.506
   61    HD2  LYS   8          2HD       LYS   8  -1.102  -6.366   8.766
   62    HD3  LYS   8          1HD       LYS   8  -2.630  -6.772   7.990
   63    HE2  LYS   8          2HE       LYS   8   0.002  -8.185   7.546
   64    HE3  LYS   8          1HE       LYS   8  -1.316  -8.762   8.558
   65    HZ1  LYS   8          1HZ       LYS   8  -1.338  -9.839   6.437
   66    HZ2  LYS   8          2HZ       LYS   8  -1.429  -8.375   5.612
   67    HZ3  LYS   8          3HZ       LYS   8  -2.713  -8.888   6.587
   68    H    CYS   9           H        CYS   9  -0.380  -4.547   3.815
   69    HA   CYS   9           HA       CYS   9  -2.392  -3.803   1.989
   70    HB2  CYS   9          2HB       CYS   9  -0.079  -5.644   1.938
   71    HB3  CYS   9          1HB       CYS   9  -1.420  -5.965   0.831
   72    H    ASN  10           H        ASN  10  -3.949  -5.058   0.993
   73    HA   ASN  10           HA       ASN  10  -4.597  -7.623   2.123
   74    HB2  ASN  10          2HB       ASN  10  -5.778  -5.808   3.478
   75    HB3  ASN  10          1HB       ASN  10  -6.662  -5.448   1.992
   76   HD21  ASN  10          1HD2      ASN  10  -6.236  -7.730   4.576
   77   HD22  ASN  10          2HD2      ASN  10  -7.559  -8.744   4.143
   78    HA   PRO  11           HA       PRO  11  -5.346  -7.760  -2.308
   79    HB2  PRO  11          2HB       PRO  11  -6.090 -10.367  -2.479
   80    HB3  PRO  11          1HB       PRO  11  -4.407  -9.864  -2.286
   81    HG2  PRO  11          2HG       PRO  11  -6.340 -10.850  -0.222
   82    HG3  PRO  11          1HG       PRO  11  -4.630 -11.263  -0.435
   83    HD2  PRO  11          2HD       PRO  11  -5.491  -9.479   1.416
   84    HD3  PRO  11          1HD       PRO  11  -3.909  -9.345   0.624
   85    H    SER  12           H        SER  12  -7.712  -8.495   0.153
   86    HA   SER  12           HA       SER  12  -9.905  -8.666  -1.725
   87    HB2  SER  12          2HB       SER  12  -9.700  -8.988   1.236
   88    HB3  SER  12          1HB       SER  12 -11.078  -9.387   0.215
   89    HG   SER  12           HG       SER  12  -9.562 -10.843  -0.901
   90    H    ASN  13           H        ASN  13  -8.241  -6.384   0.013
   91    HA   ASN  13           HA       ASN  13 -10.415  -4.505   0.067
   92    HB2  ASN  13          2HB       ASN  13 -10.517  -5.593   2.312
   93    HB3  ASN  13          1HB       ASN  13  -8.841  -5.162   2.586
   94   HD21  ASN  13          1HD2      ASN  13 -11.186  -2.984   1.039
   95   HD22  ASN  13          2HD2      ASN  13 -11.224  -1.855   2.323
   96    H    ASP  14           H        ASP  14  -8.726  -4.427  -1.642
   97    HA   ASP  14           HA       ASP  14  -6.279  -3.099  -0.890
   98    HB2  ASP  14          2HB       ASP  14  -6.573  -4.820  -2.690
   99    HB3  ASP  14          1HB       ASP  14  -7.494  -3.603  -3.576
  100    H    LYS  15           H        LYS  15  -6.892  -1.151  -0.170
  101    HA   LYS  15           HA       LYS  15  -8.664   0.455  -1.852
  102    HB2  LYS  15          2HB       LYS  15  -9.405  -0.805   0.400
  103    HB3  LYS  15          1HB       LYS  15  -8.690   0.632   1.099
  104    HG2  LYS  15          2HG       LYS  15 -10.987   0.567  -0.859
  105    HG3  LYS  15          1HG       LYS  15 -11.110   0.857   0.873
  106    HD2  LYS  15          2HD       LYS  15  -9.593   2.803   0.531
  107    HD3  LYS  15          1HD       LYS  15  -9.772   2.541  -1.196
  108    HE2  LYS  15          2HE       LYS  15 -11.351   4.264  -0.449
  109    HE3  LYS  15          1HE       LYS  15 -12.211   2.823  -0.992
  110    HZ1  LYS  15          1HZ       LYS  15 -12.489   2.167   1.334
  111    HZ2  LYS  15          2HZ       LYS  15 -13.109   3.707   1.078
  112    HZ3  LYS  15          3HZ       LYS  15 -11.641   3.523   1.840
  113    H    CYS  16           H        CYS  16  -5.859   0.294  -1.735
  114    HA   CYS  16           HA       CYS  16  -5.176   2.709  -0.259
  115    HB2  CYS  16          2HB       CYS  16  -3.281   0.747  -1.583
  116    HB3  CYS  16          1HB       CYS  16  -2.804   2.156  -0.634
  117    H    CYS  17           H        CYS  17  -4.113   4.501  -1.318
  118    HA   CYS  17           HA       CYS  17  -5.311   5.088  -3.824
  119    HB2  CYS  17          2HB       CYS  17  -3.486   6.596  -2.035
  120    HB3  CYS  17          1HB       CYS  17  -4.002   7.262  -3.573
  121    H    ARG  18           H        ARG  18  -4.406   3.749  -5.379
  122    HA   ARG  18           HA       ARG  18  -1.645   4.014  -5.995
  123    HB2  ARG  18          2HB       ARG  18  -2.252   2.538  -7.942
  124    HB3  ARG  18          1HB       ARG  18  -2.678   1.876  -6.372
  125    HG2  ARG  18          2HG       ARG  18  -4.999   2.807  -6.760
  126    HG3  ARG  18          1HG       ARG  18  -4.501   3.085  -8.427
  127    HD2  ARG  18          2HD       ARG  18  -4.392   0.457  -7.003
  128    HD3  ARG  18          1HD       ARG  18  -5.712   0.959  -8.054
  129    HE   ARG  18           HE       ARG  18  -3.407   1.217  -9.517
  130   HH11  ARG  18          1HH1      ARG  18  -4.995  -1.446  -7.824
  131   HH12  ARG  18          2HH1      ARG  18  -4.625  -2.617  -8.998
  132   HH21  ARG  18          1HH2      ARG  18  -2.897  -0.390 -11.154
  133   HH22  ARG  18          2HH2      ARG  18  -3.376  -2.004 -10.935
  134    HA   PRO  19           HA       PRO  19  -0.411   3.897  -7.947
  135    HB2  PRO  19          2HB       PRO  19   1.145   5.135  -9.610
  136    HB3  PRO  19          1HB       PRO  19  -0.412   4.470 -10.170
  137    HG2  PRO  19          2HG       PRO  19   0.275   7.314  -9.512
  138    HG3  PRO  19          1HG       PRO  19  -0.586   6.688 -10.927
  139    HD2  PRO  19          2HD       PRO  19  -1.787   7.666  -8.602
  140    HD3  PRO  19          1HD       PRO  19  -2.580   6.629  -9.802
  141    H    ASN  20           H        ASN  20  -0.925   6.676  -6.624
  142    HA   ASN  20           HA       ASN  20   1.530   7.872  -5.825
  143    HB2  ASN  20          2HB       ASN  20  -0.551   9.003  -5.365
  144    HB3  ASN  20          1HB       ASN  20  -1.142   7.645  -4.434
  145   HD21  ASN  20          1HD2      ASN  20   2.100   9.043  -4.061
  146   HD22  ASN  20          2HD2      ASN  20   1.793   9.615  -2.457
  147    H    LEU  21           H        LEU  21  -0.464   5.482  -4.236
  148    HA   LEU  21           HA       LEU  21   1.800   4.414  -2.722
  149    HB2  LEU  21          2HB       LEU  21  -1.157   4.277  -2.205
  150    HB3  LEU  21          1HB       LEU  21   0.121   3.684  -1.175
  151    HG   LEU  21           HG       LEU  21  -0.493   6.588  -1.731
  152   HD11  LEU  21          1HD1      LEU  21  -1.147   6.676   0.613
  153   HD12  LEU  21          2HD1      LEU  21  -0.869   4.942   0.756
  154   HD13  LEU  21          3HD1      LEU  21  -2.144   5.546  -0.301
  155   HD21  LEU  21          1HD2      LEU  21   1.881   6.310  -1.407
  156   HD22  LEU  21          2HD2      LEU  21   1.608   5.317   0.016
  157   HD23  LEU  21          3HD2      LEU  21   1.188   7.035   0.046
  158    H    VAL  22           H        VAL  22   1.663   2.226  -2.578
  159    HA   VAL  22           HA       VAL  22   0.042   0.853  -4.559
  160    HB   VAL  22           HB       VAL  22   2.107   1.475  -5.707
  161   HG11  VAL  22          1HG1      VAL  22   4.277   0.408  -5.133
  162   HG12  VAL  22          2HG1      VAL  22   3.537  -0.218  -3.659
  163   HG13  VAL  22          3HG1      VAL  22   3.699   1.521  -3.892
  164   HG21  VAL  22          1HG2      VAL  22   1.836  -1.495  -5.270
  165   HG22  VAL  22          2HG2      VAL  22   2.746  -0.760  -6.590
  166   HG23  VAL  22          3HG2      VAL  22   1.003  -0.517  -6.480
  167    H    CYS  23           H        CYS  23  -0.082  -1.295  -4.163
  168    HA   CYS  23           HA       CYS  23   0.286  -1.963  -1.379
  169    HB2  CYS  23          2HB       CYS  23  -1.781  -2.608  -2.500
  170    HB3  CYS  23          1HB       CYS  23  -0.835  -3.593  -3.634
  171    H    SER  24           H        SER  24   2.042  -2.729  -0.759
  172    HA   SER  24           HA       SER  24   3.911  -3.822  -2.703
  173    HB2  SER  24          2HB       SER  24   4.665  -1.865  -1.438
  174    HB3  SER  24          1HB       SER  24   4.388  -2.741   0.067
  175    HG   SER  24           HG       SER  24   6.613  -2.749  -0.703
  176    H    ARG  25           H        ARG  25   3.987  -5.915  -2.785
  177    HA   ARG  25           HA       ARG  25   3.148  -7.631  -0.640
  178    HB2  ARG  25          2HB       ARG  25   2.851  -8.245  -3.018
  179    HB3  ARG  25          1HB       ARG  25   4.591  -8.226  -3.240
  180    HG2  ARG  25          2HG       ARG  25   4.815 -10.099  -1.699
  181    HG3  ARG  25          1HG       ARG  25   3.066 -10.116  -1.459
  182    HD2  ARG  25          2HD       ARG  25   3.715 -11.815  -3.066
  183    HD3  ARG  25          1HD       ARG  25   2.755 -10.557  -3.841
  184    HE   ARG  25           HE       ARG  25   5.513  -9.987  -4.090
  185   HH11  ARG  25          1HH1      ARG  25   3.011 -12.119  -5.420
  186   HH12  ARG  25          2HH1      ARG  25   3.799 -12.328  -6.912
  187   HH21  ARG  25          1HH2      ARG  25   6.601 -10.332  -6.115
  188   HH22  ARG  25          2HH2      ARG  25   5.881 -11.320  -7.314
  189    H    LYS  26           H        LYS  26   5.961  -6.074  -1.682
  190    HA   LYS  26           HA       LYS  26   7.935  -7.713  -0.452
  191    HB2  LYS  26          2HB       LYS  26   8.275  -6.065  -2.358
  192    HB3  LYS  26          1HB       LYS  26   8.041  -4.784  -1.208
  193    HG2  LYS  26          2HG       LYS  26  10.279  -6.793  -0.964
  194    HG3  LYS  26          1HG       LYS  26  10.436  -5.261  -1.815
  195    HD2  LYS  26          2HD       LYS  26   9.888  -4.074   0.262
  196    HD3  LYS  26          1HD       LYS  26   9.734  -5.612   1.097
  197    HE2  LYS  26          2HE       LYS  26  12.081  -6.100   0.628
  198    HE3  LYS  26          1HE       LYS  26  12.225  -4.554  -0.206
  199    HZ1  LYS  26          1HZ       LYS  26  11.616  -3.451   1.876
  200    HZ2  LYS  26          2HZ       LYS  26  13.040  -4.316   2.011
  201    HZ3  LYS  26          3HZ       LYS  26  11.623  -4.937   2.679
  202    H    ASP  27           H        ASP  27   6.706  -4.460   0.304
  203    HA   ASP  27           HA       ASP  27   7.821  -4.412   2.898
  204    HB2  ASP  27          2HB       ASP  27   5.753  -2.651   1.571
  205    HB3  ASP  27          1HB       ASP  27   6.474  -2.340   3.133
  206    H    LYS  28           H        LYS  28   4.745  -5.439   1.564
  207    HA   LYS  28           HA       LYS  28   3.003  -6.394   2.266
  208    HB2  LYS  28          2HB       LYS  28   4.343  -6.661   4.959
  209    HB3  LYS  28          1HB       LYS  28   2.833  -7.402   4.411
  210    HG2  LYS  28          2HG       LYS  28   4.054  -8.656   2.707
  211    HG3  LYS  28          1HG       LYS  28   5.563  -7.935   3.262
  212    HD2  LYS  28          2HD       LYS  28   3.743  -9.687   4.922
  213    HD3  LYS  28          1HD       LYS  28   5.230 -10.217   4.144
  214    HE2  LYS  28          2HE       LYS  28   6.518  -8.671   5.522
  215    HE3  LYS  28          1HE       LYS  28   5.038  -8.082   6.281
  216    HZ1  LYS  28          1HZ       LYS  28   6.144 -10.828   6.459
  217    HZ2  LYS  28          2HZ       LYS  28   4.684 -10.336   7.130
  218    HZ3  LYS  28          3HZ       LYS  28   6.129  -9.668   7.683
  219    H    TRP  29           H        TRP  29   3.499  -3.559   2.489
  220    HA   TRP  29           HA       TRP  29   0.984  -2.934   3.725
  221    HB2  TRP  29          2HB       TRP  29   1.789  -1.025   5.006
  222    HB3  TRP  29          1HB       TRP  29   2.660  -2.442   5.544
  223    HD1  TRP  29           HD       TRP  29   3.270   0.580   3.160
  224    HE1  TRP  29          1HE       TRP  29   5.713   1.314   3.385
  225    HE3  TRP  29          3HE       TRP  29   4.869  -2.981   6.431
  226    HZ2  TRP  29          2HZ       TRP  29   8.027   0.504   4.787
  227    HZ3  TRP  29          3HZ       TRP  29   7.222  -2.925   7.178
  228    HH2  TRP  29           HH       TRP  29   8.761  -1.211   6.367
  229    H    CYS  30           H        CYS  30   0.217  -0.784   2.948
  230    HA   CYS  30           HA       CYS  30   0.926  -0.440   0.271
  231    HB2  CYS  30          2HB       CYS  30  -0.838   1.064   2.193
  232    HB3  CYS  30          1HB       CYS  30  -0.688   1.446   0.479
  233    H    LYS  31           H        LYS  31   2.422   0.769  -0.506
  234    HA   LYS  31           HA       LYS  31   4.148   2.299   1.350
  235    HB2  LYS  31          2HB       LYS  31   4.605  -0.096  -0.027
  236    HB3  LYS  31          1HB       LYS  31   5.172   1.169  -1.098
  237    HG2  LYS  31          2HG       LYS  31   6.196   0.852   1.693
  238    HG3  LYS  31          1HG       LYS  31   6.900   0.042   0.308
  239    HD2  LYS  31          2HD       LYS  31   7.101   2.403  -0.695
  240    HD3  LYS  31          1HD       LYS  31   6.824   2.965   0.955
  241    HE2  LYS  31          2HE       LYS  31   9.012   1.131   0.010
  242    HE3  LYS  31          1HE       LYS  31   9.211   2.800   0.525
  243    HZ1  LYS  31          1HZ       LYS  31   9.872   1.385   2.288
  244    HZ2  LYS  31          2HZ       LYS  31   8.507   0.434   2.191
  245    HZ3  LYS  31          3HZ       LYS  31   8.404   2.046   2.755
  246    H    TYR  32           H        TYR  32   5.501   3.748  -0.164
  247    HA   TYR  32           HA       TYR  32   3.797   5.235  -1.977
  248    HB2  TYR  32          2HB       TYR  32   5.702   6.146  -0.405
  249    HB3  TYR  32          1HB       TYR  32   6.768   5.495  -1.609
  250    HD1  TYR  32          1HD       TYR  32   7.204   6.618  -3.656
  251    HD2  TYR  32          2HD       TYR  32   4.143   8.030  -1.071
  252    HE1  TYR  32          1HE       TYR  32   7.060   8.680  -4.967
  253    HE2  TYR  32          2HE       TYR  32   3.985  10.097  -2.375
  254    HH   TYR  32           HH       TYR  32   5.403  10.425  -5.414
  255    H    GLN  33           H        GLN  33   4.054   5.070  -4.254
  256    HA   GLN  33           HA       GLN  33   5.599   2.766  -5.058
  257    HB2  GLN  33          2HB       GLN  33   3.366   3.218  -6.015
