*HEADER    ANTIMICROBIAL PROTEIN                   13-JUN-19   6RZC              
*TITLE     WINTER FLOUNDER 4 IN SDS MICELLES                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PLEUROCIDIN-LIKE PEPTIDE WF4;                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: PSEUDOPLEURONECTES AMERICANUS;                  
*SOURCE   4 ORGANISM_COMMON: WINTER FLOUNDER;                                    
*SOURCE   5 ORGANISM_TAXID: 8265                                                 
*KEYWDS    WINTER FLOUNDER, AMP, ANTIMICROBIAL PEPTIDE, CATIONIC, ANTIMICROBIAL  
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    100                                                                   
*AUTHOR    A.J.MASON,M.CLARKE                                                    
*REVDAT   1   15-JUL-20 6RZC    0                                                
# Restraints file 1: WF4-noes.tab
VARS INDEX GROUP RESID_I RESNAME_I ATOMNAME_I SEGNAME_I RESID_J RESNAME_J ATOMNAME_J SEGNAME_J D_LO D_HI FC W S
FORMAT %4d %3d  %5d %6s %6s %4s  %5d %6s %6s %4s  %9.3f %9.3f %.2f %.2f %.2f

   1  1    7 LYS  HB1     A    9 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
   1  1    7 LYS  HB2     A    9 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
   2  1   21 VAL  HB      A   22 ASN   HN     A    0.000   3.300 100.0 1.0 1.0
   3  1   22 ASN  HB1     A   23 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   3  1   22 ASN  HB2     A   23 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   4  1   6  PHE  HB1     A   10 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
   4  2   6  PHE  HB2     A   10 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
   5  1   2  TRP  HB1     A    4 SER   HN     A    0.000   2.700 100.0 1.0 1.0
   5  2   2  TRP  HB2     A    4 SER   HN     A    0.000   2.700 100.0 1.0 1.0
   6  1   24 TYR  HB1     A   25 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
   6  2   24 TYR  HB2     A   25 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
   8  1   16 ILE  HA      A   20 ALA   HN     A    0.000   2.700 100.0 1.0 1.0
   9  1    1 GLY  HA1     A    2 TRP   HB1    A    0.000   5.000 100.0 1.0 1.0
   9  1    1 GLY  HA2     A    2 TRP   HB1    A    0.000   5.000 100.0 1.0 1.0
   9  2    1 GLY  HA1     A    2 TRP   HB2    A    0.000   5.000 100.0 1.0 1.0
   9  2    1 GLY  HA2     A    2 TRP   HB2    A    0.000   5.000 100.0 1.0 1.0   
   10 1   11 HIS  HA      A   13 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   11 1   11 HIS  HA      A   14 LYS   HN     A    0.000   3.300 100.0 1.0 1.0
   12 1    6 PHE  HB1     A   7  LYS   HN     A    0.000   5.000 100.0 1.0 1.0
   12 2    6 PHE  HB2     A   7  LYS   HN     A    0.000   5.000 100.0 1.0 1.0
   13 1   24 TYR  HB1     A   25 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
   13 2   24 TYR  HB2     A   25 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
   14 1   18 HIS  HB1     A   19 ALA   HN     A    0.000   3.300 100.0 1.0 1.0
   14 1   18 HIS  HB2     A   19 ALA   HN     A    0.000   3.300 100.0 1.0 1.0
   15 1   21 VAL  HA      A   22 ASN   HN     A    0.000   5.000 100.0 1.0 1.0
   16 1   16 ILE  HA      A   17 GLY   HN     A    0.000   3.300 100.0 1.0 1.0
   17 1    4 SER  HB1     A    8 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   17 2    4 SER  HB2     A    8 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   18 1   16 ILE  HA      A   19 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   19 1   16 ILE  HA      A   18 HIS   HN     A    0.000   3.300 100.0 1.0 1.0
   20 1    4 SER  HB1     A    5 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   20 2    4 SER  HB2     A    5 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   21 1    4 SER  HA      A    5 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   47 1    4 SER  HB1     A    5 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   47 2    4 SER  HB2     A    5 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   22 1   23 HIS  HA      A   24 TYR   HN     A    0.000   5.000 100.0 1.0 1.0
   23 1   23 HIS  HA      A   25 LEU   HN     A    0.000   3.300 100.0 1.0 1.0
   25 1    2 TRP  HA      A    4 SER   HN     A    0.000   5.000 100.0 1.0 1.0
   26 1   11 HIS  HA      A   12 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   27 1    8 HIS  HA      A    9 GLY   HN     A    0.000   3.300 100.0 1.0 1.0
   28 1   12 ALA  HA      A   16 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   29 1    1 GLY  HN      A    4 SER   HN     A    0.000   5.000 100.0 1.0 1.0
   30 1   16 ILE  HN      A   19 ALA   HN     A    0.000   2.700 100.0 1.0 1.0
   31 1   10 ARG  HN      A   13 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   32 1    6 PHE  HN      A    8 HIS   HN     A    0.000   5.000 100.0 1.0 1.0
   33 1    3 GLY  HN      A    4 SER   HN     A    0.000   2.700 100.0 1.0 1.0
   34 1   11 HIS  HN      A   14 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
   35 1   17 GLY  HN      A   19 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   36 1   23 HIS  HN      A   25 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