  258    HB3  GLN  33          1HB       GLN  33   4.067   4.646  -6.787
  259    HG2  GLN  33          2HG       GLN  33   5.549   3.249  -8.115
  260    HG3  GLN  33          1HG       GLN  33   4.949   1.806  -7.303
  261   HE21  GLN  33          1HE2      GLN  33   4.263   4.256  -9.646
  262   HE22  GLN  33          2HE2      GLN  33   2.893   3.500 -10.353
  263    H    ILE  34           H        ILE  34   7.286   3.986  -4.158
  264    HA   ILE  34           HA       ILE  34   8.657   5.918  -5.726
  265    HB   ILE  34           HB       ILE  34   9.139   5.911  -3.372
  266   HG12  ILE  34          2HG1      ILE  34  11.621   5.792  -3.311
  267   HG13  ILE  34          1HG1      ILE  34  11.599   4.982  -4.873
  268   HG21  ILE  34          1HG2      ILE  34  10.296   4.106  -2.190
  269   HG22  ILE  34          2HG2      ILE  34  10.158   3.099  -3.632
  270   HG23  ILE  34          3HG2      ILE  34   8.706   3.632  -2.788
  271   HD11  ILE  34          1HD1      ILE  34  10.620   7.781  -4.323
  272   HD12  ILE  34          2HD1      ILE  34  10.623   6.975  -5.891
  273   HD13  ILE  34          3HD1      ILE  34  12.147   7.342  -5.086
  Start of MODEL   16
    1    H1   ASP   1          1HT       ASP   1 -12.743   6.506   2.681
    2    H2   ASP   1          2HT       ASP   1 -12.717   6.900   1.062
    3    H3   ASP   1          3HT       ASP   1 -13.067   8.104   2.191
    4    HA   ASP   1           HA       ASP   1 -10.846   8.354   1.399
    5    HB2  ASP   1          2HB       ASP   1  -9.571   8.135   3.493
    6    HB3  ASP   1          1HB       ASP   1 -11.161   8.820   3.791
    7    H    CYS   2           H        CYS   2  -8.614   7.351   1.735
    8    HA   CYS   2           HA       CYS   2  -8.713   4.487   1.171
    9    HB2  CYS   2          2HB       CYS   2  -6.666   4.954  -0.268
   10    HB3  CYS   2          1HB       CYS   2  -8.243   5.304  -0.937
   11    H    LEU   3           H        LEU   3  -6.556   3.500   1.390
   12    HA   LEU   3           HA       LEU   3  -5.549   4.143   3.983
   13    HB2  LEU   3          2HB       LEU   3  -4.836   1.981   2.009
   14    HB3  LEU   3          1HB       LEU   3  -4.206   2.134   3.623
   15    HG   LEU   3           HG       LEU   3  -7.118   1.694   2.984
   16   HD11  LEU   3          1HD1      LEU   3  -5.006  -0.271   3.873
   17   HD12  LEU   3          2HD1      LEU   3  -5.745  -0.204   2.274
   18   HD13  LEU   3          3HD1      LEU   3  -6.726  -0.614   3.679
   19   HD21  LEU   3          1HD2      LEU   3  -7.267   1.119   5.361
   20   HD22  LEU   3          2HD2      LEU   3  -6.713   2.777   5.143
   21   HD23  LEU   3          3HD2      LEU   3  -5.561   1.506   5.558
   22    H    GLY   4           H        GLY   4  -3.797   5.248   4.388
   23    HA2  GLY   4          2HA       GLY   4  -2.175   6.339   2.261
   24    HA3  GLY   4          1HA       GLY   4  -2.044   6.706   3.982
   25    H    PHE   5           H        PHE   5   0.418   6.401   3.410
   26    HA   PHE   5           HA       PHE   5   1.016   3.671   2.900
   27    HB2  PHE   5          2HB       PHE   5   3.394   4.433   2.873
   28    HB3  PHE   5          1HB       PHE   5   2.402   5.286   1.710
   29    HD1  PHE   5          1HD       PHE   5   1.761   7.670   2.180
   30    HD2  PHE   5          2HD       PHE   5   4.569   5.544   4.572
   31    HE1  PHE   5          1HE       PHE   5   2.619   9.792   3.063
   32    HE2  PHE   5          2HE       PHE   5   5.418   7.665   5.464
   33    HZ   PHE   5           HZ       PHE   5   4.445   9.794   4.705
   34    H    LEU   6           H        LEU   6   2.379   2.505   4.310
   35    HA   LEU   6           HA       LEU   6   3.096   1.677   6.282
   36    HB2  LEU   6          2HB       LEU   6   1.893   4.022   7.693
   37    HB3  LEU   6          1HB       LEU   6   3.118   2.921   8.329
   38    HG   LEU   6           HG       LEU   6   3.434   4.996   6.181
   39   HD11  LEU   6          1HD1      LEU   6   4.931   6.115   7.822
   40   HD12  LEU   6          2HD1      LEU   6   4.523   4.875   9.008
   41   HD13  LEU   6          3HD1      LEU   6   3.274   5.967   8.408
   42   HD21  LEU   6          1HD2      LEU   6   4.884   3.092   5.722
   43   HD22  LEU   6          2HD2      LEU   6   5.511   3.133   7.370
   44   HD23  LEU   6          3HD2      LEU   6   5.862   4.458   6.261
   45    H    TRP   7           H        TRP   7  -0.050   2.427   5.397
   46    HA   TRP   7           HA       TRP   7  -1.312   1.157   7.643
   47    HB2  TRP   7          2HB       TRP   7  -2.298   2.443   5.134
   48    HB3  TRP   7          1HB       TRP   7  -3.348   1.639   6.268
   49    HD1  TRP   7           HD       TRP   7  -0.598   4.375   6.757
   50    HE1  TRP   7          1HE       TRP   7  -1.537   6.197   8.274
   51    HE3  TRP   7          3HE       TRP   7  -5.279   2.471   7.440
   52    HZ2  TRP   7          2HZ       TRP   7  -4.000   6.780   9.570
   53    HZ3  TRP   7          3HZ       TRP   7  -6.873   3.733   8.820
   54    HH2  TRP   7           HH       TRP   7  -6.239   5.841   9.864
   55    H    LYS   8           H        LYS   8  -2.121  -0.737   7.543
   56    HA   LYS   8           HA       LYS   8  -0.878  -2.647   5.867
   57    HB2  LYS   8          2HB       LYS   8  -1.490  -3.099   8.178
   58    HB3  LYS   8          1HB       LYS   8  -3.189  -2.965   7.771
   59    HG2  LYS   8          2HG       LYS   8  -3.059  -4.951   6.414
   60    HG3  LYS   8          1HG       LYS   8  -1.312  -5.046   6.677
   61    HD2  LYS   8          2HD       LYS   8  -1.697  -5.263   9.080
   62    HD3  LYS   8          1HD       LYS   8  -3.431  -5.195   8.803
   63    HE2  LYS   8          2HE       LYS   8  -3.381  -7.256   7.581
   64    HE3  LYS   8          1HE       LYS   8  -1.617  -7.297   7.641
   65    HZ1  LYS   8          1HZ       LYS   8  -2.656  -8.746   9.303
   66    HZ2  LYS   8          2HZ       LYS   8  -3.369  -7.389  10.039
   67    HZ3  LYS   8          3HZ       LYS   8  -1.694  -7.541   9.986
   68    H    CYS   9           H        CYS   9  -1.449  -3.433   3.970
   69    HA   CYS   9           HA       CYS   9  -4.041  -2.630   2.888
   70    HB2  CYS   9          2HB       CYS   9  -2.926  -2.745   0.742
   71    HB3  CYS   9          1HB       CYS   9  -2.026  -1.731   1.877
   72    H    ASN  10           H        ASN  10  -4.228  -4.264   0.767
   73    HA   ASN  10           HA       ASN  10  -3.801  -7.017   1.495
   74    HB2  ASN  10          2HB       ASN  10  -6.065  -6.361   2.375
   75    HB3  ASN  10          1HB       ASN  10  -6.463  -5.786   0.762
   76   HD21  ASN  10          1HD2      ASN  10  -7.699  -7.868   2.482
   77   HD22  ASN  10          2HD2      ASN  10  -7.738  -9.299   1.515
   78    HA   PRO  11           HA       PRO  11  -2.665  -6.343  -2.840
   79    HB2  PRO  11          2HB       PRO  11  -2.606  -9.293  -3.026
   80    HB3  PRO  11          1HB       PRO  11  -1.312  -8.130  -3.331
   81    HG2  PRO  11          2HG       PRO  11  -1.282  -9.679  -1.155
   82    HG3  PRO  11          1HG       PRO  11  -0.728  -7.997  -1.090
   83    HD2  PRO  11          2HD       PRO  11  -3.336  -9.168  -0.188
   84    HD3  PRO  11          1HD       PRO  11  -2.301  -7.954   0.600
   85    H    SER  12           H        SER  12  -5.271  -8.384  -1.802
   86    HA   SER  12           HA       SER  12  -6.389  -8.549  -4.514
   87    HB2  SER  12          2HB       SER  12  -6.025 -10.531  -3.092
   88    HB3  SER  12          1HB       SER  12  -7.231  -9.895  -1.980
   89    HG   SER  12           HG       SER  12  -8.699  -9.869  -3.786
   90    H    ASN  13           H        ASN  13  -6.421  -6.492  -2.121
   91    HA   ASN  13           HA       ASN  13  -9.056  -5.442  -2.609
   92    HB2  ASN  13          2HB       ASN  13  -9.456  -7.199  -0.864
   93    HB3  ASN  13          1HB       ASN  13  -8.362  -6.359   0.208
   94   HD21  ASN  13          1HD2      ASN  13  -9.905  -5.969   1.774
   95   HD22  ASN  13          2HD2      ASN  13 -11.206  -4.866   1.591
   96    H    ASP  14           H        ASP  14  -7.150  -4.262  -3.379
   97    HA   ASP  14           HA       ASP  14  -5.554  -2.913  -1.471
   98    HB2  ASP  14          2HB       ASP  14  -4.748  -3.696  -3.600
   99    HB3  ASP  14          1HB       ASP  14  -5.809  -2.594  -4.458
  100    H    LYS  15           H        LYS  15  -6.145  -1.229  -0.565
  101    HA   LYS  15           HA       LYS  15  -8.360   0.411  -1.605
  102    HB2  LYS  15          2HB       LYS  15  -8.067  -1.292   0.582
  103    HB3  LYS  15          1HB       LYS  15  -8.259   0.350   1.229
  104    HG2  LYS  15          2HG       LYS  15 -10.399   0.531   0.327
  105    HG3  LYS  15          1HG       LYS  15 -10.084  -0.732  -0.873
  106    HD2  LYS  15          2HD       LYS  15 -11.494  -1.716   0.746
  107    HD3  LYS  15          1HD       LYS  15  -9.834  -2.303   0.959
  108    HE2  LYS  15          2HE       LYS  15 -10.815  -1.861   3.138
  109    HE3  LYS  15          1HE       LYS  15  -9.508  -0.723   2.814
  110    HZ1  LYS  15          1HZ       LYS  15 -11.430   0.345   3.784
  111    HZ2  LYS  15          2HZ       LYS  15 -12.407  -0.173   2.513
  112    HZ3  LYS  15          3HZ       LYS  15 -11.172   0.939   2.230
  113    H    CYS  16           H        CYS  16  -5.407   0.455  -1.520
  114    HA   CYS  16           HA       CYS  16  -4.594   2.592   0.244
  115    HB2  CYS  16          2HB       CYS  16  -3.172   1.475  -2.176
  116    HB3  CYS  16          1HB       CYS  16  -2.451   2.393  -0.856
  117    H    CYS  17           H        CYS  17  -3.741   4.651  -0.566
  118    HA   CYS  17           HA       CYS  17  -5.551   5.883  -2.354
  119    HB2  CYS  17          2HB       CYS  17  -3.007   6.914  -1.128
  120    HB3  CYS  17          1HB       CYS  17  -4.128   7.902  -2.055
  121    H    ARG  18           H        ARG  18  -5.227   4.482  -4.107
  122    HA   ARG  18           HA       ARG  18  -2.874   4.525  -5.626
  123    HB2  ARG  18          2HB       ARG  18  -5.674   3.571  -6.191
  124    HB3  ARG  18          1HB       ARG  18  -4.279   3.245  -7.214
  125    HG2  ARG  18          2HG       ARG  18  -3.220   1.970  -5.502
  126    HG3  ARG  18          1HG       ARG  18  -4.432   2.456  -4.319
  127    HD2  ARG  18          2HD       ARG  18  -4.831   0.193  -5.085
  128    HD3  ARG  18          1HD       ARG  18  -6.122   1.302  -5.558
  129    HE   ARG  18           HE       ARG  18  -5.327   1.267  -7.774
  130   HH11  ARG  18          1HH1      ARG  18  -3.671  -1.158  -5.718
  131   HH12  ARG  18          2HH1      ARG  18  -3.270  -2.161  -7.020
  132   HH21  ARG  18          1HH2      ARG  18  -4.714  -0.133  -9.545
  133   HH22  ARG  18          2HH2      ARG  18  -3.897  -1.589  -9.248
  134    HA   PRO  19           HA       PRO  19  -2.503   4.182  -7.807
  135    HB2  PRO  19          2HB       PRO  19  -1.233   5.205  -9.874
  136    HB3  PRO  19          1HB       PRO  19  -2.956   4.768  -9.958
  137    HG2  PRO  19          2HG       PRO  19  -1.747   7.479  -9.587
  138    HG3  PRO  19          1HG       PRO  19  -3.033   6.979 -10.702
  139    HD2  PRO  19          2HD       PRO  19  -3.464   8.128  -8.230
  140    HD3  PRO  19          1HD       PRO  19  -4.639   7.109  -9.080
  141    H    ASN  20           H        ASN  20  -1.983   7.117  -6.589
  142    HA   ASN  20           HA       ASN  20   0.798   7.570  -6.660
  143    HB2  ASN  20          2HB       ASN  20  -0.762   9.272  -5.839
  144    HB3  ASN  20          1HB       ASN  20  -1.106   8.278  -4.428
  145   HD21  ASN  20          1HD2      ASN  20  -0.442   9.859  -3.031
  146   HD22  ASN  20          2HD2      ASN  20   1.203  10.299  -2.790
  147    H    LEU  21           H        LEU  21  -1.093   5.899  -4.123
  148    HA   LEU  21           HA       LEU  21   1.356   4.519  -3.282
  149    HB2  LEU  21          2HB       LEU  21  -1.204   4.954  -1.778
  150    HB3  LEU  21          1HB       LEU  21   0.266   4.245  -1.191
  151    HG   LEU  21           HG       LEU  21   0.002   7.159  -1.955
  152   HD11  LEU  21          1HD1      LEU  21   0.135   5.877   0.764
  153   HD12  LEU  21          2HD1      LEU  21  -1.280   6.640   0.044
  154   HD13  LEU  21          3HD1      LEU  21   0.142   7.608   0.433
  155   HD21  LEU  21          1HD2      LEU  21   2.268   6.313  -2.268
  156   HD22  LEU  21          2HD2      LEU  21   2.263   5.650  -0.635
  157   HD23  LEU  21          3HD2      LEU  21   2.198   7.396  -0.878
  158    H    VAL  22           H        VAL  22   0.955   2.359  -2.680
  159    HA   VAL  22           HA       VAL  22  -1.413   1.060  -3.706
  160    HB   VAL  22           HB       VAL  22  -0.010   1.390  -5.674
  161   HG11  VAL  22          1HG1      VAL  22   2.201   1.400  -4.721
  162   HG12  VAL  22          2HG1      VAL  22   2.121   0.162  -5.974
  163   HG13  VAL  22          3HG1      VAL  22   2.054  -0.300  -4.273
  164   HG21  VAL  22          1HG2      VAL  22   0.036  -0.927  -6.526
  165   HG22  VAL  22          2HG2      VAL  22  -1.462  -0.529  -5.685
  166   HG23  VAL  22          3HG2      VAL  22  -0.231  -1.504  -4.883
  167    H    CYS  23           H        CYS  23  -1.366  -1.216  -3.177
  168    HA   CYS  23           HA       CYS  23  -0.263  -1.711  -0.601
  169    HB2  CYS  23          2HB       CYS  23  -2.369  -2.726  -1.292
  170    HB3  CYS  23          1HB       CYS  23  -1.524  -3.595  -2.576
  171    H    SER  24           H        SER  24   1.593  -2.390  -0.160
  172    HA   SER  24           HA       SER  24   3.348  -3.339  -2.256
  173    HB2  SER  24          2HB       SER  24   4.245  -1.650  -0.732
  174    HB3  SER  24          1HB       SER  24   3.887  -2.682   0.650
  175    HG   SER  24           HG       SER  24   6.110  -2.782  -0.019
  176    H    ARG  25           H        ARG  25   3.344  -5.438  -2.686
  177    HA   ARG  25           HA       ARG  25   2.335  -7.462  -1.091
  178    HB2  ARG  25          2HB       ARG  25   3.516  -8.865  -2.769
  179    HB3  ARG  25          1HB       ARG  25   2.447  -7.659  -3.472
  180    HG2  ARG  25          2HG       ARG  25   4.498  -6.214  -3.810
  181    HG3  ARG  25          1HG       ARG  25   5.453  -7.597  -3.302
  182    HD2  ARG  25          2HD       ARG  25   3.525  -7.634  -5.610