   37 1   18 HIS  HN      A   22 ASN   HN     A    0.000   5.000 100.0 1.0 1.0
   43 1    4 SER  HN      A    5 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   44 1   24 TYR  HN      A   25 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
   45 1    2 TRP  HN      A    3 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
   49 1   16 ILE  HG21    A   19 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   49 1   16 ILE  HG23    A   19 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   49 1   16 ILE  HG22    A   19 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   50 1   21 VAL  HG11    A   23 HIS   HN     A    0.000   5.000 100.0 1.0 1.0
   50 1   21 VAL  HG12    A   23 HIS   HN     A    0.000   5.000 100.0 1.0 1.0
   50 1   21 VAL  HG13    A   23 HIS   HN     A    0.000   5.000 100.0 1.0 1.0
   51 1   12 ALA  HB1     A   14 LYS   HN     A    0.000   2.700 100.0 1.0 1.0
   51 1   12 ALA  HB2     A   14 LYS   HN     A    0.000   2.700 100.0 1.0 1.0
   51 1   12 ALA  HB3     A   14 LYS   HN     A    0.000   2.700 100.0 1.0 1.0
   52 1   12 ALA  HB1     A   13 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   52 1   12 ALA  HB2     A   13 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   52 1   12 ALA  HB3     A   13 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   53 1   19 ALA  HB1     A   23 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   53 1   19 ALA  HB2     A   23 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   53 1   19 ALA  HB3     A   23 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   54 1   19 ALA  HB1     A   21 VAL   HN     A    0.000   2.700 100.0 1.0 1.0
   54 1   19 ALA  HB2     A   21 VAL   HN     A    0.000   2.700 100.0 1.0 1.0
   54 1   19 ALA  HB3     A   21 VAL   HN     A    0.000   2.700 100.0 1.0 1.0
   55 1   16 ILE  HB      A   19 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
   56 1   14 LYS  HB1     A   18 HIS   HN     A    0.000   5.000 100.0 1.0 1.0
   56 1   14 LYS  HB2     A   18 HIS   HN     A    0.000   5.000 100.0 1.0 1.0
   57 1   14 LYS  HB1     A   17 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
   57 1   14 LYS  HB2     A   17 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
   58 1   14 LYS  HB1     A   15 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   58 1   14 LYS  HB2     A   15 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   59 1   14 LYS  HB1     A   16 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   59 1   14 LYS  HB2     A   16 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   60 1   15 HIS  HB1     A   16 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   60 1   15 HIS  HB2     A   16 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   61 1    5 ILE  HA      A    7 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
    7 1   14 LYS  HA      A   18 HIS   HN     A    0.000   2.700 100.0 1.0 1.0
   38 1   10 ARG  HA      A   11 HIS   HN     A    0.000   3.300 100.0 1.0 1.0
   39 1    7 LYS  HA      A   11 HIS   HN     A    0.000   5.000 100.0 1.0 1.0
   40 1   11 HIS  HA      A   14 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
   41 1   12 ALA  HA      A   16 ILE   HG21   A    0.000   2.700 100.0 1.0 1.0
   41 1   12 ALA  HA      A   16 ILE   HG22   A    0.000   2.700 100.0 1.0 1.0
   41 1   12 ALA  HA      A   16 ILE   HG23   A    0.000   2.700 100.0 1.0 1.0
   42 1   10 ARG  HA      A   14 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
   42 1   10 ARG  HA      A   14 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
   46 1   12 ALA  HA      A   14 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
   46 1   12 ALA  HA      A   14 LYS   HB2    A    0.000   2.700 100.0 1.0 1.0
   24 1   16 ILE  HA      A   18 HIS   HB1    A    0.000   5.000 100.0 1.0 1.0
   24 2   16 ILE  HA      A   18 HIS   HB2    A    0.000   5.000 100.0 1.0 1.0
   48 1   6  PHE  HB1     A   10 ARG   HD1    A    0.000   2.700 100.0 1.0 1.0
   48 1   6  PHE  HB2     A   10 ARG   HD1    A    0.000   2.700 100.0 1.0 1.0
   48 2   6  PHE  HB1     A   10 ARG   HD2    A    0.000   2.700 100.0 1.0 1.0
   48 2   6  PHE  HB2     A   10 ARG   HD2    A    0.000   2.700 100.0 1.0 1.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1  65.840  22.763   2.433
    2    H2   GLY   1           HT2      GLY   1  66.139  21.883   1.010
    3    H3   GLY   1           HT3      GLY   1  67.433  22.390   1.988
    4    HA2  GLY   1           HA1      GLY   1  67.380  20.477   2.985
    5    HA3  GLY   1           HA2      GLY   1  65.819  20.986   3.660
    6    H    TRP   2           HN       TRP   2  64.123  19.741   3.267
    7    HA   TRP   2           HA       TRP   2  64.399  17.434   1.521
    8    HB2  TRP   2           HB2      TRP   2  62.009  18.612   2.991
    9    HB3  TRP   2           HB1      TRP   2  61.987  17.061   2.119
   10    HD1  TRP   2           HD1      TRP   2  63.157  18.692   5.316
   11    HE1  TRP   2           HE1      TRP   2  64.221  16.922   6.896
   12    HE3  TRP   2           HE3      TRP   2  63.391  14.743   2.064
   13    HZ2  TRP   2           HZ2      TRP   2  65.051  14.168   6.738
   14    HZ3  TRP   2           HZ3      TRP   2  64.323  12.554   2.800
   15    HH2  TRP   2           HH2      TRP   2  65.153  12.264   5.132
   16    H    GLY   3           HN       GLY   3  64.473  17.694  -0.622
   17    HA2  GLY   3           HA1      GLY   3  62.962  19.835  -1.945
   18    HA3  GLY   3           HA2      GLY   3  64.004  18.624  -2.716
   19    H    SER   4           HN       SER   4  61.816  17.222  -0.539
   20    HA   SER   4           HA       SER   4  60.521  15.605  -2.411
   21    HB2  SER   4           HB2      SER   4  58.709  15.376  -0.679
   22    HB3  SER   4           HB1      SER   4  60.354  15.162  -0.039
   23    HG   SER   4           HG       SER   4  59.188  16.565   1.288
   24    H    ILE   5           HN       ILE   5  59.503  16.232  -4.202
   25    HA   ILE   5           HA       ILE   5  58.065  18.770  -4.347
   26    HB   ILE   5           HB       ILE   5  57.296  17.768  -6.622
   27   HG12  ILE   5          HG12      ILE   5  59.468  15.730  -5.939
   28   HG13  ILE   5          HG11      ILE   5  57.734  15.374  -5.802
   29   HG21  ILE   5          HG21      ILE   5  60.299  17.941  -6.103
   30   HG22  ILE   5          HG22      ILE   5  59.230  19.351  -6.294
   31   HG23  ILE   5          HG23      ILE   5  59.464  18.224  -7.648
   32   HD11  ILE   5           HD1      ILE   5  59.355  15.972  -8.298
   33   HD12  ILE   5           HD2      ILE   5  57.586  16.172  -8.288
   34   HD13  ILE   5           HD3      ILE   5  58.305  14.580  -7.960
   35    H    PHE   6           HN       PHE   6  56.737  18.207  -2.387
   36    HA   PHE   6           HA       PHE   6  54.685  17.641  -1.476
   37    HB2  PHE   6           HB2      PHE   6  53.784  17.533  -4.382
   38    HB3  PHE   6           HB1      PHE   6  52.739  17.714  -2.954
   39    HD1  PHE   6           HD1      PHE   6  55.181  19.378  -5.172
   40    HD2  PHE   6           HD2      PHE   6  52.738  19.800  -1.639
   41    HE1  PHE   6           HE1      PHE   6  55.535  21.843  -5.222
   42    HE2  PHE   6           HE2      PHE   6  53.091  22.266  -1.689
   43    HZ   PHE   6           HZ       PHE   6  54.432  23.293  -3.521
   44    H    LYS   7           HN       LYS   7  56.580  15.518  -2.989
   45    HA   LYS   7           HA       LYS   7  54.857  13.281  -3.515
   46    HB2  LYS   7           HB2      LYS   7  57.317  13.585  -4.185
   47    HB3  LYS   7           HB1      LYS   7  57.724  13.131  -2.516
   48    HG2  LYS   7           HG2      LYS   7  57.812  11.034  -3.559
   49    HG3  LYS   7           HG1      LYS   7  56.125  11.048  -3.004
   50    HD2  LYS   7           HD2      LYS   7  55.374  11.783  -5.237
   51    HD3  LYS   7           HD1      LYS   7  57.061  11.873  -5.795
   52    HE2  LYS   7           HE2      LYS   7  55.911   9.749  -6.481
   53    HE3  LYS   7           HE1      LYS   7  57.345   9.468  -5.464
   54    HZ1  LYS   7           HZ1      LYS   7  54.660   9.726  -4.252
   55    HZ2  LYS   7           HZ2      LYS   7  56.045   8.959  -3.635
   56    HZ3  LYS   7           HZ3      LYS   7  55.169   8.247  -4.904
   57    H    HIS   8           HN       HIS   8  57.089  13.773  -0.738
   58    HA   HIS   8           HA       HIS   8  55.457  11.884   0.880
   59    HB2  HIS   8           HB2      HIS   8  58.053  13.374   1.441
   60    HB3  HIS   8           HB1      HIS   8  57.279  12.223   2.557
   61    HD1  HIS   8           HD1      HIS   8  59.997  12.203   0.398
   62    HD2  HIS   8           HD2      HIS   8  56.632   9.701   0.708
   63    HE1  HIS   8           HE1      HIS   8  60.578   9.999  -0.760
   64    H    GLY   9           HN       GLY   9  53.881  14.003   0.299
   65    HA2  GLY   9           HA1      GLY   9  53.258  15.020   2.920
   66    HA3  GLY   9           HA2      GLY   9  54.030  16.281   1.940
   67    H    ARG  10           HN       ARG  10  52.294  13.929   0.146
   68    HA   ARG  10           HA       ARG  10  49.661  15.095   0.336
   69    HB2  ARG  10           HB2      ARG  10  51.056  16.935  -0.834
   70    HB3  ARG  10           HB1      ARG  10  51.138  15.827  -2.222
   71    HG2  ARG  10           HG2      ARG  10  48.700  15.790  -2.400
   72    HG3  ARG  10           HG1      ARG  10  48.538  16.748  -0.909
   73    HD2  ARG  10           HD2      ARG  10  49.542  18.678  -1.940
   74    HD3  ARG  10           HD1      ARG  10  50.044  17.735  -3.363
   75    HE   ARG  10           HE       ARG  10  47.259  17.469  -3.262
   76   HH11  ARG  10          HH11      ARG  10  48.162  18.647  -5.668
   77   HH12  ARG  10          HH12      ARG  10  47.748  20.324  -5.544
   78   HH21  ARG  10          HH21      ARG  10  47.322  20.236  -2.102
   79   HH22  ARG  10          HH22      ARG  10  47.272  21.225  -3.524
   80    H    HIS  11           HN       HIS  11  51.876  12.813  -0.549
   81    HA   HIS  11           HA       HIS  11  49.775  11.126  -1.734