  183    HD3  ARG  25          1HD       ARG  25   5.247  -7.305  -5.785
  184    HE   ARG  25           HE       ARG  25   5.030  -9.678  -4.425
  185   HH11  ARG  25          1HH1      ARG  25   3.990  -8.482  -7.582
  186   HH12  ARG  25          2HH1      ARG  25   4.218  -9.954  -8.412
  187   HH21  ARG  25          1HH2      ARG  25   5.368 -11.734  -5.537
  188   HH22  ARG  25          2HH2      ARG  25   5.035 -11.850  -7.199
  189    H    LYS  26           H        LYS  26   5.278  -5.791  -1.010
  190    HA   LYS  26           HA       LYS  26   6.860  -7.918   0.170
  191    HB2  LYS  26          2HB       LYS  26   7.748  -6.249  -1.466
  192    HB3  LYS  26          1HB       LYS  26   7.485  -5.009  -0.270
  193    HG2  LYS  26          2HG       LYS  26   9.061  -6.104   1.243
  194    HG3  LYS  26          1HG       LYS  26   9.373  -7.335   0.014
  195    HD2  LYS  26          2HD       LYS  26  10.123  -5.567  -1.529
  196    HD3  LYS  26          1HD       LYS  26   9.863  -4.372  -0.262
  197    HE2  LYS  26          2HE       LYS  26  11.798  -6.680  -0.172
  198    HE3  LYS  26          1HE       LYS  26  12.206  -4.985  -0.408
  199    HZ1  LYS  26          1HZ       LYS  26  12.578  -5.663   1.856
  200    HZ2  LYS  26          2HZ       LYS  26  10.972  -6.127   2.050
  201    HZ3  LYS  26          3HZ       LYS  26  11.374  -4.505   1.790
  202    H    ASP  27           H        ASP  27   5.970  -4.582   1.010
  203    HA   ASP  27           HA       ASP  27   6.755  -4.841   3.723
  204    HB2  ASP  27          2HB       ASP  27   5.184  -2.689   2.313
  205    HB3  ASP  27          1HB       ASP  27   5.887  -2.575   3.915
  206    H    LYS  28           H        LYS  28   3.758  -5.262   1.960
  207    HA   LYS  28           HA       LYS  28   1.834  -5.976   2.412
  208    HB2  LYS  28          2HB       LYS  28   2.969  -6.645   5.117
  209    HB3  LYS  28          1HB       LYS  28   1.362  -7.072   4.512
  210    HG2  LYS  28          2HG       LYS  28   2.220  -8.442   2.791
  211    HG3  LYS  28          1HG       LYS  28   3.857  -7.838   3.033
  212    HD2  LYS  28          2HD       LYS  28   2.341  -9.403   5.108
  213    HD3  LYS  28          1HD       LYS  28   3.392 -10.150   3.906
  214    HE2  LYS  28          2HE       LYS  28   4.286  -8.034   5.871
  215    HE3  LYS  28          1HE       LYS  28   4.477  -9.766   6.116
  216    HZ1  LYS  28          1HZ       LYS  28   6.502  -8.759   5.245
  217    HZ2  LYS  28          2HZ       LYS  28   5.717  -8.210   3.869
  218    HZ3  LYS  28          3HZ       LYS  28   5.879  -9.850   4.142
  219    H    TRP  29           H        TRP  29   2.705  -3.266   2.975
  220    HA   TRP  29           HA       TRP  29   0.115  -2.397   3.921
  221    HB2  TRP  29          2HB       TRP  29   1.075  -0.537   5.200
  222    HB3  TRP  29          1HB       TRP  29   1.583  -2.071   5.871
  223    HD1  TRP  29           HD       TRP  29   3.069   0.559   3.422
  224    HE1  TRP  29          1HE       TRP  29   5.530   0.851   3.977
  225    HE3  TRP  29          3HE       TRP  29   3.418  -2.884   7.146
  226    HZ2  TRP  29          2HZ       TRP  29   7.400  -0.233   5.807
  227    HZ3  TRP  29          3HZ       TRP  29   5.588  -3.200   8.263
  228    HH2  TRP  29           HH       TRP  29   7.540  -1.899   7.603
  229    H    CYS  30           H        CYS  30  -0.309  -0.097   3.172
  230    HA   CYS  30           HA       CYS  30   0.275   0.099   0.455
  231    HB2  CYS  30          2HB       CYS  30  -0.726   2.165   2.402
  232    HB3  CYS  30          1HB       CYS  30  -0.882   2.176   0.653
  233    H    LYS  31           H        LYS  31   1.838   1.289  -0.535
  234    HA   LYS  31           HA       LYS  31   3.528   3.066   0.987
  235    HB2  LYS  31          2HB       LYS  31   4.368   0.618   1.284
  236    HB3  LYS  31          1HB       LYS  31   4.651   0.670  -0.445
  237    HG2  LYS  31          2HG       LYS  31   6.350   2.321  -0.206
  238    HG3  LYS  31          1HG       LYS  31   6.028   2.461   1.531
  239    HD2  LYS  31          2HD       LYS  31   6.682   0.116   1.785
  240    HD3  LYS  31          1HD       LYS  31   6.965   0.012   0.049
  241    HE2  LYS  31          2HE       LYS  31   8.712   1.716   0.241
  242    HE3  LYS  31          1HE       LYS  31   8.433   1.805   1.980
  243    HZ1  LYS  31          1HZ       LYS  31   9.035  -0.566   2.112
  244    HZ2  LYS  31          2HZ       LYS  31  10.303   0.390   1.511
  245    HZ3  LYS  31          3HZ       LYS  31   9.396  -0.558   0.466
  246    H    TYR  32           H        TYR  32   5.366   3.427  -0.813
  247    HA   TYR  32           HA       TYR  32   3.963   4.299  -3.233
  248    HB2  TYR  32          2HB       TYR  32   5.433   5.815  -1.712
  249    HB3  TYR  32          1HB       TYR  32   6.773   4.894  -2.329
  250    HD1  TYR  32          1HD       TYR  32   7.530   5.159  -4.643
  251    HD2  TYR  32          2HD       TYR  32   4.289   7.440  -3.118
  252    HE1  TYR  32          1HE       TYR  32   7.763   6.716  -6.503
  253    HE2  TYR  32          2HE       TYR  32   4.500   8.996  -4.981
  254    HH   TYR  32           HH       TYR  32   6.344   9.735  -6.551
  255    H    GLN  33           H        GLN  33   4.706   3.407  -5.207
  256    HA   GLN  33           HA       GLN  33   6.404   1.091  -4.927
  257    HB2  GLN  33          2HB       GLN  33   4.346   1.150  -6.358
  258    HB3  GLN  33          1HB       GLN  33   5.235   2.253  -7.415
  259    HG2  GLN  33          2HG       GLN  33   6.808   0.554  -7.998
  260    HG3  GLN  33          1HG       GLN  33   6.167  -0.539  -6.774
  261   HE21  GLN  33          1HE2      GLN  33   5.713  -2.156  -8.229
  262   HE22  GLN  33          2HE2      GLN  33   4.439  -2.051  -9.376
  263    H    ILE  34           H        ILE  34   7.806   2.720  -4.149
  264    HA   ILE  34           HA       ILE  34   9.362   4.355  -5.869
  265    HB   ILE  34           HB       ILE  34   9.206   4.970  -3.543
  266   HG12  ILE  34          2HG1      ILE  34  11.626   5.221  -2.916
  267   HG13  ILE  34          1HG1      ILE  34  12.016   4.172  -4.274
  268   HG21  ILE  34          1HG2      ILE  34  10.563   2.396  -2.827
  269   HG22  ILE  34          2HG2      ILE  34   8.898   2.861  -2.475
  270   HG23  ILE  34          3HG2      ILE  34  10.235   3.724  -1.713
  271   HD11  ILE  34          1HD1      ILE  34  12.315   6.519  -4.829
  272   HD12  ILE  34          2HD1      ILE  34  10.616   6.827  -4.465
  273   HD13  ILE  34          3HD1      ILE  34  11.055   5.781  -5.816
  Start of MODEL   17
    1    H1   ASP   1          1HT       ASP   1 -12.181   7.901   0.409
    2    H2   ASP   1          2HT       ASP   1 -11.394   8.162  -1.041
    3    H3   ASP   1          3HT       ASP   1 -11.935   9.488  -0.132
    4    HA   ASP   1           HA       ASP   1  -9.551   9.160   0.070
    5    HB2  ASP   1          2HB       ASP   1  -9.368   9.005   2.526
    6    HB3  ASP   1          1HB       ASP   1 -10.653  10.091   2.040
    7    H    CYS   2           H        CYS   2  -7.933   7.878   1.212
    8    HA   CYS   2           HA       CYS   2  -8.337   5.037   0.524
    9    HB2  CYS   2          2HB       CYS   2  -5.817   6.662   0.285
   10    HB3  CYS   2          1HB       CYS   2  -6.017   4.976  -0.135
   11    H    LEU   3           H        LEU   3  -6.548   3.705   1.517
   12    HA   LEU   3           HA       LEU   3  -6.140   4.228   4.289
   13    HB2  LEU   3          2HB       LEU   3  -4.923   2.186   2.419
   14    HB3  LEU   3          1HB       LEU   3  -4.884   2.152   4.164
   15    HG   LEU   3           HG       LEU   3  -7.334   1.791   2.444
   16   HD11  LEU   3          1HD1      LEU   3  -5.772  -0.189   4.090
   17   HD12  LEU   3          2HD1      LEU   3  -5.832  -0.111   2.328
   18   HD13  LEU   3          3HD1      LEU   3  -7.284  -0.518   3.243
   19   HD21  LEU   3          1HD2      LEU   3  -7.848   2.866   4.581
   20   HD22  LEU   3          2HD2      LEU   3  -7.032   1.552   5.435
   21   HD23  LEU   3          3HD2      LEU   3  -8.486   1.228   4.492
   22    H    GLY   4           H        GLY   4  -4.104   4.822   5.111
   23    HA2  GLY   4          2HA       GLY   4  -2.470   6.346   3.301
   24    HA3  GLY   4          1HA       GLY   4  -2.259   6.204   5.043
   25    H    PHE   5           H        PHE   5   0.059   6.097   4.187
   26    HA   PHE   5           HA       PHE   5   0.682   3.473   3.215
   27    HB2  PHE   5          2HB       PHE   5   3.018   4.399   3.040
   28    HB3  PHE   5          1HB       PHE   5   1.849   5.255   2.053
   29    HD1  PHE   5          1HD       PHE   5   1.113   7.544   2.714
   30    HD2  PHE   5          2HD       PHE   5   4.203   5.474   4.790
   31    HE1  PHE   5          1HE       PHE   5   1.863   9.655   3.711
   32    HE2  PHE   5          2HE       PHE   5   4.943   7.580   5.788
   33    HZ   PHE   5           HZ       PHE   5   3.786   9.671   5.254
   34    H    LEU   6           H        LEU   6   2.400   2.336   4.367
   35    HA   LEU   6           HA       LEU   6   3.369   1.387   6.185
   36    HB2  LEU   6          2HB       LEU   6   2.083   3.485   7.893
   37    HB3  LEU   6          1HB       LEU   6   3.424   2.444   8.363
   38    HG   LEU   6           HG       LEU   6   3.420   4.740   6.434
   39   HD11  LEU   6          1HD1      LEU   6   4.984   5.779   8.048
   40   HD12  LEU   6          2HD1      LEU   6   4.778   4.387   9.109
   41   HD13  LEU   6          3HD1      LEU   6   3.404   5.434   8.754
   42   HD21  LEU   6          1HD2      LEU   6   5.869   4.394   6.229
   43   HD22  LEU   6          2HD2      LEU   6   4.939   3.034   5.600
   44   HD23  LEU   6          3HD2      LEU   6   5.718   2.915   7.178
   45    H    TRP   7           H        TRP   7   0.302   1.583   5.344
   46    HA   TRP   7           HA       TRP   7  -0.853   0.227   7.616
   47    HB2  TRP   7          2HB       TRP   7  -1.969   1.538   5.160
   48    HB3  TRP   7          1HB       TRP   7  -2.933   0.563   6.240
   49    HD1  TRP   7           HD       TRP   7  -0.343   3.050   7.611
   50    HE1  TRP   7          1HE       TRP   7  -1.547   4.929   8.849
   51    HE3  TRP   7          3HE       TRP   7  -5.135   1.829   6.396
   52    HZ2  TRP   7          2HZ       TRP   7  -4.218   5.802   9.260
   53    HZ3  TRP   7          3HZ       TRP   7  -6.968   3.245   7.248
   54    HH2  TRP   7           HH       TRP   7  -6.510   5.185   8.648
   55    H    LYS   8           H        LYS   8  -1.753  -1.715   7.351
   56    HA   LYS   8           HA       LYS   8  -0.482  -3.587   5.656
   57    HB2  LYS   8          2HB       LYS   8  -1.402  -4.090   7.903
   58    HB3  LYS   8          1HB       LYS   8  -3.015  -3.803   7.288
   59    HG2  LYS   8          2HG       LYS   8  -2.719  -5.742   5.762
   60    HG3  LYS   8          1HG       LYS   8  -1.163  -6.059   6.535
   61    HD2  LYS   8          2HD       LYS   8  -2.286  -6.284   8.709
   62    HD3  LYS   8          1HD       LYS   8  -3.839  -5.975   7.940
   63    HE2  LYS   8          2HE       LYS   8  -3.454  -8.039   6.542
   64    HE3  LYS   8          1HE       LYS   8  -2.013  -8.335   7.503
   65    HZ1  LYS   8          1HZ       LYS   8  -3.934  -9.586   8.328
   66    HZ2  LYS   8          2HZ       LYS   8  -4.770  -8.156   8.593
   67    HZ3  LYS   8          3HZ       LYS   8  -3.380  -8.487   9.479
   68    H    CYS   9           H        CYS   9  -0.944  -3.973   3.558
   69    HA   CYS   9           HA       CYS   9  -3.197  -2.737   2.291
   70    HB2  CYS   9          2HB       CYS   9  -2.346  -3.716   0.273
   71    HB3  CYS   9          1HB       CYS   9  -0.979  -3.037   1.163
   72    H    ASN  10           H        ASN  10  -4.844  -3.980   1.120
   73    HA   ASN  10           HA       ASN  10  -5.135  -6.735   2.042
   74    HB2  ASN  10          2HB       ASN  10  -6.530  -5.183   3.479
   75    HB3  ASN  10          1HB       ASN  10  -7.400  -4.723   2.021
   76   HD21  ASN  10          1HD2      ASN  10  -6.888  -7.150   4.381
   77   HD22  ASN  10          2HD2      ASN  10  -8.177  -8.191   3.927
   78    HA   PRO  11           HA       PRO  11  -5.399  -6.443  -2.489
   79    HB2  PRO  11          2HB       PRO  11  -5.433  -9.393  -2.231
   80    HB3  PRO  11          1HB       PRO  11  -4.393  -8.358  -3.215
   81    HG2  PRO  11          2HG       PRO  11  -3.430  -9.521  -1.030
   82    HG3  PRO  11          1HG       PRO  11  -2.988  -7.849  -1.427
   83    HD2  PRO  11          2HD       PRO  11  -4.993  -8.856   0.558
   84    HD3  PRO  11          1HD       PRO  11  -3.783  -7.560   0.730
   85    H    SER  12           H        SER  12  -7.674  -7.890  -0.327
   86    HA   SER  12           HA       SER  12  -9.467  -8.723  -2.423
   87    HB2  SER  12          2HB       SER  12  -9.612  -8.848   0.569
   88    HB3  SER  12          1HB       SER  12 -10.691  -9.647  -0.575
   89    HG   SER  12           HG       SER  12  -8.329 -10.322  -1.347
   90    H    ASN  13           H        ASN  13  -8.781  -6.023  -0.490
   91    HA   ASN  13           HA       ASN  13 -10.979  -4.539  -1.398
   92    HB2  ASN  13          2HB       ASN  13 -11.979  -5.783   0.549
   93    HB3  ASN  13          1HB       ASN  13 -10.789  -5.020   1.588
   94   HD21  ASN  13          1HD2      ASN  13 -12.421  -3.961   2.777
   95   HD22  ASN  13          2HD2      ASN  13 -13.270  -2.592   2.158
   96    H    ASP  14           H        ASP  14  -9.148  -3.662  -2.202
   97    HA   ASP  14           HA       ASP  14  -7.153  -2.646  -0.387
   98    HB2  ASP  14          2HB       ASP  14  -6.466  -4.020  -2.248
   99    HB3  ASP  14          1HB       ASP  14  -7.212  -2.915  -3.387
  100    H    LYS  15           H        LYS  15  -7.072  -0.638  -0.020
  101    HA   LYS  15           HA       LYS  15  -8.807   1.099  -1.593
  102    HB2  LYS  15          2HB       LYS  15  -9.178   0.100   1.047
  103    HB3  LYS  15          1HB       LYS  15  -8.963   1.848   1.105
  104    HG2  LYS  15          2HG       LYS  15 -11.316   1.389   0.924
  105    HG3  LYS  15          1HG       LYS  15 -10.739   2.020  -0.640
  106    HD2  LYS  15          2HD       LYS  15 -10.686  -0.231  -1.521