   82    HB2  HIS  11           HB2      HIS  11  50.808  12.393  -3.698
   83    HB3  HIS  11           HB1      HIS  11  52.342  11.580  -3.307
   84    HD1  HIS  11           HD1      HIS  11  48.903  10.992  -4.733
   85    HD2  HIS  11           HD2      HIS  11  52.397   8.802  -3.924
   86    HE1  HIS  11           HE1      HIS  11  48.638   8.703  -5.832
   87    H    ALA  12           HN       ALA  12  50.048   9.094  -1.596
   88    HA   ALA  12           HA       ALA  12  50.795   7.070  -0.846
   89    HB1  ALA  12           HB1      ALA  12  52.983   7.945  -1.787
   90    HB2  ALA  12           HB2      ALA  12  53.086   6.741  -0.479
   91    HB3  ALA  12           HB3      ALA  12  53.248   8.463  -0.131
   92    H    ALA  13           HN       ALA  13  51.662  10.047   0.833
   93    HA   ALA  13           HA       ALA  13  51.558   8.830   3.493
   94    HB1  ALA  13           HB1      ALA  13  51.062  11.630   2.346
   95    HB2  ALA  13           HB2      ALA  13  52.340  11.134   3.482
   96    HB3  ALA  13           HB3      ALA  13  50.649  11.231   4.030
   97    H    LYS  14           HN       LYS  14  50.333   8.796   0.552
   98    HA   LYS  14           HA       LYS  14  47.343   8.486   1.421
   99    HB2  LYS  14           HB2      LYS  14  48.221  10.185  -0.369
  100    HB3  LYS  14           HB1      LYS  14  48.622   8.711  -1.327
  101    HG2  LYS  14           HG2      LYS  14  46.392   8.360  -1.889
  102    HG3  LYS  14           HG1      LYS  14  45.789   8.817  -0.281
  103    HD2  LYS  14           HD2      LYS  14  45.976  11.184  -0.825
  104    HD3  LYS  14           HD1      LYS  14  46.774  10.806  -2.371
  105    HE2  LYS  14           HE2      LYS  14  44.732   9.600  -3.119
  106    HE3  LYS  14           HE1      LYS  14  43.933  10.018  -1.584
  107    HZ1  LYS  14           HZ1      LYS  14  43.248  11.784  -2.776
  108    HZ2  LYS  14           HZ2      LYS  14  44.523  11.687  -3.897
  109    HZ3  LYS  14           HZ3      LYS  14  44.773  12.416  -2.382
  110    H    HIS  15           HN       HIS  15  46.403   7.145  -0.638
  111    HA   HIS  15           HA       HIS  15  45.951   4.880  -1.083
  112    HB2  HIS  15           HB2      HIS  15  48.691   5.372  -2.305
  113    HB3  HIS  15           HB1      HIS  15  47.601   4.036  -2.749
  114    HD1  HIS  15           HD1      HIS  15  44.970   5.960  -2.371
  115    HD2  HIS  15           HD2      HIS  15  48.267   6.542  -4.915
  116    HE1  HIS  15           HE1      HIS  15  44.222   7.535  -4.238
  117    H    ILE  16           HN       ILE  16  47.516   5.377   1.469
  118    HA   ILE  16           HA       ILE  16  47.733   2.878   2.365
  119    HB   ILE  16           HB       ILE  16  49.513   2.138   0.969
  120   HG12  ILE  16          HG12      ILE  16  51.197   3.087   3.308
  121   HG13  ILE  16          HG11      ILE  16  49.843   1.988   3.628
  122   HG21  ILE  16          HG21      ILE  16  50.239   4.268  -0.024
  123   HG22  ILE  16          HG22      ILE  16  51.651   3.538   0.760
  124   HG23  ILE  16          HG23      ILE  16  50.783   4.847   1.560
  125   HD11  ILE  16           HD1      ILE  16  50.771   0.391   1.934
  126   HD12  ILE  16           HD2      ILE  16  51.885   0.685   3.290
  127   HD13  ILE  16           HD3      ILE  16  52.170   1.471   1.721
  128    H    GLY  17           HN       GLY  17  49.374   5.756   2.303
  129    HA2  GLY  17           HA1      GLY  17  49.696   5.860   5.216
  130    HA3  GLY  17           HA2      GLY  17  49.953   7.202   4.082
  131    H    HIS  18           HN       HIS  18  47.322   6.140   2.782
  132    HA   HIS  18           HA       HIS  18  45.535   7.900   4.421
  133    HB2  HIS  18           HB2      HIS  18  45.634   6.900   1.620
  134    HB3  HIS  18           HB1      HIS  18  44.000   6.853   2.308
  135    HD1  HIS  18           HD1      HIS  18  43.246   8.803   0.733
  136    HD2  HIS  18           HD2      HIS  18  46.395   9.823   3.325
  137    HE1  HIS  18           HE1      HIS  18  43.434  11.351   0.739
  138    H    ALA  19           HN       ALA  19  45.722   4.456   3.266
  139    HA   ALA  19           HA       ALA  19  44.413   3.589   5.729
  140    HB1  ALA  19           HB1      ALA  19  42.277   2.913   4.896
  141    HB2  ALA  19           HB2      ALA  19  42.722   3.350   3.227
  142    HB3  ALA  19           HB3      ALA  19  42.493   4.621   4.452
  143    H    ALA  20           HN       ALA  20  46.767   2.819   4.174
  144    HA   ALA  20           HA       ALA  20  47.803   0.847   3.503
  145    HB1  ALA  20           HB1      ALA  20  46.647   0.106   5.661
  146    HB2  ALA  20           HB2      ALA  20  47.112  -1.175   4.516
  147    HB3  ALA  20           HB3      ALA  20  45.417  -0.644   4.618
  148    H    VAL  21           HN       VAL  21  44.867   1.867   2.228
  149    HA   VAL  21           HA       VAL  21  45.281   0.189  -0.183
  150    HB   VAL  21           HB       VAL  21  42.579   0.272   1.245
  151   HG11  VAL  21          HG11      VAL  21  41.999  -1.404  -0.569
  152   HG12  VAL  21          HG12      VAL  21  43.555  -1.017  -1.341
  153   HG13  VAL  21          HG13      VAL  21  42.308   0.241  -1.170
  154   HG21  VAL  21          HG21      VAL  21  42.984  -2.246   1.391
  155   HG22  VAL  21          HG22      VAL  21  44.026  -1.259   2.439
  156   HG23  VAL  21          HG23      VAL  21  44.669  -1.926   0.919
  157    H    ASN  22           HN       ASN  22  43.790   2.811   1.580
  158    HA   ASN  22           HA       ASN  22  44.007   5.016   0.265
  159    HB2  ASN  22           HB2      ASN  22  43.708   4.206  -1.995
  160    HB3  ASN  22           HB1      ASN  22  42.153   3.441  -1.578
  161   HD21  ASN  22          HD21      ASN  22  41.244   4.819  -3.389
  162   HD22  ASN  22          HD22      ASN  22  40.858   6.507  -3.037
  163    H    HIS  23           HN       HIS  23  41.352   2.760   0.955
  164    HA   HIS  23           HA       HIS  23  40.186   4.760   2.811
  165    HB2  HIS  23           HB2      HIS  23  38.564   3.592   0.510
  166    HB3  HIS  23           HB1      HIS  23  37.947   4.638   1.812
  167    HD1  HIS  23           HD1      HIS  23  39.673   6.961   2.033
  168    HD2  HIS  23           HD2      HIS  23  39.145   5.113  -1.707
  169    HE1  HIS  23           HE1      HIS  23  40.245   8.690   0.242
  170    H    TYR  24           HN       TYR  24  37.651   2.889   2.269
  171    HA   TYR  24           HA       TYR  24  36.748   1.086   3.412
  172    HB2  TYR  24           HB2      TYR  24  38.371  -0.086   1.845
  173    HB3  TYR  24           HB1      TYR  24  39.524  -0.141   3.199
  174    HD1  TYR  24           HD1      TYR  24  36.049  -1.127   2.175
  175    HD2  TYR  24           HD2      TYR  24  39.333  -1.822   4.889
  176    HE1  TYR  24           HE1      TYR  24  34.891  -3.146   3.060
  177    HE2  TYR  24           HE2      TYR  24  38.175  -3.842   5.773
  178    HH   TYR  24           HH       TYR  24  35.674  -4.457   6.008
  179    H    LEU  25           HN       LEU  25  38.597   3.224   4.786
  180    HA   LEU  25           HA       LEU  25  39.299   3.677   6.941
  181    HB2  LEU  25           HB2      LEU  25  36.967   3.369   7.493
  182    HB3  LEU  25           HB1      LEU  25  37.139   1.601   7.482
  183    HG   LEU  25           HG       LEU  25  38.519   1.647   9.478
  184   HD11  LEU  25          HD11      LEU  25  38.525   4.654   9.006
  185   HD12  LEU  25          HD12      LEU  25  39.915   3.559   9.209
  186   HD13  LEU  25          HD13      LEU  25  38.890   3.963  10.605
  187   HD21  LEU  25          HD21      LEU  25  36.934   2.575  11.090
  188   HD22  LEU  25          HD22      LEU  25  36.027   1.860   9.734
  189   HD23  LEU  25          HD23      LEU  25  36.225   3.626   9.840
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1  69.403  18.776  -5.437
    2    H2   GLY   1           HT2      GLY   1  68.224  17.815  -4.679
    3    H3   GLY   1           HT3      GLY   1  68.032  19.502  -4.756
    4    HA2  GLY   1           HA1      GLY   1  67.469  19.518  -6.919
    5    HA3  GLY   1           HA2      GLY   1  68.324  17.994  -7.226
    6    H    TRP   2           HN       TRP   2  65.423  19.485  -5.864
    7    HA   TRP   2           HA       TRP   2  63.868  17.086  -6.584
    8    HB2  TRP   2           HB2      TRP   2  64.102  17.989  -3.684
    9    HB3  TRP   2           HB1      TRP   2  62.912  16.817  -4.300
   10    HD1  TRP   2           HD1      TRP   2  64.140  14.678  -5.717
   11    HE1  TRP   2           HE1      TRP   2  66.206  13.275  -4.995
   12    HE3  TRP   2           HE3      TRP   2  66.199  17.947  -2.359
   13    HZ2  TRP   2           HZ2      TRP   2  68.437  13.564  -3.195
   14    HZ3  TRP   2           HZ3      TRP   2  68.296  17.362  -1.150
   15    HH2  TRP   2           HH2      TRP   2  69.416  15.176  -1.564
   16    H    GLY   3           HN       GLY   3  63.677  19.978  -4.446
   17    HA2  GLY   3           HA1      GLY   3  62.205  21.760  -4.485
   18    HA3  GLY   3           HA2      GLY   3  61.936  21.414  -6.205
   19    H    SER   4           HN       SER   4  61.346  18.753  -4.133
   20    HA   SER   4           HA       SER   4  58.645  18.463  -4.880
   21    HB2  SER   4           HB2      SER   4  58.489  16.810  -3.147
   22    HB3  SER   4           HB1      SER   4  60.154  16.747  -3.767
   23    HG   SER   4           HG       SER   4  60.765  17.204  -1.816
   24    H    ILE   5           HN       ILE   5  57.083  19.927  -4.622
   25    HA   ILE   5           HA       ILE   5  57.092  21.818  -2.413
   26    HB   ILE   5           HB       ILE   5  54.702  21.155  -4.183
   27   HG12  ILE   5          HG12      ILE   5  57.121  22.917  -4.793
   28   HG13  ILE   5          HG11      ILE   5  56.657  21.429  -5.649
   29   HG21  ILE   5          HG21      ILE   5  55.630  23.841  -3.089
   30   HG22  ILE   5          HG22      ILE   5  54.580  22.754  -2.152
   31   HG23  ILE   5          HG23      ILE   5  54.024  23.396  -3.714