  107    HD3  LYS  15          1HD       LYS  15 -11.211  -0.867   0.036
  108    HE2  LYS  15          2HE       LYS  15 -13.311   0.314  -0.139
  109    HE3  LYS  15          1HE       LYS  15 -12.791   1.085  -1.635
  110    HZ1  LYS  15          1HZ       LYS  15 -12.747  -1.092  -2.696
  111    HZ2  LYS  15          2HZ       LYS  15 -14.265  -0.829  -2.017
  112    HZ3  LYS  15          3HZ       LYS  15 -13.171  -1.837  -1.245
  113    H    CYS  16           H        CYS  16  -5.891   0.626  -1.358
  114    HA   CYS  16           HA       CYS  16  -5.010   3.054  -0.074
  115    HB2  CYS  16          2HB       CYS  16  -3.435   0.866  -1.475
  116    HB3  CYS  16          1HB       CYS  16  -2.714   2.290  -0.718
  117    H    CYS  17           H        CYS  17  -3.886   4.731  -1.286
  118    HA   CYS  17           HA       CYS  17  -5.293   5.284  -3.692
  119    HB2  CYS  17          2HB       CYS  17  -3.227   6.752  -2.153
  120    HB3  CYS  17          1HB       CYS  17  -3.638   7.291  -3.766
  121    H    ARG  18           H        ARG  18  -4.759   3.820  -5.230
  122    HA   ARG  18           HA       ARG  18  -2.109   3.521  -6.110
  123    HB2  ARG  18          2HB       ARG  18  -3.064   2.236  -7.975
  124    HB3  ARG  18          1HB       ARG  18  -3.803   1.739  -6.473
  125    HG2  ARG  18          2HG       ARG  18  -5.067   3.690  -8.345
  126    HG3  ARG  18          1HG       ARG  18  -5.341   1.944  -8.479
  127    HD2  ARG  18          2HD       ARG  18  -6.121   3.851  -6.263
  128    HD3  ARG  18          1HD       ARG  18  -7.172   2.956  -7.344
  129    HE   ARG  18           HE       ARG  18  -5.462   1.377  -5.602
  130   HH11  ARG  18          1HH1      ARG  18  -8.682   2.701  -6.221
  131   HH12  ARG  18          2HH1      ARG  18  -9.477   1.649  -5.156
  132   HH21  ARG  18          1HH2      ARG  18  -6.541  -0.053  -4.061
  133   HH22  ARG  18          2HH2      ARG  18  -8.213   0.023  -3.907
  134    HA   PRO  19           HA       PRO  19  -1.166   3.155  -8.043
  135    HB2  PRO  19          2HB       PRO  19   0.494   3.932  -9.914
  136    HB3  PRO  19          1HB       PRO  19  -1.220   3.584 -10.252
  137    HG2  PRO  19          2HG       PRO  19   0.135   6.231 -10.036
  138    HG3  PRO  19          1HG       PRO  19  -1.113   5.702 -11.174
  139    HD2  PRO  19          2HD       PRO  19  -1.522   7.105  -8.751
  140    HD3  PRO  19          1HD       PRO  19  -2.772   6.340  -9.753
  141    H    ASN  20           H        ASN  20  -0.617   6.228  -6.973
  142    HA   ASN  20           HA       ASN  20   2.142   6.291  -6.647
  143    HB2  ASN  20          2HB       ASN  20   1.812   8.171  -5.276
  144    HB3  ASN  20          1HB       ASN  20   0.668   8.266  -6.603
  145   HD21  ASN  20          1HD2      ASN  20   1.104   8.060  -3.225
  146   HD22  ASN  20          2HD2      ASN  20  -0.555   8.217  -2.785
  147    H    LEU  21           H        LEU  21  -0.406   5.092  -4.484
  148    HA   LEU  21           HA       LEU  21   1.728   3.903  -2.879
  149    HB2  LEU  21          2HB       LEU  21  -1.160   4.175  -2.197
  150    HB3  LEU  21          1HB       LEU  21   0.092   3.548  -1.208
  151    HG   LEU  21           HG       LEU  21  -0.173   6.462  -1.953
  152   HD11  LEU  21          1HD1      LEU  21  -1.867   5.739  -0.369
  153   HD12  LEU  21          2HD1      LEU  21  -0.673   6.765   0.430
  154   HD13  LEU  21          3HD1      LEU  21  -0.626   5.019   0.654
  155   HD21  LEU  21          1HD2      LEU  21   2.160   5.845  -1.698
  156   HD22  LEU  21          2HD2      LEU  21   1.808   5.051  -0.165
  157   HD23  LEU  21          3HD2      LEU  21   1.638   6.802  -0.310
  158    H    VAL  22           H        VAL  22   1.574   1.869  -2.564
  159    HA   VAL  22           HA       VAL  22  -0.521   0.226  -3.656
  160    HB   VAL  22           HB       VAL  22   0.934   0.767  -5.606
  161   HG11  VAL  22          1HG1      VAL  22   2.991  -0.907  -4.202
  162   HG12  VAL  22          2HG1      VAL  22   3.080   0.822  -4.494
  163   HG13  VAL  22          3HG1      VAL  22   3.122  -0.305  -5.858
  164   HG21  VAL  22          1HG2      VAL  22   0.786  -2.157  -4.886
  165   HG22  VAL  22          2HG2      VAL  22   1.093  -1.538  -6.508
  166   HG23  VAL  22          3HG2      VAL  22  -0.450  -1.211  -5.716
  167    H    CYS  23           H        CYS  23  -0.116  -2.002  -3.147
  168    HA   CYS  23           HA       CYS  23   1.174  -2.232  -0.596
  169    HB2  CYS  23          2HB       CYS  23  -0.855  -3.525  -1.051
  170    HB3  CYS  23          1HB       CYS  23   0.023  -4.420  -2.300
  171    H    SER  24           H        SER  24   3.112  -2.641  -0.310
  172    HA   SER  24           HA       SER  24   4.853  -3.485  -2.458
  173    HB2  SER  24          2HB       SER  24   5.591  -1.746  -0.843
  174    HB3  SER  24          1HB       SER  24   5.355  -2.917   0.459
  175    HG   SER  24           HG       SER  24   7.535  -2.799  -0.141
  176    H    ARG  25           H        ARG  25   5.310  -5.588  -2.737
  177    HA   ARG  25           HA       ARG  25   4.117  -7.547  -1.025
  178    HB2  ARG  25          2HB       ARG  25   4.350  -7.916  -3.444
  179    HB3  ARG  25          1HB       ARG  25   6.095  -7.878  -3.288
  180    HG2  ARG  25          2HG       ARG  25   6.009  -9.884  -1.896
  181    HG3  ARG  25          1HG       ARG  25   4.255  -9.923  -2.093
  182    HD2  ARG  25          2HD       ARG  25   5.355 -11.449  -3.638
  183    HD3  ARG  25          1HD       ARG  25   4.517 -10.156  -4.494
  184    HE   ARG  25           HE       ARG  25   7.247  -9.523  -4.019
  185   HH11  ARG  25          1HH1      ARG  25   5.074 -11.270  -6.207
  186   HH12  ARG  25          2HH1      ARG  25   6.193 -11.339  -7.483
  187   HH21  ARG  25          1HH2      ARG  25   8.777  -9.593  -5.822
  188   HH22  ARG  25          2HH2      ARG  25   8.316 -10.385  -7.263
  189    H    LYS  26           H        LYS  26   7.120  -5.981  -1.241
  190    HA   LYS  26           HA       LYS  26   8.695  -7.860   0.229
  191    HB2  LYS  26          2HB       LYS  26   9.565  -6.083  -1.357
  192    HB3  LYS  26          1HB       LYS  26   9.185  -4.903  -0.121
  193    HG2  LYS  26          2HG       LYS  26  10.726  -5.958   1.420
  194    HG3  LYS  26          1HG       LYS  26  11.088  -7.199   0.231
  195    HD2  LYS  26          2HD       LYS  26  12.902  -5.719   0.065
  196    HD3  LYS  26          1HD       LYS  26  11.869  -5.282  -1.283
  197    HE2  LYS  26          2HE       LYS  26  11.884  -3.821   1.365
  198    HE3  LYS  26          1HE       LYS  26  12.895  -3.366   0.008
  199    HZ1  LYS  26          1HZ       LYS  26  10.687  -3.100  -1.248
  200    HZ2  LYS  26          2HZ       LYS  26  11.130  -1.986  -0.109
  201    HZ3  LYS  26          3HZ       LYS  26   9.945  -3.076   0.295
  202    H    ASP  27           H        ASP  27   7.474  -4.616   0.979
  203    HA   ASP  27           HA       ASP  27   8.051  -4.720   3.732
  204    HB2  ASP  27          2HB       ASP  27   6.242  -2.867   2.182
  205    HB3  ASP  27          1HB       ASP  27   6.854  -2.617   3.800
  206    H    LYS  28           H        LYS  28   5.192  -5.376   1.760
  207    HA   LYS  28           HA       LYS  28   3.339  -6.296   2.023
  208    HB2  LYS  28          2HB       LYS  28   4.140  -7.062   4.831
  209    HB3  LYS  28          1HB       LYS  28   2.782  -7.656   3.858
  210    HG2  LYS  28          2HG       LYS  28   4.365  -8.480   2.173
  211    HG3  LYS  28          1HG       LYS  28   5.691  -8.014   3.232
  212    HD2  LYS  28          2HD       LYS  28   4.820  -9.546   4.945
  213    HD3  LYS  28          1HD       LYS  28   3.544 -10.041   3.826
  214    HE2  LYS  28          2HE       LYS  28   6.513 -10.376   3.467
  215    HE3  LYS  28          1HE       LYS  28   5.326 -11.647   3.736
  216    HZ1  LYS  28          1HZ       LYS  28   4.315 -11.056   1.598
  217    HZ2  LYS  28          2HZ       LYS  28   5.901 -11.567   1.444
  218    HZ3  LYS  28          3HZ       LYS  28   5.543  -9.926   1.310
  219    H    TRP  29           H        TRP  29   3.781  -3.566   2.638
  220    HA   TRP  29           HA       TRP  29   1.119  -3.104   3.696
  221    HB2  TRP  29          2HB       TRP  29   1.820  -1.171   5.030
  222    HB3  TRP  29          1HB       TRP  29   2.622  -2.613   5.609
  223    HD1  TRP  29           HD       TRP  29   3.501   0.392   3.272
  224    HE1  TRP  29          1HE       TRP  29   5.931   1.078   3.738
  225    HE3  TRP  29          3HE       TRP  29   4.686  -3.175   6.724
  226    HZ2  TRP  29          2HZ       TRP  29   8.072   0.227   5.381
  227    HZ3  TRP  29          3HZ       TRP  29   6.948  -3.157   7.703
  228    HH2  TRP  29           HH       TRP  29   8.596  -1.491   7.038
  229    H    CYS  30           H        CYS  30   0.360  -0.832   3.057
  230    HA   CYS  30           HA       CYS  30   1.019  -0.394   0.379
  231    HB2  CYS  30          2HB       CYS  30  -0.661   1.055   2.418
  232    HB3  CYS  30          1HB       CYS  30  -0.485   1.595   0.754
  233    H    LYS  31           H        LYS  31   2.643   0.641  -0.322
  234    HA   LYS  31           HA       LYS  31   4.135   2.494   1.419
  235    HB2  LYS  31          2HB       LYS  31   5.059   0.040   0.808
  236    HB3  LYS  31          1HB       LYS  31   5.342   0.847  -0.730
  237    HG2  LYS  31          2HG       LYS  31   6.737   2.496   0.396
  238    HG3  LYS  31          1HG       LYS  31   6.556   1.569   1.894
  239    HD2  LYS  31          2HD       LYS  31   7.523  -0.387   0.746
  240    HD3  LYS  31          1HD       LYS  31   7.760   0.600  -0.695
  241    HE2  LYS  31          2HE       LYS  31   9.835   0.491   0.489
  242    HE3  LYS  31          1HE       LYS  31   9.190   2.122   0.665
  243    HZ1  LYS  31          1HZ       LYS  31   9.057  -0.059   2.678
  244    HZ2  LYS  31          2HZ       LYS  31   8.389   1.493   2.885
  245    HZ3  LYS  31          3HZ       LYS  31  10.046   1.297   2.739
  246    H    TYR  32           H        TYR  32   5.724   3.608  -0.420
  247    HA   TYR  32           HA       TYR  32   3.828   4.700  -2.352
  248    HB2  TYR  32          2HB       TYR  32   5.554   6.062  -0.833
  249    HB3  TYR  32          1HB       TYR  32   6.659   5.605  -2.089
  250    HD1  TYR  32          1HD       TYR  32   6.470   6.501  -4.376
  251    HD2  TYR  32          2HD       TYR  32   3.760   7.656  -1.315
  252    HE1  TYR  32          1HE       TYR  32   5.706   8.368  -5.764
  253    HE2  TYR  32          2HE       TYR  32   2.989   9.526  -2.689
  254    HH   TYR  32           HH       TYR  32   3.710   9.776  -5.973
  255    H    GLN  33           H        GLN  33   4.087   4.319  -4.460
  256    HA   GLN  33           HA       GLN  33   6.070   2.328  -5.150
  257    HB2  GLN  33          2HB       GLN  33   3.722   2.131  -5.906
  258    HB3  GLN  33          1HB       GLN  33   3.981   3.590  -6.858
  259    HG2  GLN  33          2HG       GLN  33   4.074   1.484  -8.183
  260    HG3  GLN  33          1HG       GLN  33   5.521   2.476  -8.299
  261   HE21  GLN  33          1HE2      GLN  33   7.421   1.671  -7.565
  262   HE22  GLN  33          2HE2      GLN  33   7.638   0.044  -7.015
  263    H    ILE  34           H        ILE  34   7.433   3.967  -4.526
  264    HA   ILE  34           HA       ILE  34   8.290   6.180  -6.029
  265    HB   ILE  34           HB       ILE  34  10.154   4.276  -4.558
  266   HG12  ILE  34          2HG1      ILE  34   8.693   6.720  -3.509
  267   HG13  ILE  34          1HG1      ILE  34   8.305   5.045  -3.130
  268   HG21  ILE  34          1HG2      ILE  34  10.475   7.205  -5.258
  269   HG22  ILE  34          2HG2      ILE  34  11.327   5.861  -6.019
  270   HG23  ILE  34          3HG2      ILE  34  11.617   6.240  -4.320
  271   HD11  ILE  34          1HD1      ILE  34  10.463   4.790  -2.024
  272   HD12  ILE  34          2HD1      ILE  34   9.532   6.111  -1.321
  273   HD13  ILE  34          3HD1      ILE  34  10.867   6.461  -2.421
  Start of MODEL   18
    1    H1   ASP   1          1HT       ASP   1 -13.244   6.895   2.353
    2    H2   ASP   1          2HT       ASP   1 -11.972   6.383   3.350
    3    H3   ASP   1          3HT       ASP   1 -12.727   5.283   2.335
    4    HA   ASP   1           HA       ASP   1 -11.925   6.365   0.413
    5    HB2  ASP   1          2HB       ASP   1 -10.241   8.153   0.584
    6    HB3  ASP   1          1HB       ASP   1 -11.755   8.667   1.313
    7    H    CYS   2           H        CYS   2  -9.365   6.430  -0.053
    8    HA   CYS   2           HA       CYS   2  -8.660   3.762   0.449
    9    HB2  CYS   2          2HB       CYS   2  -6.575   4.447  -0.783
   10    HB3  CYS   2          1HB       CYS   2  -8.097   4.529  -1.642
   11    H    LEU   3           H        LEU   3  -6.412   3.167   0.932
   12    HA   LEU   3           HA       LEU   3  -5.798   4.010   3.610
   13    HB2  LEU   3          2HB       LEU   3  -4.628   1.876   1.841
   14    HB3  LEU   3          1HB       LEU   3  -4.268   2.129   3.524
   15    HG   LEU   3           HG       LEU   3  -6.971   1.326   2.445
   16   HD11  LEU   3          1HD1      LEU   3  -4.837  -0.317   3.806
   17   HD12  LEU   3          2HD1      LEU   3  -5.312  -0.427   2.111
   18   HD13  LEU   3          3HD1      LEU   3  -6.453  -0.876   3.378
   19   HD21  LEU   3          1HD2      LEU   3  -7.519   0.854   4.769
   20   HD22  LEU   3          2HD2      LEU   3  -7.070   2.550   4.583
   21   HD23  LEU   3          3HD2      LEU   3  -5.924   1.398   5.275
   22    H    GLY   4           H        GLY   4  -3.939   4.965   4.222
   23    HA2  GLY   4          2HA       GLY   4  -2.332   6.294   2.223
   24    HA3  GLY   4          1HA       GLY   4  -2.280   6.536   3.970
   25    H    PHE   5           H        PHE   5   0.192   6.390   3.483
   26    HA   PHE   5           HA       PHE   5   0.932   3.726   2.800
   27    HB2  PHE   5          2HB       PHE   5   3.279   4.622   2.758
   28    HB3  PHE   5          1HB       PHE   5   2.201   5.330   1.579
   29    HD1  PHE   5          1HD       PHE   5   4.516   5.941   4.230
   30    HD2  PHE   5          2HD       PHE   5   1.289   7.675   2.062