   32   HD11  ILE   5           HD1      ILE   5  54.397  22.618  -6.116
   33   HD12  ILE   5           HD2      ILE   5  55.823  23.186  -7.017
   34   HD13  ILE   5           HD3      ILE   5  55.231  24.110  -5.618
   35    H    PHE   6           HN       PHE   6  55.311  18.834  -3.209
   36    HA   PHE   6           HA       PHE   6  54.766  18.382  -0.356
   37    HB2  PHE   6           HB2      PHE   6  52.511  18.991  -2.309
   38    HB3  PHE   6           HB1      PHE   6  52.269  18.142  -0.765
   39    HD1  PHE   6           HD1      PHE   6  53.425  19.331   1.345
   40    HD2  PHE   6           HD2      PHE   6  52.279  21.346  -2.300
   41    HE1  PHE   6           HE1      PHE   6  53.366  21.503   2.561
   42    HE2  PHE   6           HE2      PHE   6  52.220  23.516  -1.079
   43    HZ   PHE   6           HZ       PHE   6  52.830  23.604   1.334
   44    H    LYS   7           HN       LYS   7  55.145  17.463  -3.605
   45    HA   LYS   7           HA       LYS   7  53.842  14.984  -3.802
   46    HB2  LYS   7           HB2      LYS   7  55.187  16.107  -5.599
   47    HB3  LYS   7           HB1      LYS   7  56.667  15.594  -4.755
   48    HG2  LYS   7           HG2      LYS   7  56.055  13.243  -5.001
   49    HG3  LYS   7           HG1      LYS   7  54.484  13.691  -5.710
   50    HD2  LYS   7           HD2      LYS   7  55.621  14.749  -7.620
   51    HD3  LYS   7           HD1      LYS   7  57.207  14.374  -6.904
   52    HE2  LYS   7           HE2      LYS   7  55.104  12.325  -7.734
   53    HE3  LYS   7           HE1      LYS   7  56.595  12.705  -8.631
   54    HZ1  LYS   7           HZ1      LYS   7  57.630  11.231  -7.362
   55    HZ2  LYS   7           HZ2      LYS   7  56.241  10.978  -6.416
   56    HZ3  LYS   7           HZ3      LYS   7  57.341  12.205  -6.004
   57    H    HIS   8           HN       HIS   8  56.447  15.943  -1.726
   58    HA   HIS   8           HA       HIS   8  57.516  13.280  -1.262
   59    HB2  HIS   8           HB2      HIS   8  58.740  15.444  -0.831
   60    HB3  HIS   8           HB1      HIS   8  57.657  15.717   0.555
   61    HD1  HIS   8           HD1      HIS   8  58.394  14.747   2.734
   62    HD2  HIS   8           HD2      HIS   8  60.250  12.880  -0.544
   63    HE1  HIS   8           HE1      HIS   8  60.048  13.038   3.667
   64    H    GLY   9           HN       GLY   9  54.493  14.197  -0.826
   65    HA2  GLY   9           HA1      GLY   9  53.891  12.191   1.106
   66    HA3  GLY   9           HA2      GLY   9  53.905  13.765   1.924
   67    H    ARG  10           HN       ARG  10  53.028  13.467  -1.458
   68    HA   ARG  10           HA       ARG  10  50.213  14.248  -0.736
   69    HB2  ARG  10           HB2      ARG  10  51.789  15.654  -2.302
   70    HB3  ARG  10           HB1      ARG  10  51.448  14.397  -3.508
   71    HG2  ARG  10           HG2      ARG  10  49.677  15.824  -4.005
   72    HG3  ARG  10           HG1      ARG  10  48.889  14.882  -2.721
   73    HD2  ARG  10           HD2      ARG  10  50.021  17.688  -2.618
   74    HD3  ARG  10           HD1      ARG  10  48.463  17.078  -2.009
   75    HE   ARG  10           HE       ARG  10  50.799  15.969  -0.617
   76   HH11  ARG  10          HH11      ARG  10  47.874  17.587  -0.350
   77   HH12  ARG  10          HH12      ARG  10  48.287  18.464   1.086
   78   HH21  ARG  10          HH21      ARG  10  51.617  17.503   1.036
   79   HH22  ARG  10          HH22      ARG  10  50.405  18.417   1.869
   80    H    HIS  11           HN       HIS  11  52.001  11.567  -1.433
   81    HA   HIS  11           HA       HIS  11  49.585  10.079  -2.228
   82    HB2  HIS  11           HB2      HIS  11  50.774   8.970  -4.152
   83    HB3  HIS  11           HB1      HIS  11  50.390  10.682  -4.446
   84    HD1  HIS  11           HD1      HIS  11  53.314   8.555  -3.130
   85    HD2  HIS  11           HD2      HIS  11  52.607  12.184  -5.136
   86    HE1  HIS  11           HE1      HIS  11  55.589   9.525  -3.775
   87    H    ALA  12           HN       ALA  12  49.577   8.063  -1.825
   88    HA   ALA  12           HA       ALA  12  50.061   6.079  -0.813
   89    HB1  ALA  12           HB1      ALA  12  52.297   5.459  -0.487
   90    HB2  ALA  12           HB2      ALA  12  52.727   7.166  -0.394
   91    HB3  ALA  12           HB3      ALA  12  52.289   6.463  -1.953
   92    H    ALA  13           HN       ALA  13  51.433   9.102   0.388
   93    HA   ALA  13           HA       ALA  13  51.300   8.276   3.198
   94    HB1  ALA  13           HB1      ALA  13  50.848  10.805   3.488
   95    HB2  ALA  13           HB2      ALA  13  51.062  10.966   1.728
   96    HB3  ALA  13           HB3      ALA  13  52.419  10.426   2.745
   97    H    LYS  14           HN       LYS  14  49.931   8.018   0.340
   98    HA   LYS  14           HA       LYS  14  46.978   8.268   1.344
   99    HB2  LYS  14           HB2      LYS  14  47.985   9.584  -0.684
  100    HB3  LYS  14           HB1      LYS  14  48.134   7.958  -1.450
  101    HG2  LYS  14           HG2      LYS  14  45.854   7.867  -1.901
  102    HG3  LYS  14           HG1      LYS  14  45.396   8.570  -0.334
  103    HD2  LYS  14           HD2      LYS  14  46.029  10.830  -1.197
  104    HD3  LYS  14           HD1      LYS  14  46.401  10.097  -2.776
  105    HE2  LYS  14           HE2      LYS  14  43.695  10.069  -1.368
  106    HE3  LYS  14           HE1      LYS  14  44.125  11.028  -2.805
  107    HZ1  LYS  14           HZ1      LYS  14  43.382   9.273  -3.940
  108    HZ2  LYS  14           HZ2      LYS  14  43.424   8.241  -2.592
  109    HZ3  LYS  14           HZ3      LYS  14  44.831   8.506  -3.506
  110    H    HIS  15           HN       HIS  15  45.766   6.798  -0.514
  111    HA   HIS  15           HA       HIS  15  45.022   4.578  -0.662
  112    HB2  HIS  15           HB2      HIS  15  47.798   4.355  -1.875
  113    HB3  HIS  15           HB1      HIS  15  46.379   3.351  -2.259
  114    HD1  HIS  15           HD1      HIS  15  44.137   5.051  -2.885
  115    HD2  HIS  15           HD2      HIS  15  48.035   6.411  -3.690
  116    HE1  HIS  15           HE1      HIS  15  43.954   6.883  -4.656
  117    H    ILE  16           HN       ILE  16  46.736   5.217   1.794
  118    HA   ILE  16           HA       ILE  16  46.610   2.855   3.042
  119    HB   ILE  16           HB       ILE  16  48.225   1.691   1.742
  120   HG12  ILE  16          HG12      ILE  16  50.091   2.716   3.906
  121   HG13  ILE  16          HG11      ILE  16  48.621   1.851   4.386
  122   HG21  ILE  16          HG21      ILE  16  49.864   4.254   1.930
  123   HG22  ILE  16          HG22      ILE  16  49.202   3.542   0.448
  124   HG23  ILE  16          HG23      ILE  16  50.527   2.742   1.312
  125   HD11  ILE  16           HD1      ILE  16  50.445   0.249   4.213
  126   HD12  ILE  16           HD2      ILE  16  50.836   0.800   2.570
  127   HD13  ILE  16           HD3      ILE  16  49.306  -0.054   2.882
  128    H    GLY  17           HN       GLY  17  48.588   5.466   2.545
  129    HA2  GLY  17           HA1      GLY  17  49.035   5.918   5.413
  130    HA3  GLY  17           HA2      GLY  17  49.438   7.037   4.095
  131    H    HIS  18           HN       HIS  18  46.616   6.168   3.023
  132    HA   HIS  18           HA       HIS  18  45.162   8.373   4.468
  133    HB2  HIS  18           HB2      HIS  18  45.014   7.079   1.779
  134    HB3  HIS  18           HB1      HIS  18  43.430   7.439   2.491
  135    HD1  HIS  18           HD1      HIS  18  43.038   9.321   0.704
  136    HD2  HIS  18           HD2      HIS  18  46.370   9.964   3.188
  137    HE1  HIS  18           HE1      HIS  18  43.728  11.766   0.436
  138    H    ALA  19           HN       ALA  19  44.867   4.837   3.707
  139    HA   ALA  19           HA       ALA  19  43.416   4.439   6.211
  140    HB1  ALA  19           HB1      ALA  19  41.742   4.098   3.711
  141    HB2  ALA  19           HB2      ALA  19  41.685   5.568   4.716
  142    HB3  ALA  19           HB3      ALA  19  41.221   3.996   5.410
  143    H    ALA  20           HN       ALA  20  45.670   3.195   4.990
  144    HA   ALA  20           HA       ALA  20  46.454   1.038   4.685
  145    HB1  ALA  20           HB1      ALA  20  43.704  -0.119   5.167
  146    HB2  ALA  20           HB2      ALA  20  44.612   0.624   6.504
  147    HB3  ALA  20           HB3      ALA  20  45.298  -0.763   5.625
  148    H    VAL  21           HN       VAL  21  43.719   2.282   2.947
  149    HA   VAL  21           HA       VAL  21  44.584   0.736   0.556
  150    HB   VAL  21           HB       VAL  21  41.649   0.816   1.380
  151   HG11  VAL  21          HG11      VAL  21  41.454  -0.865  -0.449
  152   HG12  VAL  21          HG12      VAL  21  43.193  -0.685  -0.783
  153   HG13  VAL  21          HG13      VAL  21  42.089   0.687  -1.044
  154   HG21  VAL  21          HG21      VAL  21  41.975  -1.669   1.759
  155   HG22  VAL  21          HG22      VAL  21  42.791  -0.639   2.958
  156   HG23  VAL  21          HG23      VAL  21  43.730  -1.398   1.650
  157    H    ASN  22           HN       ASN  22  42.651   3.268   2.088
  158    HA   ASN  22           HA       ASN  22  43.253   5.451   0.618
  159    HB2  ASN  22           HB2      ASN  22  42.828   4.665  -1.567
  160    HB3  ASN  22           HB1      ASN  22  41.414   3.714  -1.059
  161   HD21  ASN  22          HD21      ASN  22  39.350   4.826  -0.836
  162   HD22  ASN  22          HD22      ASN  22  39.131   6.467  -1.452
  163    H    HIS  23           HN       HIS  23  40.377   3.505   1.445
  164    HA   HIS  23           HA       HIS  23  39.527   5.544   3.376
  165    HB2  HIS  23           HB2      HIS  23  38.671   6.447   1.188
  166    HB3  HIS  23           HB1      HIS  23  37.717   4.956   0.999
  167    HD1  HIS  23           HD1      HIS  23  35.411   5.043   1.935
  168    HD2  HIS  23           HD2      HIS  23  38.001   7.715   3.894
  169    HE1  HIS  23           HE1      HIS  23  34.015   6.358   3.623
  170    H    TYR  24           HN       TYR  24  40.330   2.923   3.724
  171    HA   TYR  24           HA       TYR  24  38.148   1.046   3.670