   31    HE1  PHE   5          1HE       PHE   5   5.243   8.173   4.937
   32    HE2  PHE   5          2HE       PHE   5   2.008   9.908   2.769
   33    HZ   PHE   5           HZ       PHE   5   3.990  10.170   4.206
   34    H    LEU   6           H        LEU   6   2.501   2.631   4.008
   35    HA   LEU   6           HA       LEU   6   3.426   1.734   5.845
   36    HB2  LEU   6          2HB       LEU   6   2.306   3.968   7.482
   37    HB3  LEU   6          1HB       LEU   6   3.657   2.917   7.905
   38    HG   LEU   6           HG       LEU   6   3.569   5.078   5.825
   39   HD11  LEU   6          1HD1      LEU   6   5.096   4.883   8.437
   40   HD12  LEU   6          2HD1      LEU   6   3.731   5.947   8.096
   41   HD13  LEU   6          3HD1      LEU   6   5.266   6.190   7.265
   42   HD21  LEU   6          1HD2      LEU   6   5.996   4.649   5.507
   43   HD22  LEU   6          2HD2      LEU   6   4.995   3.275   5.038
   44   HD23  LEU   6          3HD2      LEU   6   5.866   3.249   6.573
   45    H    TRP   7           H        TRP   7   0.231   2.112   5.192
   46    HA   TRP   7           HA       TRP   7  -0.711   0.769   7.559
   47    HB2  TRP   7          2HB       TRP   7  -2.119   1.854   5.146
   48    HB3  TRP   7          1HB       TRP   7  -2.889   1.113   6.519
   49    HD1  TRP   7           HD       TRP   7  -0.252   3.225   7.920
   50    HE1  TRP   7          1HE       TRP   7  -1.144   5.497   8.686
   51    HE3  TRP   7          3HE       TRP   7  -4.810   3.098   5.646
   52    HZ2  TRP   7          2HZ       TRP   7  -3.490   7.039   8.385
   53    HZ3  TRP   7          3HZ       TRP   7  -6.330   5.016   5.941
   54    HH2  TRP   7           HH       TRP   7  -5.674   6.941   7.284
   55    H    LYS   8           H        LYS   8  -1.268  -1.236   7.492
   56    HA   LYS   8           HA       LYS   8  -0.186  -3.085   5.714
   57    HB2  LYS   8          2HB       LYS   8  -0.832  -3.594   8.028
   58    HB3  LYS   8          1HB       LYS   8  -2.521  -3.431   7.574
   59    HG2  LYS   8          2HG       LYS   8  -2.303  -5.364   6.084
   60    HG3  LYS   8          1HG       LYS   8  -0.613  -5.528   6.546
   61    HD2  LYS   8          2HD       LYS   8  -1.975  -7.099   7.810
   62    HD3  LYS   8          1HD       LYS   8  -1.296  -5.878   8.884
   63    HE2  LYS   8          2HE       LYS   8  -3.428  -4.654   8.829
   64    HE3  LYS   8          1HE       LYS   8  -4.109  -5.890   7.775
   65    HZ1  LYS   8          1HZ       LYS   8  -3.776  -7.491   9.560
   66    HZ2  LYS   8          2HZ       LYS   8  -4.745  -6.211  10.070
   67    HZ3  LYS   8          3HZ       LYS   8  -3.144  -6.283  10.541
   68    H    CYS   9           H        CYS   9  -0.805  -3.869   3.790
   69    HA   CYS   9           HA       CYS   9  -3.387  -3.000   2.798
   70    HB2  CYS   9          2HB       CYS   9  -2.414  -3.254   0.587
   71    HB3  CYS   9          1HB       CYS   9  -1.394  -2.259   1.629
   72    H    ASN  10           H        ASN  10  -3.924  -4.683   0.826
   73    HA   ASN  10           HA       ASN  10  -3.846  -7.405   1.822
   74    HB2  ASN  10          2HB       ASN  10  -5.852  -6.306   2.799
   75    HB3  ASN  10          1HB       ASN  10  -6.334  -5.780   1.199
   76   HD21  ASN  10          1HD2      ASN  10  -7.800  -7.302   3.108
   77   HD22  ASN  10          2HD2      ASN  10  -8.192  -8.811   2.349
   78    HA   PRO  11           HA       PRO  11  -3.119  -7.534  -2.634
   79    HB2  PRO  11          2HB       PRO  11  -3.194 -10.240  -2.954
   80    HB3  PRO  11          1HB       PRO  11  -1.798  -9.380  -2.295
   81    HG2  PRO  11          2HG       PRO  11  -3.982 -10.839  -0.855
   82    HG3  PRO  11          1HG       PRO  11  -2.236 -10.863  -0.547
   83    HD2  PRO  11          2HD       PRO  11  -3.931  -9.393   0.936
   84    HD3  PRO  11          1HD       PRO  11  -2.281  -8.839   0.572
   85    H    SER  12           H        SER  12  -5.922  -8.836  -1.051
   86    HA   SER  12           HA       SER  12  -7.337  -9.301  -3.536
   87    HB2  SER  12          2HB       SER  12  -7.837 -10.003  -0.676
   88    HB3  SER  12          1HB       SER  12  -8.893 -10.383  -2.037
   89    HG   SER  12           HG       SER  12  -6.939 -11.453  -2.945
   90    H    ASN  13           H        ASN  13  -6.707  -6.862  -1.532
   91    HA   ASN  13           HA       ASN  13  -8.992  -5.354  -2.142
   92    HB2  ASN  13          2HB       ASN  13  -9.819  -6.667  -0.201
   93    HB3  ASN  13          1HB       ASN  13  -8.536  -5.994   0.781
   94   HD21  ASN  13          1HD2      ASN  13 -11.448  -5.207  -0.959
   95   HD22  ASN  13          2HD2      ASN  13 -11.755  -3.695  -0.200
   96    H    ASP  14           H        ASP  14  -7.166  -4.594  -3.058
   97    HA   ASP  14           HA       ASP  14  -5.180  -3.356  -1.360
   98    HB2  ASP  14          2HB       ASP  14  -4.499  -4.597  -3.298
   99    HB3  ASP  14          1HB       ASP  14  -5.447  -3.575  -4.353
  100    H    LYS  15           H        LYS  15  -5.938  -1.662  -0.471
  101    HA   LYS  15           HA       LYS  15  -7.899  -0.061  -1.907
  102    HB2  LYS  15          2HB       LYS  15  -8.271  -1.556   0.189
  103    HB3  LYS  15          1HB       LYS  15  -7.527  -0.207   1.022
  104    HG2  LYS  15          2HG       LYS  15  -9.250   1.262   0.053
  105    HG3  LYS  15          1HG       LYS  15  -9.957  -0.220  -0.649
  106    HD2  LYS  15          2HD       LYS  15 -10.180  -1.199   1.512
  107    HD3  LYS  15          1HD       LYS  15  -9.413   0.205   2.248
  108    HE2  LYS  15          2HE       LYS  15 -12.047   0.259   0.764
  109    HE3  LYS  15          1HE       LYS  15 -11.888   0.206   2.514
  110    HZ1  LYS  15          1HZ       LYS  15 -12.274   2.434   1.766
  111    HZ2  LYS  15          2HZ       LYS  15 -10.962   2.413   0.741
  112    HZ3  LYS  15          3HZ       LYS  15 -10.740   2.348   2.429
  113    H    CYS  16           H        CYS  16  -4.863  -0.057  -1.550
  114    HA   CYS  16           HA       CYS  16  -4.225   2.230  -0.058
  115    HB2  CYS  16          2HB       CYS  16  -2.680   1.078  -2.379
  116    HB3  CYS  16          1HB       CYS  16  -2.060   2.090  -1.074
  117    H    CYS  17           H        CYS  17  -3.689   4.373  -0.901
  118    HA   CYS  17           HA       CYS  17  -5.491   5.275  -2.889
  119    HB2  CYS  17          2HB       CYS  17  -3.195   6.695  -1.580
  120    HB3  CYS  17          1HB       CYS  17  -4.356   7.474  -2.638
  121    H    ARG  18           H        ARG  18  -5.086   4.342  -4.814
  122    HA   ARG  18           HA       ARG  18  -2.496   4.370  -5.919
  123    HB2  ARG  18          2HB       ARG  18  -3.704   3.605  -8.073
  124    HB3  ARG  18          1HB       ARG  18  -3.615   2.509  -6.707
  125    HG2  ARG  18          2HG       ARG  18  -6.023   4.208  -6.851
  126    HG3  ARG  18          1HG       ARG  18  -5.847   2.994  -8.125
  127    HD2  ARG  18          2HD       ARG  18  -5.691   2.456  -5.158
  128    HD3  ARG  18          1HD       ARG  18  -7.073   2.091  -6.197
  129    HE   ARG  18           HE       ARG  18  -5.476   0.671  -7.484
  130   HH11  ARG  18          1HH1      ARG  18  -4.955   1.184  -4.024
  131   HH12  ARG  18          2HH1      ARG  18  -4.114  -0.310  -3.827
  132   HH21  ARG  18          1HH2      ARG  18  -4.269  -1.279  -7.193
  133   HH22  ARG  18          2HH2      ARG  18  -3.677  -1.695  -5.645
  134    HA   PRO  19           HA       PRO  19  -1.598   4.214  -7.797
  135    HB2  PRO  19          2HB       PRO  19   0.077   5.250  -9.514
  136    HB3  PRO  19          1HB       PRO  19  -1.617   4.901  -9.947
  137    HG2  PRO  19          2HG       PRO  19  -0.350   7.536  -9.340
  138    HG3  PRO  19          1HG       PRO  19  -1.525   7.134 -10.602
  139    HD2  PRO  19          2HD       PRO  19  -2.097   8.220  -8.064
  140    HD3  PRO  19          1HD       PRO  19  -3.273   7.513  -9.188
  141    H    ASN  20           H        ASN  20  -1.355   6.891  -6.239
  142    HA   ASN  20           HA       ASN  20   1.385   7.450  -5.799
  143    HB2  ASN  20          2HB       ASN  20  -0.384   9.024  -5.153
  144    HB3  ASN  20          1HB       ASN  20  -0.910   7.921  -3.892
  145   HD21  ASN  20          1HD2      ASN  20   2.460   8.628  -4.708
  146   HD22  ASN  20          2HD2      ASN  20   2.816   9.402  -3.217
  147    H    LEU  21           H        LEU  21  -0.863   5.492  -3.744
  148    HA   LEU  21           HA       LEU  21   1.496   4.113  -2.752
  149    HB2  LEU  21          2HB       LEU  21  -1.187   4.220  -1.451
  150    HB3  LEU  21          1HB       LEU  21   0.259   3.500  -0.864
  151    HG   LEU  21           HG       LEU  21   0.136   5.338   0.492
  152   HD11  LEU  21          1HD1      LEU  21   1.847   6.927  -0.084
  153   HD12  LEU  21          2HD1      LEU  21   1.808   6.356  -1.749
  154   HD13  LEU  21          3HD1      LEU  21   2.318   5.265  -0.460
  155   HD21  LEU  21          1HD2      LEU  21  -0.415   7.639  -0.270
  156   HD22  LEU  21          2HD2      LEU  21  -1.711   6.464  -0.371
  157   HD23  LEU  21          3HD2      LEU  21  -0.847   6.949  -1.842
  158    H    VAL  22           H        VAL  22   1.344   2.021  -2.659
  159    HA   VAL  22           HA       VAL  22  -0.897   0.600  -3.944
  160    HB   VAL  22           HB       VAL  22   1.924   0.132  -4.793
  161   HG11  VAL  22          1HG1      VAL  22   0.526  -1.810  -5.092
  162   HG12  VAL  22          2HG1      VAL  22   0.921  -1.155  -6.681
  163   HG13  VAL  22          3HG1      VAL  22  -0.667  -0.860  -5.976
  164   HG21  VAL  22          1HG2      VAL  22   1.349   2.326  -5.650
  165   HG22  VAL  22          2HG2      VAL  22  -0.141   1.694  -6.347
  166   HG23  VAL  22          3HG2      VAL  22   1.419   1.179  -6.988
  167    H    CYS  23           H        CYS  23  -1.034  -1.608  -3.271
  168    HA   CYS  23           HA       CYS  23   0.181  -2.247  -0.824
  169    HB2  CYS  23          2HB       CYS  23  -1.971  -3.202  -1.512
  170    HB3  CYS  23          1HB       CYS  23  -1.169  -4.048  -2.833
  171    H    SER  24           H        SER  24   1.987  -3.077  -0.433
  172    HA   SER  24           HA       SER  24   3.745  -4.005  -2.584
  173    HB2  SER  24          2HB       SER  24   4.551  -2.153  -1.210
  174    HB3  SER  24          1HB       SER  24   4.278  -3.110   0.240
  175    HG   SER  24           HG       SER  24   6.475  -3.008  -0.567
  176    H    ARG  25           H        ARG  25   4.335  -6.110  -2.593
  177    HA   ARG  25           HA       ARG  25   3.170  -7.842  -0.608
  178    HB2  ARG  25          2HB       ARG  25   3.218  -8.520  -2.994
  179    HB3  ARG  25          1HB       ARG  25   4.974  -8.525  -2.946
  180    HG2  ARG  25          2HG       ARG  25   4.993 -10.352  -1.402
  181    HG3  ARG  25          1HG       ARG  25   3.241 -10.288  -1.228
  182    HD2  ARG  25          2HD       ARG  25   3.021 -10.831  -3.621
  183    HD3  ARG  25          1HD       ARG  25   4.776 -10.961  -3.725
  184    HE   ARG  25           HE       ARG  25   4.594 -12.762  -2.053
  185   HH11  ARG  25          1HH1      ARG  25   1.750 -12.010  -4.030
  186   HH12  ARG  25          2HH1      ARG  25   1.127 -13.594  -3.979
  187   HH21  ARG  25          1HH2      ARG  25   3.705 -14.959  -1.990
  188   HH22  ARG  25          2HH2      ARG  25   2.257 -15.291  -2.804
  189    H    LYS  26           H        LYS  26   6.162  -6.363  -1.313
  190    HA   LYS  26           HA       LYS  26   7.839  -7.949   0.364
  191    HB2  LYS  26          2HB       LYS  26   8.636  -6.422  -1.455
  192    HB3  LYS  26          1HB       LYS  26   8.128  -5.074  -0.476
  193    HG2  LYS  26          2HG       LYS  26  10.509  -5.312  -0.261
  194    HG3  LYS  26          1HG       LYS  26   9.740  -5.724   1.269
  195    HD2  LYS  26          2HD       LYS  26   9.985  -8.112   0.747
  196    HD3  LYS  26          1HD       LYS  26  10.741  -7.695  -0.792
  197    HE2  LYS  26          2HE       LYS  26  12.541  -6.529   0.441
  198    HE3  LYS  26          1HE       LYS  26  11.795  -7.023   1.958
  199    HZ1  LYS  26          1HZ       LYS  26  12.178  -9.357   1.305
  200    HZ2  LYS  26          2HZ       LYS  26  13.616  -8.504   1.362
  201    HZ3  LYS  26          3HZ       LYS  26  12.900  -8.837  -0.115
  202    H    ASP  27           H        ASP  27   6.563  -4.654   0.711
  203    HA   ASP  27           HA       ASP  27   7.263  -4.442   3.443
  204    HB2  ASP  27          2HB       ASP  27   5.447  -2.714   1.755
  205    HB3  ASP  27          1HB       ASP  27   6.090  -2.321   3.333
  206    H    LYS  28           H        LYS  28   4.344  -5.434   1.695
  207    HA   LYS  28           HA       LYS  28   2.432  -6.149   2.201
  208    HB2  LYS  28          2HB       LYS  28   3.495  -6.577   4.995
  209    HB3  LYS  28          1HB       LYS  28   1.958  -7.130   4.314
  210    HG2  LYS  28          2HG       LYS  28   3.166  -8.446   2.639
  211    HG3  LYS  28          1HG       LYS  28   4.691  -7.951   3.369
  212    HD2  LYS  28          2HD       LYS  28   4.061 -10.179   4.132
  213    HD3  LYS  28          1HD       LYS  28   4.020  -9.030   5.468
  214    HE2  LYS  28          2HE       LYS  28   1.600  -8.859   5.296
  215    HE3  LYS  28          1HE       LYS  28   1.610  -9.900   3.873
  216    HZ1  LYS  28          1HZ       LYS  28   2.461 -10.705   6.593
  217    HZ2  LYS  28          2HZ       LYS  28   2.353 -11.717   5.235
  218    HZ3  LYS  28          3HZ       LYS  28   0.961 -11.034   5.898
  219    H    TRP  29           H        TRP  29   3.191  -3.379   2.588
  220    HA   TRP  29           HA       TRP  29   0.619  -2.629   3.620
  221    HB2  TRP  29          2HB       TRP  29   1.483  -0.704   4.861
  222    HB3  TRP  29          1HB       TRP  29   2.136  -2.191   5.507
  223    HD1  TRP  29           HD       TRP  29   3.385   0.435   2.898
  224    HE1  TRP  29          1HE       TRP  29   5.817   0.987   3.452
  225    HE3  TRP  29          3HE       TRP  29   4.007  -2.654   6.908
  226    HZ2  TRP  29          2HZ       TRP  29   7.754   0.236   5.358
  227    HZ3  TRP  29          3HZ       TRP  29   6.177  -2.664   8.055
  228    HH2  TRP  29           HH       TRP  29   8.013  -1.241   7.288
  229    H    CYS  30           H        CYS  30   0.154  -0.266   2.958
  230    HA   CYS  30           HA       CYS  30   0.575  -0.003   0.208
  231    HB2  CYS  30          2HB       CYS  30  -0.355   1.946   2.311
  232    HB3  CYS  30          1HB       CYS  30  -0.575   2.093   0.573
  233    H    LYS  31           H        LYS  31   2.605   0.593  -0.616
  234    HA   LYS  31           HA       LYS  31   4.238   2.287   1.028
  235    HB2  LYS  31          2HB       LYS  31   5.945   1.592  -0.445
  236    HB3  LYS  31          1HB       LYS  31   5.238   0.175   0.337
  237    HG2  LYS  31          2HG       LYS  31   4.035  -0.320  -1.728
  238    HG3  LYS  31          1HG       LYS  31   4.656   1.155  -2.456
  239    HD2  LYS  31          2HD       LYS  31   6.399  -1.123  -1.510
  240    HD3  LYS  31          1HD       LYS  31   5.890  -0.887  -3.183
  241    HE2  LYS  31          2HE       LYS  31   7.010   1.304  -3.190
  242    HE3  LYS  31          1HE       LYS  31   7.531   1.038  -1.530
  243    HZ1  LYS  31          1HZ       LYS  31   9.217   0.530  -3.197
  244    HZ2  LYS  31          2HZ       LYS  31   8.256  -0.725  -3.791
  245    HZ3  LYS  31          3HZ       LYS  31   8.856  -0.782  -2.209
  246    H    TYR  32           H        TYR  32   5.546   3.774  -0.355
  247    HA   TYR  32           HA       TYR  32   3.793   5.376  -2.020
  248    HB2  TYR  32          2HB       TYR  32   5.634   6.058  -0.207
  249    HB3  TYR  32          1HB       TYR  32   6.699   5.831  -1.541
  250    HD1  TYR  32          1HD       TYR  32   4.355   8.079  -0.024
  251    HD2  TYR  32          2HD       TYR  32   6.449   7.245  -3.633
  252    HE1  TYR  32          1HE       TYR  32   3.956  10.371  -0.772
  253    HE2  TYR  32          2HE       TYR  32   6.060   9.535  -4.396
  254    HH   TYR  32           HH       TYR  32   5.042  11.995  -2.380
  255    H    GLN  33           H        GLN  33   4.118   5.527  -4.238
  256    HA   GLN  33           HA       GLN  33   5.906   3.620  -5.426
  257    HB2  GLN  33          2HB       GLN  33   3.675   4.295  -6.376
  258    HB3  GLN  33          1HB       GLN  33   4.452   5.834  -6.786
  259    HG2  GLN  33          2HG       GLN  33   6.108   4.580  -8.142
  260    HG3  GLN  33          1HG       GLN  33   5.200   3.106  -7.832
  261   HE21  GLN  33          1HE2      GLN  33   2.584   4.595  -8.048
  262   HE22  GLN  33          2HE2      GLN  33   2.417   4.862  -9.747
  263    H    ILE  34           H        ILE  34   7.514   4.628  -4.213
  264    HA   ILE  34           HA       ILE  34   8.813   7.064  -4.897
  265    HB   ILE  34           HB       ILE  34  10.232   4.601  -3.817
  266   HG12  ILE  34          2HG1      ILE  34   8.793   6.787  -2.282
  267   HG13  ILE  34          1HG1      ILE  34   8.259   5.118  -2.478
  268   HG21  ILE  34          1HG2      ILE  34  11.759   6.246  -2.799
  269   HG22  ILE  34          2HG2      ILE  34  10.849   7.552  -3.555
  270   HG23  ILE  34          3HG2      ILE  34  11.726   6.394  -4.557
  271   HD11  ILE  34          1HD1      ILE  34   9.265   5.518  -0.286
  272   HD12  ILE  34          2HD1      ILE  34  10.779   5.974  -1.072
  273   HD13  ILE  34          3HD1      ILE  34  10.164   4.328  -1.225
  Start of MODEL   19
    1    H1   ASP   1          1HT       ASP   1 -13.017   7.385   2.433
    2    H2   ASP   1          2HT       ASP   1 -12.327   6.002   3.141
    3    H3   ASP   1          3HT       ASP   1 -12.830   5.946   1.549
    4    HA   ASP   1           HA       ASP   1 -11.142   7.492   0.904
    5    HB2  ASP   1          2HB       ASP   1 -10.401   7.352   3.843
    6    HB3  ASP   1          1HB       ASP   1  -9.292   7.899   2.599
    7    H    CYS   2           H        CYS   2  -8.678   6.794   1.035
    8    HA   CYS   2           HA       CYS   2  -8.724   3.887   0.852
    9    HB2  CYS   2          2HB       CYS   2  -6.541   4.396  -0.400
   10    HB3  CYS   2          1HB       CYS   2  -8.065   4.706  -1.211
   11    H    LEU   3           H        LEU   3  -6.392   3.050   1.175
   12    HA   LEU   3           HA       LEU   3  -5.693   3.661   3.891
   13    HB2  LEU   3          2HB       LEU   3  -4.610   1.677   1.913
   14    HB3  LEU   3          1HB       LEU   3  -4.150   1.800   3.589
   15    HG   LEU   3           HG       LEU   3  -6.904   1.137   2.608
   16   HD11  LEU   3          1HD1      LEU   3  -5.310  -0.617   2.040
   17   HD12  LEU   3          2HD1      LEU   3  -6.392  -1.148   3.326
   18   HD13  LEU   3          3HD1      LEU   3  -4.741  -0.657   3.710
   19   HD21  LEU   3          1HD2      LEU   3  -7.305   0.451   4.940
   20   HD22  LEU   3          2HD2      LEU   3  -6.920   2.165   4.817
   21   HD23  LEU   3          3HD2      LEU   3  -5.695   1.026   5.375
   22    H    GLY   4           H        GLY   4  -4.088   4.882   4.451
   23    HA2  GLY   4          2HA       GLY   4  -2.489   6.242   2.491
   24    HA3  GLY   4          1HA       GLY   4  -2.465   6.480   4.238
   25    H    PHE   5           H        PHE   5  -0.008   6.542   3.694
   26    HA   PHE   5           HA       PHE   5   0.978   3.935   3.073
   27    HB2  PHE   5          2HB       PHE   5   3.227   5.033   3.072
   28    HB3  PHE   5          1HB       PHE   5   2.115   5.777   1.942
   29    HD1  PHE   5          1HD       PHE   5   1.052   7.992   2.597
   30    HD2  PHE   5          2HD       PHE   5   4.316   6.286   4.722
   31    HE1  PHE   5          1HE       PHE   5   1.551  10.177   3.569
   32    HE2  PHE   5          2HE       PHE   5   4.818   8.477   5.708
   33    HZ   PHE   5           HZ       PHE   5   3.431  10.432   5.131
   34    H    LEU   6           H        LEU   6   2.359   2.847   4.425
   35    HA   LEU   6           HA       LEU   6   3.284   2.081   6.327
   36    HB2  LEU   6          2HB       LEU   6   1.991   4.296   7.851
   37    HB3  LEU   6          1HB       LEU   6   3.353   3.306   8.377
   38    HG   LEU   6           HG       LEU   6   3.299   5.414   6.250
   39   HD11  LEU   6          1HD1      LEU   6   4.848   6.634   7.757
   40   HD12  LEU   6          2HD1      LEU   6   4.718   5.324   8.927
   41   HD13  LEU   6          3HD1      LEU   6   3.299   6.298   8.539
   42   HD21  LEU   6          1HD2      LEU   6   4.840   3.662   5.576
   43   HD22  LEU   6          2HD2      LEU   6   5.612   3.682   7.161
   44   HD23  LEU   6          3HD2      LEU   6   5.768   5.073   6.089
   45    H    TRP   7           H        TRP   7   0.024   2.430   5.645
   46    HA   TRP   7           HA       TRP   7  -0.911   0.949   7.933
   47    HB2  TRP   7          2HB       TRP   7  -2.280   2.014   5.476
   48    HB3  TRP   7          1HB       TRP   7  -3.072   1.186   6.789
   49    HD1  TRP   7           HD       TRP   7  -1.126   4.446   6.172
   50    HE1  TRP   7          1HE       TRP   7  -1.947   6.239   7.814
   51    HE3  TRP   7          3HE       TRP   7  -4.343   1.576   8.894
   52    HZ2  TRP   7          2HZ       TRP   7  -3.753   6.405  10.001
   53    HZ3  TRP   7          3HZ       TRP   7  -5.584   2.623  10.745
   54    HH2  TRP   7           HH       TRP   7  -5.291   4.988  11.282
   55    H    LYS   8           H        LYS   8  -1.580  -1.167   7.714
   56    HA   LYS   8           HA       LYS   8  -0.227  -2.729   5.809
   57    HB2  LYS   8          2HB       LYS   8  -0.792  -3.668   7.994
   58    HB3  LYS   8          1HB       LYS   8  -2.510  -3.582   7.608
   59    HG2  LYS   8          2HG       LYS   8  -2.138  -5.125   5.734
   60    HG3  LYS   8          1HG       LYS   8  -0.447  -5.245   6.192
   61    HD2  LYS   8          2HD       LYS   8  -1.088  -6.236   8.323
   62    HD3  LYS   8          1HD       LYS   8  -2.795  -6.068   7.895
   63    HE2  LYS   8          2HE       LYS   8  -0.764  -7.690   6.355
   64    HE3  LYS   8          1HE       LYS   8  -1.945  -8.351   7.480
   65    HZ1  LYS   8          1HZ       LYS   8  -2.633  -6.863   4.971
   66    HZ2  LYS   8          2HZ       LYS   8  -3.722  -7.569   6.033
   67    HZ3  LYS   8          3HZ       LYS   8  -2.688  -8.535   5.149
   68    H    CYS   9           H        CYS   9  -0.777  -3.589   3.923
   69    HA   CYS   9           HA       CYS   9  -3.386  -2.883   2.867
   70    HB2  CYS   9          2HB       CYS   9  -2.338  -2.986   0.690
   71    HB3  CYS   9          1HB       CYS   9  -1.408  -1.957   1.783
   72    H    ASN  10           H        ASN  10  -3.758  -4.575   0.913
   73    HA   ASN  10           HA       ASN  10  -3.263  -7.290   1.776
   74    HB2  ASN  10          2HB       ASN  10  -5.421  -6.538   2.812
   75    HB3  ASN  10          1HB       ASN  10  -5.997  -6.110   1.210
   76   HD21  ASN  10          1HD2      ASN  10  -7.120  -7.930   3.106
   77   HD22  ASN  10          2HD2      ASN  10  -7.215  -9.476   2.348
   78    HA   PRO  11           HA       PRO  11  -2.562  -7.020  -2.704
   79    HB2  PRO  11          2HB       PRO  11  -2.516  -9.981  -2.512
   80    HB3  PRO  11          1HB       PRO  11  -1.296  -8.885  -3.162
   81    HG2  PRO  11          2HG       PRO  11  -0.911 -10.099  -0.823
   82    HG3  PRO  11          1HG       PRO  11  -0.406  -8.418  -1.068
   83    HD2  PRO  11          2HD       PRO  11  -2.815  -9.481   0.361
   84    HD3  PRO  11          1HD       PRO  11  -1.725  -8.146   0.805
   85    H    SER  12           H        SER  12  -5.061  -8.902  -1.132
   86    HA   SER  12           HA       SER  12  -6.399  -9.487  -3.634
   87    HB2  SER  12          2HB       SER  12  -6.814 -10.403  -0.821
   88    HB3  SER  12          1HB       SER  12  -7.647 -10.965  -2.267
   89    HG   SER  12           HG       SER  12  -5.294 -11.369  -2.974
   90    H    ASN  13           H        ASN  13  -6.290  -7.119  -1.395
   91    HA   ASN  13           HA       ASN  13  -8.910  -6.141  -1.916
   92    HB2  ASN  13          2HB       ASN  13  -9.234  -7.699   0.085
   93    HB3  ASN  13          1HB       ASN  13  -8.207  -6.606   0.997
   94   HD21  ASN  13          1HD2      ASN  13 -10.996  -7.238   1.471
   95   HD22  ASN  13          2HD2      ASN  13 -11.854  -5.744   1.382
   96    H    ASP  14           H        ASP  14  -7.370  -4.980  -2.863
   97    HA   ASP  14           HA       ASP  14  -5.453  -3.490  -1.363
   98    HB2  ASP  14          2HB       ASP  14  -4.982  -4.519  -3.456
   99    HB3  ASP  14          1HB       ASP  14  -6.192  -3.540  -4.269
  100    H    LYS  15           H        LYS  15  -5.953  -1.679  -0.520
  101    HA   LYS  15           HA       LYS  15  -8.027  -0.039  -1.732
  102    HB2  LYS  15          2HB       LYS  15  -8.239  -1.520   0.574
  103    HB3  LYS  15          1HB       LYS  15  -7.798   0.071   1.173
  104    HG2  LYS  15          2HG       LYS  15 -10.144  -0.643  -0.549
  105    HG3  LYS  15          1HG       LYS  15 -10.204  -0.162   1.149
  106    HD2  LYS  15          2HD       LYS  15  -9.127   1.979   0.446
  107    HD3  LYS  15          1HD       LYS  15  -9.380   1.483  -1.217
  108    HE2  LYS  15          2HE       LYS  15 -11.210   2.943  -0.612
  109    HE3  LYS  15          1HE       LYS  15 -11.825   1.295  -0.727
  110    HZ1  LYS  15          1HZ       LYS  15 -12.680   2.406   1.252
  111    HZ2  LYS  15          2HZ       LYS  15 -11.131   2.750   1.761
  112    HZ3  LYS  15          3HZ       LYS  15 -11.652   1.154   1.742
  113    H    CYS  16           H        CYS  16  -4.970  -0.106  -1.654
  114    HA   CYS  16           HA       CYS  16  -4.175   2.082   0.036
  115    HB2  CYS  16          2HB       CYS  16  -2.723   0.883  -2.338
  116    HB3  CYS  16          1HB       CYS  16  -2.033   1.964  -1.131
  117    H    CYS  17           H        CYS  17  -3.599   4.206  -0.676
  118    HA   CYS  17           HA       CYS  17  -5.331   5.283  -2.642
  119    HB2  CYS  17          2HB       CYS  17  -2.947   6.563  -1.317
  120    HB3  CYS  17          1HB       CYS  17  -4.168   7.417  -2.232
  121    H    ARG  18           H        ARG  18  -4.586   3.834  -4.381
  122    HA   ARG  18           HA       ARG  18  -2.112   4.439  -5.589
  123    HB2  ARG  18          2HB       ARG  18  -2.873   2.788  -7.372
  124    HB3  ARG  18          1HB       ARG  18  -2.782   2.153  -5.744
  125    HG2  ARG  18          2HG       ARG  18  -4.731   1.226  -6.673
  126    HG3  ARG  18          1HG       ARG  18  -5.314   2.531  -5.644
  127    HD2  ARG  18          2HD       ARG  18  -6.487   2.523  -7.787
  128    HD3  ARG  18          1HD       ARG  18  -5.492   3.973  -7.597
  129    HE   ARG  18           HE       ARG  18  -4.300   1.741  -8.975
  130   HH11  ARG  18          1HH1      ARG  18  -5.996   4.813  -9.309
  131   HH12  ARG  18          2HH1      ARG  18  -5.429   5.149 -10.875
  132   HH21  ARG  18          1HH2      ARG  18  -3.501   2.172 -11.150
  133   HH22  ARG  18          2HH2      ARG  18  -3.965   3.589 -11.944
  134    HA   PRO  19           HA       PRO  19  -1.376   4.154  -7.848
  135    HB2  PRO  19          2HB       PRO  19  -0.209   5.484  -9.756
  136    HB3  PRO  19          1HB       PRO  19  -1.812   4.737 -10.002
  137    HG2  PRO  19          2HG       PRO  19  -1.164   7.613  -9.448
  138    HG3  PRO  19          1HG       PRO  19  -2.229   6.936 -10.692
  139    HD2  PRO  19          2HD       PRO  19  -3.075   7.847  -8.211
  140    HD3  PRO  19          1HD       PRO  19  -3.971   6.704  -9.231
  141    H    ASN  20           H        ASN  20  -1.657   6.938  -6.402
  142    HA   ASN  20           HA       ASN  20   0.978   7.995  -6.129
  143    HB2  ASN  20          2HB       ASN  20  -1.042   9.206  -5.342
  144    HB3  ASN  20          1HB       ASN  20  -1.247   8.022  -4.063
  145   HD21  ASN  20          1HD2      ASN  20  -1.121   9.572  -2.467
  146   HD22  ASN  20          2HD2      ASN  20   0.343  10.362  -2.041
  147    H    LEU  21           H        LEU  21  -0.814   5.714  -4.080
  148    HA   LEU  21           HA       LEU  21   1.707   4.688  -2.979
  149    HB2  LEU  21          2HB       LEU  21  -1.080   4.535  -1.879
  150    HB3  LEU  21          1HB       LEU  21   0.394   4.015  -1.116
  151    HG   LEU  21           HG       LEU  21  -0.326   6.895  -1.687
  152   HD11  LEU  21          1HD1      LEU  21  -0.549   7.120   0.709
  153   HD12  LEU  21          2HD1      LEU  21  -0.186   5.411   0.917
  154   HD13  LEU  21          3HD1      LEU  21  -1.669   5.897   0.102
  155   HD21  LEU  21          1HD2      LEU  21   1.649   7.411  -0.294
  156   HD22  LEU  21          2HD2      LEU  21   2.059   6.598  -1.799
  157   HD23  LEU  21          3HD2      LEU  21   2.062   5.693  -0.283
  158    H    VAL  22           H        VAL  22   1.619   2.458  -2.542
  159    HA   VAL  22           HA       VAL  22  -0.176   0.833  -4.185
  160    HB   VAL  22           HB       VAL  22   1.844   1.349  -5.515
  161   HG11  VAL  22          1HG1      VAL  22   4.022   0.330  -4.940
  162   HG12  VAL  22          2HG1      VAL  22   3.351  -0.140  -3.379
  163   HG13  VAL  22          3HG1      VAL  22   3.509   1.566  -3.790
  164   HG21  VAL  22          1HG2      VAL  22   1.582  -1.558  -4.767
  165   HG22  VAL  22          2HG2      VAL  22   2.465  -0.965  -6.173
  166   HG23  VAL  22          3HG2      VAL  22   0.727  -0.699  -6.053
  167    H    CYS  23           H        CYS  23  -0.072  -1.330  -3.527
  168    HA   CYS  23           HA       CYS  23   0.525  -1.694  -0.706
  169    HB2  CYS  23          2HB       CYS  23  -1.555  -2.590  -1.411
  170    HB3  CYS  23          1HB       CYS  23  -0.803  -3.450  -2.761
  171    H    SER  24           H        SER  24   2.321  -2.429  -0.097
  172    HA   SER  24           HA       SER  24   4.216  -3.415  -2.033
  173    HB2  SER  24          2HB       SER  24   5.000  -1.806  -0.373
  174    HB3  SER  24          1HB       SER  24   4.495  -2.887   0.926
  175    HG   SER  24           HG       SER  24   6.794  -2.973   0.389
  176    H    ARG  25           H        ARG  25   4.453  -5.449  -2.457
  177    HA   ARG  25           HA       ARG  25   3.057  -7.537  -1.159
  178    HB2  ARG  25          2HB       ARG  25   3.796  -7.482  -3.556
  179    HB3  ARG  25          1HB       ARG  25   5.448  -7.681  -3.006
  180    HG2  ARG  25          2HG       ARG  25   4.635  -9.789  -3.763
  181    HG3  ARG  25          1HG       ARG  25   4.783  -9.855  -2.004
  182    HD2  ARG  25          2HD       ARG  25   2.393  -9.461  -1.778
  183    HD3  ARG  25          1HD       ARG  25   2.245  -9.321  -3.529
  184    HE   ARG  25           HE       ARG  25   3.238 -11.787  -2.321
  185   HH11  ARG  25          1HH1      ARG  25   0.851 -10.125  -4.386
  186   HH12  ARG  25          2HH1      ARG  25   0.009 -11.555  -4.766
  187   HH21  ARG  25          1HH2      ARG  25   1.991 -13.750  -2.855
  188   HH22  ARG  25          2HH2      ARG  25   0.649 -13.601  -3.905
  189    H    LYS  26           H        LYS  26   6.162  -6.113  -0.880
  190    HA   LYS  26           HA       LYS  26   7.454  -8.190   0.628
  191    HB2  LYS  26          2HB       LYS  26   8.473  -6.491  -0.984
  192    HB3  LYS  26          1HB       LYS  26   8.257  -5.313   0.272
  193    HG2  LYS  26          2HG       LYS  26   9.947  -7.783   0.626
  194    HG3  LYS  26          1HG       LYS  26  10.575  -6.254   0.029
  195    HD2  LYS  26          2HD       LYS  26   9.855  -5.188   2.139
  196    HD3  LYS  26          1HD       LYS  26   9.313  -6.764   2.718
  197    HE2  LYS  26          2HE       LYS  26  11.581  -7.634   2.503
  198    HE3  LYS  26          1HE       LYS  26  12.116  -6.076   1.881
  199    HZ1  LYS  26          1HZ       LYS  26  11.511  -5.081   3.999
  200    HZ2  LYS  26          2HZ       LYS  26  12.664  -6.273   4.176
  201    HZ3  LYS  26          3HZ       LYS  26  11.082  -6.593   4.627
  202    H    ASP  27           H        ASP  27   6.471  -4.829   1.309
  203    HA   ASP  27           HA       ASP  27   7.027  -5.074   4.088
  204    HB2  ASP  27          2HB       ASP  27   5.694  -2.887   2.521
  205    HB3  ASP  27          1HB       ASP  27   6.225  -2.794   4.186
  206    H    LYS  28           H        LYS  28   4.167  -5.405   2.090
  207    HA   LYS  28           HA       LYS  28   2.143  -5.849   2.405
  208    HB2  LYS  28          2HB       LYS  28   2.986  -6.620   5.192
  209    HB3  LYS  28          1HB       LYS  28   1.359  -6.760   4.516
  210    HG2  LYS  28          2HG       LYS  28   3.777  -8.084   3.330
  211    HG3  LYS  28          1HG       LYS  28   2.652  -8.880   4.434
  212    HD2  LYS  28          2HD       LYS  28   0.809  -8.418   2.850
  213    HD3  LYS  28          1HD       LYS  28   1.965  -7.687   1.738
  214    HE2  LYS  28          2HE       LYS  28   1.478  -9.947   1.074
  215    HE3  LYS  28          1HE       LYS  28   3.156  -9.800   1.592
  216    HZ1  LYS  28          1HZ       LYS  28   0.935 -10.874   3.236
  217    HZ2  LYS  28          2HZ       LYS  28   2.541 -10.784   3.722
  218    HZ3  LYS  28          3HZ       LYS  28   2.092 -11.808   2.462
  219    H    TRP  29           H        TRP  29   3.284  -3.184   3.098
  220    HA   TRP  29           HA       TRP  29   0.722  -2.268   4.068
  221    HB2  TRP  29          2HB       TRP  29   1.706  -0.403   5.302
  222    HB3  TRP  29          1HB       TRP  29   2.364  -1.907   5.902
  223    HD1  TRP  29           HD       TRP  29   3.442   0.934   3.467
  224    HE1  TRP  29          1HE       TRP  29   5.949   1.352   3.777
  225    HE3  TRP  29          3HE       TRP  29   4.436  -2.727   6.884
  226    HZ2  TRP  29          2HZ       TRP  29   8.073   0.281   5.298
  227    HZ3  TRP  29          3HZ       TRP  29   6.737  -2.955   7.727
  228    HH2  TRP  29           HH       TRP  29   8.516  -1.480   6.945
  229    H    CYS  30           H        CYS  30   0.119  -0.077   3.278
  230    HA   CYS  30           HA       CYS  30   0.724   0.179   0.565
  231    HB2  CYS  30          2HB       CYS  30  -0.595   2.075   2.511
  232    HB3  CYS  30          1HB       CYS  30  -0.649   2.159   0.759
  233    H    LYS  31           H        LYS  31   2.267   1.380  -0.325
  234    HA   LYS  31           HA       LYS  31   3.964   3.087   1.355
  235    HB2  LYS  31          2HB       LYS  31   4.595   0.489   0.766
  236    HB3  LYS  31          1HB       LYS  31   5.142   1.320  -0.680
  237    HG2  LYS  31          2HG       LYS  31   6.715   2.586   0.502
  238    HG3  LYS  31          1HG       LYS  31   6.064   2.036   2.056
  239    HD2  LYS  31          2HD       LYS  31   6.627  -0.298   1.410
  240    HD3  LYS  31          1HD       LYS  31   7.396   0.327  -0.044
  241    HE2  LYS  31          2HE       LYS  31   8.212   1.003   2.782
  242    HE3  LYS  31          1HE       LYS  31   8.980  -0.208   1.772
  243    HZ1  LYS  31          1HZ       LYS  31   8.836   2.688   1.180
  244    HZ2  LYS  31          2HZ       LYS  31   9.577   1.533   0.204
  245    HZ3  LYS  31          3HZ       LYS  31  10.187   1.865   1.739
  246    H    TYR  32           H        TYR  32   5.562   4.051  -0.511
  247    HA   TYR  32           HA       TYR  32   3.807   5.440  -2.326
  248    HB2  TYR  32          2HB       TYR  32   5.932   6.417  -1.343
  249    HB3  TYR  32          1HB       TYR  32   6.817   5.349  -2.393
  250    HD1  TYR  32          1HD       TYR  32   3.972   7.757  -2.819
  251    HD2  TYR  32          2HD       TYR  32   7.726   6.360  -4.252
  252    HE1  TYR  32          1HE       TYR  32   3.897   9.415  -4.607
  253    HE2  TYR  32          2HE       TYR  32   7.661   8.011  -6.050
  254    HH   TYR  32           HH       TYR  32   6.006   9.308  -7.267
  255    H    GLN  33           H        GLN  33   3.528   5.089  -4.543
  256    HA   GLN  33           HA       GLN  33   4.679   2.611  -5.449
  257    HB2  GLN  33          2HB       GLN  33   2.291   3.191  -5.990
  258    HB3  GLN  33          1HB       GLN  33   2.944   4.444  -7.046
  259    HG2  GLN  33          2HG       GLN  33   4.004   2.860  -8.476
  260    HG3  GLN  33          1HG       GLN  33   3.676   1.542  -7.364
  261   HE21  GLN  33          1HE2      GLN  33   2.682   0.336  -8.939
  262   HE22  GLN  33          2HE2      GLN  33   1.139   0.705  -9.591
  263    H    ILE  34           H        ILE  34   6.525   3.598  -5.041
  264    HA   ILE  34           HA       ILE  34   8.140   5.365  -6.304
  265    HB   ILE  34           HB       ILE  34   8.953   2.473  -5.863
  266   HG12  ILE  34          2HG1      ILE  34   9.115   4.795  -3.926
  267   HG13  ILE  34          1HG1      ILE  34   7.912   3.512  -3.841
  268   HG21  ILE  34          1HG2      ILE  34  10.560   3.759  -7.165
  269   HG22  ILE  34          2HG2      ILE  34  11.195   3.390  -5.561
  270   HG23  ILE  34          3HG2      ILE  34  10.585   5.005  -5.916
  271   HD11  ILE  34          1HD1      ILE  34   9.710   3.139  -2.256
  272   HD12  ILE  34          2HD1      ILE  34  10.890   3.187  -3.562
  273   HD13  ILE  34          3HD1      ILE  34   9.705   1.883  -3.494
  Start of MODEL   20
    1    H1   ASP   1          1HT       ASP   1 -12.250   6.416   3.006
    2    H2   ASP   1          2HT       ASP   1 -12.609   6.680   1.386
    3    H3   ASP   1          3HT       ASP   1 -12.978   7.874   2.523
    4    HA   ASP   1           HA       ASP   1 -10.974   8.426   1.254
    5    HB2  ASP   1          2HB       ASP   1 -10.216   7.538   4.059
    6    HB3  ASP   1          1HB       ASP   1  -9.449   8.805   3.121
    7    H    CYS   2           H        CYS   2  -8.692   7.754   0.850
    8    HA   CYS   2           HA       CYS   2  -8.631   4.872   0.678
    9    HB2  CYS   2          2HB       CYS   2  -6.475   5.230  -0.579
   10    HB3  CYS   2          1HB       CYS   2  -7.944   5.670  -1.392
   11    H    LEU   3           H        LEU   3  -6.729   3.719   1.133
   12    HA   LEU   3           HA       LEU   3  -5.925   4.278   3.812
   13    HB2  LEU   3          2HB       LEU   3  -5.053   2.071   1.955
   14    HB3  LEU   3          1HB       LEU   3  -4.855   2.149   3.685
   15    HG   LEU   3           HG       LEU   3  -7.488   1.901   2.240
   16   HD11  LEU   3          1HD1      LEU   3  -7.549  -0.356   3.186
   17   HD12  LEU   3          2HD1      LEU   3  -5.921  -0.123   3.825
   18   HD13  LEU   3          3HD1      LEU   3  -6.193  -0.129   2.083
   19   HD21  LEU   3          1HD2      LEU   3  -7.738   3.124   4.340
   20   HD22  LEU   3          2HD2      LEU   3  -6.883   1.841   5.198
   21   HD23  LEU   3          3HD2      LEU   3  -8.449   1.516   4.464
   22    H    GLY   4           H        GLY   4  -3.972   4.916   4.486
   23    HA2  GLY   4          2HA       GLY   4  -2.250   6.225   2.575
   24    HA3  GLY   4          1HA       GLY   4  -2.145   6.311   4.328
   25    H    PHE   5           H        PHE   5   0.269   6.064   3.720
   26    HA   PHE   5           HA       PHE   5   0.839   3.342   3.046
   27    HB2  PHE   5          2HB       PHE   5   3.192   4.129   2.774
   28    HB3  PHE   5          1HB       PHE   5   2.068   4.916   1.687
   29    HD1  PHE   5          1HD       PHE   5   1.424   7.296   2.119
   30    HD2  PHE   5          2HD       PHE   5   4.504   5.343   4.312
   31    HE1  PHE   5          1HE       PHE   5   2.310   9.480   2.827
   32    HE2  PHE   5          2HE       PHE   5   5.379   7.516   5.028
   33    HZ   PHE   5           HZ       PHE   5   4.285   9.588   4.284
   34    H    LEU   6           H        LEU   6   2.295   2.206   4.275
   35    HA   LEU   6           HA       LEU   6   3.218   1.323   6.125
   36    HB2  LEU   6          2HB       LEU   6   2.287   3.693   7.686
   37    HB3  LEU   6          1HB       LEU   6   3.544   2.551   8.163
   38    HG   LEU   6           HG       LEU   6   3.655   4.617   5.986
   39   HD11  LEU   6          1HD1      LEU   6   3.841   5.597   8.205
   40   HD12  LEU   6          2HD1      LEU   6   5.415   5.661   7.412
   41   HD13  LEU   6          3HD1      LEU   6   5.096   4.441   8.645
   42   HD21  LEU   6          1HD2      LEU   6   6.033   3.994   5.744
   43   HD22  LEU   6          2HD2      LEU   6   4.945   2.667   5.341
   44   HD23  LEU   6          3HD2      LEU   6   5.792   2.677   6.890
   45    H    TRP   7           H        TRP   7   0.192   1.765   5.334
   46    HA   TRP   7           HA       TRP   7  -1.069   0.726   7.717
   47    HB2  TRP   7          2HB       TRP   7  -2.097   1.613   5.030
   48    HB3  TRP   7          1HB       TRP   7  -3.093   1.003   6.316
   49    HD1  TRP   7           HD       TRP   7  -0.340   3.657   6.923
   50    HE1  TRP   7          1HE       TRP   7  -1.442   5.851   7.667
   51    HE3  TRP   7          3HE       TRP   7  -5.218   2.341   6.323
   52    HZ2  TRP   7          2HZ       TRP   7  -4.040   6.895   7.964
   53    HZ3  TRP   7          3HZ       TRP   7  -6.959   4.000   6.847
   54    HH2  TRP   7           HH       TRP   7  -6.374   6.230   7.653
   55    H    LYS   8           H        LYS   8  -1.936  -1.312   7.680
   56    HA   LYS   8           HA       LYS   8  -0.715  -3.299   6.089
   57    HB2  LYS   8          2HB       LYS   8  -1.615  -3.602   8.421
   58    HB3  LYS   8          1HB       LYS   8  -3.234  -3.488   7.749
   59    HG2  LYS   8          2HG       LYS   8  -2.692  -5.785   8.158
   60    HG3  LYS   8          1HG       LYS   8  -2.787  -5.499   6.415
   61    HD2  LYS   8          2HD       LYS   8  -0.338  -5.358   6.305
   62    HD3  LYS   8          1HD       LYS   8  -0.245  -5.631   8.043
   63    HE2  LYS   8          2HE       LYS   8  -1.184  -7.842   7.784
   64    HE3  LYS   8          1HE       LYS   8  -1.438  -7.576   6.063
   65    HZ1  LYS   8          1HZ       LYS   8   0.971  -7.298   5.846
   66    HZ2  LYS   8          2HZ       LYS   8   0.553  -8.846   6.364
   67    HZ3  LYS   8          3HZ       LYS   8   1.182  -7.734   7.462
   68    H    CYS   9           H        CYS   9  -1.320  -4.060   4.104
   69    HA   CYS   9           HA       CYS   9  -3.721  -2.870   2.968
   70    HB2  CYS   9          2HB       CYS   9  -2.582  -3.128   0.843
   71    HB3  CYS   9          1HB       CYS   9  -1.629  -2.235   2.032
   72    H    ASN  10           H        ASN  10  -4.258  -4.272   0.869
   73    HA   ASN  10           HA       ASN  10  -4.176  -7.105   1.299
   74    HB2  ASN  10          2HB       ASN  10  -6.247  -6.285   2.432
   75    HB3  ASN  10          1HB       ASN  10  -6.736  -5.521   0.931
   76   HD21  ASN  10          1HD2      ASN  10  -8.076  -7.572   2.495
   77   HD22  ASN  10          2HD2      ASN  10  -8.309  -8.906   1.425
   78    HA   PRO  11           HA       PRO  11  -3.343  -5.975  -2.930
   79    HB2  PRO  11          2HB       PRO  11  -2.747  -8.431  -3.894
   80    HB3  PRO  11          1HB       PRO  11  -1.649  -7.514  -2.861
   81    HG2  PRO  11          2HG       PRO  11  -3.522  -9.729  -2.120
   82    HG3  PRO  11          1HG       PRO  11  -1.843  -9.464  -1.615
   83    HD2  PRO  11          2HD       PRO  11  -3.963  -8.822  -0.061
   84    HD3  PRO  11          1HD       PRO  11  -2.429  -7.929  -0.015
   85    H    SER  12           H        SER  12  -5.837  -8.277  -1.994
   86    HA   SER  12           HA       SER  12  -6.917  -8.293  -4.679
   87    HB2  SER  12          2HB       SER  12  -7.433  -9.934  -2.229
   88    HB3  SER  12          1HB       SER  12  -8.262 -10.091  -3.775
   89    HG   SER  12           HG       SER  12  -5.713 -10.108  -4.342
   90    H    ASN  13           H        ASN  13  -7.134  -6.537  -1.971
   91    HA   ASN  13           HA       ASN  13  -9.731  -5.486  -2.559
   92    HB2  ASN  13          2HB       ASN  13 -10.141  -7.523  -1.031
   93    HB3  ASN  13          1HB       ASN  13  -9.293  -6.630   0.219
   94   HD21  ASN  13          1HD2      ASN  13 -12.027  -7.606   0.078
   95   HD22  ASN  13          2HD2      ASN  13 -13.046  -6.239   0.336
   96    H    ASP  14           H        ASP  14  -8.002  -4.092  -3.045
   97    HA   ASP  14           HA       ASP  14  -6.473  -2.872  -0.924
   98    HB2  ASP  14          2HB       ASP  14  -5.413  -3.706  -2.987
   99    HB3  ASP  14          1HB       ASP  14  -6.391  -2.595  -3.928
  100    H    LYS  15           H        LYS  15  -6.924  -0.927  -0.331
  101    HA   LYS  15           HA       LYS  15  -8.794   0.668  -1.877
  102    HB2  LYS  15          2HB       LYS  15  -9.329  -0.697   0.405
  103    HB3  LYS  15          1HB       LYS  15  -8.992   0.927   1.022
  104    HG2  LYS  15          2HG       LYS  15 -11.065   0.112  -1.015
  105    HG3  LYS  15          1HG       LYS  15 -11.375   0.689   0.624
  106    HD2  LYS  15          2HD       LYS  15 -10.357   2.835   0.035
  107    HD3  LYS  15          1HD       LYS  15 -10.075   2.233  -1.589
  108    HE2  LYS  15          2HE       LYS  15 -12.100   3.626  -1.580
  109    HE3  LYS  15          1HE       LYS  15 -12.510   1.943  -1.897
  110    HZ1  LYS  15          1HZ       LYS  15 -14.034   2.938  -0.325
  111    HZ2  LYS  15          2HZ       LYS  15 -12.774   3.319   0.714
  112    HZ3  LYS  15          3HZ       LYS  15 -13.151   1.713   0.417
  113    H    CYS  16           H        CYS  16  -5.852   0.600  -1.540
  114    HA   CYS  16           HA       CYS  16  -5.229   2.901   0.087
  115    HB2  CYS  16          2HB       CYS  16  -3.494   1.101  -1.602
  116    HB3  CYS  16          1HB       CYS  16  -2.885   2.453  -0.649
  117    H    CYS  17           H        CYS  17  -3.726   4.546  -0.898
  118    HA   CYS  17           HA       CYS  17  -5.207   5.821  -2.988
  119    HB2  CYS  17          2HB       CYS  17  -2.664   6.670  -1.653
  120    HB3  CYS  17          1HB       CYS  17  -3.701   7.697  -2.606
  121    H    ARG  18           H        ARG  18  -4.581   4.026  -4.657
  122    HA   ARG  18           HA       ARG  18  -1.981   4.095  -5.693
  123    HB2  ARG  18          2HB       ARG  18  -4.562   3.254  -7.014
  124    HB3  ARG  18          1HB       ARG  18  -2.998   3.030  -7.762
  125    HG2  ARG  18          2HG       ARG  18  -3.235   0.953  -6.829
  126    HG3  ARG  18          1HG       ARG  18  -2.544   1.837  -5.454
  127    HD2  ARG  18          2HD       ARG  18  -4.475   0.463  -4.821
  128    HD3  ARG  18          1HD       ARG  18  -4.693   2.182  -4.499
  129    HE   ARG  18           HE       ARG  18  -5.741   1.826  -6.978
  130   HH11  ARG  18          1HH1      ARG  18  -6.314   0.197  -3.909
  131   HH12  ARG  18          2HH1      ARG  18  -7.988   0.014  -4.171
  132   HH21  ARG  18          1HH2      ARG  18  -7.978   1.571  -7.349
  133   HH22  ARG  18          2HH2      ARG  18  -8.970   0.825  -6.181
  134    HA   PRO  19           HA       PRO  19  -1.178   3.761  -7.857
  135    HB2  PRO  19          2HB       PRO  19   0.446   4.756  -9.651
  136    HB3  PRO  19          1HB       PRO  19  -1.278   4.466 -10.003
  137    HG2  PRO  19          2HG       PRO  19   0.087   7.055  -9.389
  138    HG3  PRO  19          1HG       PRO  19  -1.098   6.699 -10.657
  139    HD2  PRO  19          2HD       PRO  19  -1.680   7.793  -8.154
  140    HD3  PRO  19          1HD       PRO  19  -2.855   7.018  -9.234
  141    H    ASN  20           H        ASN  20  -0.658   6.598  -6.389
  142    HA   ASN  20           HA       ASN  20   2.115   6.847  -5.982
  143    HB2  ASN  20          2HB       ASN  20   0.080   7.429  -3.876
  144    HB3  ASN  20          1HB       ASN  20   1.611   8.207  -4.229
  145   HD21  ASN  20          1HD2      ASN  20  -1.073   9.012  -3.909
  146   HD22  ASN  20          2HD2      ASN  20  -1.480  10.035  -5.259
  147    H    LEU  21           H        LEU  21  -0.485   5.343  -3.998
  148    HA   LEU  21           HA       LEU  21   1.636   4.056  -2.619
  149    HB2  LEU  21          2HB       LEU  21  -1.165   4.271  -1.691
  150    HB3  LEU  21          1HB       LEU  21   0.225   3.822  -0.784
  151    HG   LEU  21           HG       LEU  21  -0.258   6.630  -1.787
  152   HD11  LEU  21          1HD1      LEU  21  -1.701   6.040   0.079
  153   HD12  LEU  21          2HD1      LEU  21  -0.482   7.222   0.550
  154   HD13  LEU  21          3HD1      LEU  21  -0.294   5.531   1.008
  155   HD21  LEU  21          1HD2      LEU  21   2.022   5.457  -0.196
  156   HD22  LEU  21          2HD2      LEU  21   1.731   7.179  -0.397
  157   HD23  LEU  21          3HD2      LEU  21   2.098   6.181  -1.802
  158    H    VAL  22           H        VAL  22   1.430   1.914  -2.465
  159    HA   VAL  22           HA       VAL  22  -0.740   0.444  -3.815
  160    HB   VAL  22           HB       VAL  22   2.142   0.032  -4.443
  161   HG11  VAL  22          1HG1      VAL  22   0.868  -2.022  -4.667
  162   HG12  VAL  22          2HG1      VAL  22   1.410  -1.468  -6.250
  163   HG13  VAL  22          3HG1      VAL  22  -0.263  -1.221  -5.763
  164   HG21  VAL  22          1HG2      VAL  22   1.483   2.107  -5.493
  165   HG22  VAL  22          2HG2      VAL  22   0.077   1.330  -6.220
  166   HG23  VAL  22          3HG2      VAL  22   1.701   0.879  -6.740
  167    H    CYS  23           H        CYS  23  -0.963  -1.635  -3.027
  168    HA   CYS  23           HA       CYS  23   0.195  -2.276  -0.521
  169    HB2  CYS  23          2HB       CYS  23  -2.011  -3.111  -1.164
  170    HB3  CYS  23          1HB       CYS  23  -1.264  -4.025  -2.481
  171    H    SER  24           H        SER  24   2.052  -3.008  -0.203
  172    HA   SER  24           HA       SER  24   3.656  -4.006  -2.401
  173    HB2  SER  24          2HB       SER  24   4.625  -2.218  -1.071
  174    HB3  SER  24          1HB       SER  24   4.376  -3.145   0.403
  175    HG   SER  24           HG       SER  24   6.517  -3.264  -0.323
  176    H    ARG  25           H        ARG  25   4.097  -6.064  -2.605
  177    HA   ARG  25           HA       ARG  25   3.143  -7.985  -0.674
  178    HB2  ARG  25          2HB       ARG  25   2.866  -8.491  -3.036
  179    HB3  ARG  25          1HB       ARG  25   4.581  -8.280  -3.326
  180    HG2  ARG  25          2HG       ARG  25   3.899 -10.632  -3.343
  181    HG3  ARG  25          1HG       ARG  25   5.078 -10.293  -2.077
  182    HD2  ARG  25          2HD       ARG  25   3.280 -10.233  -0.422
  183    HD3  ARG  25          1HD       ARG  25   2.097 -10.531  -1.695
  184    HE   ARG  25           HE       ARG  25   3.902 -12.568  -1.889
  185   HH11  ARG  25          1HH1      ARG  25   1.712 -11.448   0.669
  186   HH12  ARG  25          2HH1      ARG  25   1.550 -12.981   1.384
  187   HH21  ARG  25          1HH2      ARG  25   3.693 -14.626  -0.911
  188   HH22  ARG  25          2HH2      ARG  25   2.666 -14.869   0.435
  189    H    LYS  26           H        LYS  26   5.970  -6.276  -1.326
  190    HA   LYS  26           HA       LYS  26   7.838  -8.146  -0.193
  191    HB2  LYS  26          2HB       LYS  26   8.417  -6.419  -1.908
  192    HB3  LYS  26          1HB       LYS  26   8.116  -5.199  -0.701
  193    HG2  LYS  26          2HG       LYS  26   9.886  -6.033   0.705
  194    HG3  LYS  26          1HG       LYS  26  10.192  -7.346  -0.431
  195    HD2  LYS  26          2HD       LYS  26  10.812  -5.727  -2.144
  196    HD3  LYS  26          1HD       LYS  26  10.478  -4.405  -1.023
  197    HE2  LYS  26          2HE       LYS  26  12.225  -5.204   0.467
  198    HE3  LYS  26          1HE       LYS  26  12.539  -6.564  -0.606
  199    HZ1  LYS  26          1HZ       LYS  26  13.185  -5.036  -2.313
  200    HZ2  LYS  26          2HZ       LYS  26  14.110  -4.762  -0.921
  201    HZ3  LYS  26          3HZ       LYS  26  12.836  -3.722  -1.324
  202    H    ASP  27           H        ASP  27   6.521  -5.024   0.683
  203    HA   ASP  27           HA       ASP  27   7.539  -5.072   3.345
  204    HB2  ASP  27          2HB       ASP  27   5.600  -3.228   1.980
  205    HB3  ASP  27          1HB       ASP  27   6.323  -2.977   3.554
  206    H    LYS  28           H        LYS  28   4.406  -5.759   1.794
  207    HA   LYS  28           HA       LYS  28   2.544  -6.466   2.397
  208    HB2  LYS  28          2HB       LYS  28   3.773  -7.233   5.053
  209    HB3  LYS  28          1HB       LYS  28   2.137  -7.566   4.484
  210    HG2  LYS  28          2HG       LYS  28   3.287  -9.577   4.101
  211    HG3  LYS  28          1HG       LYS  28   3.182  -8.786   2.537
  212    HD2  LYS  28          2HD       LYS  28   5.376  -9.605   2.628
  213    HD3  LYS  28          1HD       LYS  28   5.527  -7.899   3.015
  214    HE2  LYS  28          2HE       LYS  28   5.521 -10.174   5.017
  215    HE3  LYS  28          1HE       LYS  28   6.941  -9.315   4.450
  216    HZ1  LYS  28          1HZ       LYS  28   6.346  -8.478   6.568
  217    HZ2  LYS  28          2HZ       LYS  28   4.751  -8.266   6.158
  218    HZ3  LYS  28          3HZ       LYS  28   5.925  -7.258   5.486
  219    H    TRP  29           H        TRP  29   3.217  -3.789   2.699
  220    HA   TRP  29           HA       TRP  29   0.770  -3.030   3.971
  221    HB2  TRP  29          2HB       TRP  29   1.724  -1.139   5.215
  222    HB3  TRP  29          1HB       TRP  29   2.449  -2.622   5.790
  223    HD1  TRP  29           HD       TRP  29   3.361   0.355   3.449
  224    HE1  TRP  29          1HE       TRP  29   5.873   0.822   3.666
  225    HE3  TRP  29          3HE       TRP  29   4.601  -3.492   6.576
  226    HZ2  TRP  29          2HZ       TRP  29   8.102  -0.298   5.024
  227    HZ3  TRP  29          3HZ       TRP  29   6.946  -3.712   7.293
  228    HH2  TRP  29           HH       TRP  29   8.654  -2.146   6.526
  229    H    CYS  30           H        CYS  30   0.163  -0.762   3.150
  230    HA   CYS  30           HA       CYS  30   0.989  -0.569   0.472
  231    HB2  CYS  30          2HB       CYS  30  -0.860   0.948   2.259
  232    HB3  CYS  30          1HB       CYS  30  -0.394   1.609   0.699
  233    H    LYS  31           H        LYS  31   2.534   0.559  -0.332
  234    HA   LYS  31           HA       LYS  31   4.108   2.269   1.492
  235    HB2  LYS  31          2HB       LYS  31   4.976  -0.149   0.591
  236    HB3  LYS  31          1HB       LYS  31   5.274   0.869  -0.815
  237    HG2  LYS  31          2HG       LYS  31   6.706   2.328   0.534
  238    HG3  LYS  31          1HG       LYS  31   6.489   1.194   1.882
  239    HD2  LYS  31          2HD       LYS  31   7.409  -0.602   0.448
  240    HD3  LYS  31          1HD       LYS  31   7.726   0.599  -0.802
  241    HE2  LYS  31          2HE       LYS  31   9.762   0.184   0.402
  242    HE3  LYS  31          1HE       LYS  31   9.197   1.802   0.817
  243    HZ1  LYS  31          1HZ       LYS  31   8.338   0.911   2.909
  244    HZ2  LYS  31          2HZ       LYS  31   9.962   0.544   2.771
  245    HZ3  LYS  31          3HZ       LYS  31   8.815  -0.645   2.470
  246    H    TYR  32           H        TYR  32   5.576   3.578  -0.058
  247    HA   TYR  32           HA       TYR  32   3.863   4.828  -2.084
  248    HB2  TYR  32          2HB       TYR  32   5.583   6.004  -0.342
  249    HB3  TYR  32          1HB       TYR  32   6.678   5.636  -1.627
  250    HD1  TYR  32          1HD       TYR  32   4.475   8.072  -0.445
  251    HD2  TYR  32          2HD       TYR  32   5.911   6.383  -4.072
  252    HE1  TYR  32          1HE       TYR  32   3.812  10.087  -1.639
  253    HE2  TYR  32          2HE       TYR  32   5.254   8.398  -5.282
  254    HH   TYR  32           HH       TYR  32   4.380  11.279  -3.698
  255    H    GLN  33           H        GLN  33   4.047   3.936  -4.059
  256    HA   GLN  33           HA       GLN  33   6.527   2.564  -4.579
  257    HB2  GLN  33          2HB       GLN  33   4.389   1.464  -5.170
  258    HB3  GLN  33          1HB       GLN  33   4.164   2.728  -6.395
  259    HG2  GLN  33          2HG       GLN  33   6.125   2.005  -7.589
  260    HG3  GLN  33          1HG       GLN  33   6.529   0.861  -6.316
  261   HE21  GLN  33          1HE2      GLN  33   6.158   0.397  -9.116
  262   HE22  GLN  33          2HE2      GLN  33   4.907  -0.770  -9.289
  263    H    ILE  34           H        ILE  34   7.447   4.456  -4.346
  264    HA   ILE  34           HA       ILE  34   7.620   6.606  -6.124
  265    HB   ILE  34           HB       ILE  34   9.984   5.239  -4.787
  266   HG12  ILE  34          2HG1      ILE  34   8.285   7.559  -3.828
  267   HG13  ILE  34          1HG1      ILE  34   8.222   5.922  -3.194
  268   HG21  ILE  34          1HG2      ILE  34   9.714   8.034  -5.901
  269   HG22  ILE  34          2HG2      ILE  34  10.708   6.738  -6.562
  270   HG23  ILE  34          3HG2      ILE  34  11.096   7.432  -4.987
  271   HD11  ILE  34          1HD1      ILE  34   9.476   7.400  -1.733
  272   HD12  ILE  34          2HD1      ILE  34  10.585   7.781  -3.050
  273   HD13  ILE  34          3HD1      ILE  34  10.518   6.143  -2.399