  172    HB2  TYR  24           HB2      TYR  24  40.557   0.424   3.846
  173    HB3  TYR  24           HB1      TYR  24  40.581   1.087   5.498
  174    HD1  TYR  24           HD1      TYR  24  38.995  -1.493   3.298
  175    HD2  TYR  24           HD2      TYR  24  39.689  -0.164   7.346
  176    HE1  TYR  24           HE1      TYR  24  38.079  -3.643   4.163
  177    HE2  TYR  24           HE2      TYR  24  38.772  -2.314   8.209
  178    HH   TYR  24           HH       TYR  24  37.640  -4.196   7.645
  179    H    LEU  25           HN       LEU  25  38.908   3.716   5.731
  180    HA   LEU  25           HA       LEU  25  36.463   3.340   7.229
  181    HB2  LEU  25           HB2      LEU  25  37.751   1.647   8.421
  182    HB3  LEU  25           HB1      LEU  25  39.100   2.780   8.647
  183    HG   LEU  25           HG       LEU  25  37.726   4.201  10.099
  184   HD11  LEU  25          HD11      LEU  25  35.518   4.084   9.238
  185   HD12  LEU  25          HD12      LEU  25  35.401   3.195  10.772
  186   HD13  LEU  25          HD13      LEU  25  35.511   2.303   9.234
  187   HD21  LEU  25          HD21      LEU  25  37.436   2.646  11.971
  188   HD22  LEU  25          HD22      LEU  25  38.899   2.207  11.057
  189   HD23  LEU  25          HD23      LEU  25  37.403   1.262  10.852
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  58.547  15.028   6.807
    2    H2   GLY   1           HT2      GLY   1  57.912  13.537   6.292
    3    H3   GLY   1           HT3      GLY   1  56.937  14.929   6.288
    4    HA2  GLY   1           HA1      GLY   1  57.818  14.167   4.098
    5    HA3  GLY   1           HA2      GLY   1  58.028  15.876   4.527
    6    H    TRP   2           HN       TRP   2  59.782  16.058   3.080
    7    HA   TRP   2           HA       TRP   2  62.340  15.457   4.336
    8    HB2  TRP   2           HB2      TRP   2  61.767  13.244   3.286
    9    HB3  TRP   2           HB1      TRP   2  61.737  14.055   1.702
   10    HD1  TRP   2           HD1      TRP   2  64.212  14.044   4.703
   11    HE1  TRP   2           HE1      TRP   2  66.634  13.783   3.791
   12    HE3  TRP   2           HE3      TRP   2  63.165  13.787  -0.301
   13    HZ2  TRP   2           HZ2      TRP   2  67.909  13.503   1.224
   14    HZ3  TRP   2           HZ3      TRP   2  64.998  13.522  -1.964
   15    HH2  TRP   2           HH2      TRP   2  67.368  13.380  -1.207
   16    H    GLY   3           HN       GLY   3  61.371  15.673   0.890
   17    HA2  GLY   3           HA1      GLY   3  61.747  18.460   0.590
   18    HA3  GLY   3           HA2      GLY   3  63.322  17.688   0.314
   19    H    SER   4           HN       SER   4  61.175  15.372  -0.516
   20    HA   SER   4           HA       SER   4  61.719  15.478  -3.285
   21    HB2  SER   4           HB2      SER   4  60.866  13.477  -2.093
   22    HB3  SER   4           HB1      SER   4  59.286  14.270  -1.910
   23    HG   SER   4           HG       SER   4  59.285  14.433  -4.247
   24    H    ILE   5           HN       ILE   5  59.935  15.576  -5.013
   25    HA   ILE   5           HA       ILE   5  58.865  18.294  -4.951
   26    HB   ILE   5           HB       ILE   5  58.255  16.113  -6.988
   27   HG12  ILE   5          HG12      ILE   5  60.643  16.130  -6.864
   28   HG13  ILE   5          HG11      ILE   5  60.242  17.143  -8.262
   29   HG21  ILE   5          HG21      ILE   5  58.109  19.151  -6.979
   30   HG22  ILE   5          HG22      ILE   5  56.850  17.972  -7.390
   31   HG23  ILE   5          HG23      ILE   5  58.212  18.233  -8.498
   32   HD11  ILE   5           HD1      ILE   5  61.143  18.023  -5.493
   33   HD12  ILE   5           HD2      ILE   5  60.398  19.156  -6.646
   34   HD13  ILE   5           HD3      ILE   5  61.922  18.342  -7.057
   35    H    PHE   6           HN       PHE   6  57.554  17.850  -2.950
   36    HA   PHE   6           HA       PHE   6  55.502  17.435  -1.940
   37    HB2  PHE   6           HB2      PHE   6  54.484  17.810  -4.786
   38    HB3  PHE   6           HB1      PHE   6  53.518  17.946  -3.297
   39    HD1  PHE   6           HD1      PHE   6  55.973  19.588  -5.480
   40    HD2  PHE   6           HD2      PHE   6  53.982  19.776  -1.656
   41    HE1  PHE   6           HE1      PHE   6  56.668  21.968  -5.236
   42    HE2  PHE   6           HE2      PHE   6  54.676  22.158  -1.414
   43    HZ   PHE   6           HZ       PHE   6  56.079  23.231  -3.171
   44    H    LYS   7           HN       LYS   7  57.035  15.192  -3.461
   45    HA   LYS   7           HA       LYS   7  55.017  13.315  -4.317
   46    HB2  LYS   7           HB2      LYS   7  57.519  13.297  -4.870
   47    HB3  LYS   7           HB1      LYS   7  57.779  12.650  -3.237
   48    HG2  LYS   7           HG2      LYS   7  57.628  10.673  -4.505
   49    HG3  LYS   7           HG1      LYS   7  55.959  10.857  -3.925
   50    HD2  LYS   7           HD2      LYS   7  55.244  11.776  -6.057
   51    HD3  LYS   7           HD1      LYS   7  56.923  11.900  -6.631
   52    HE2  LYS   7           HE2      LYS   7  55.553   9.878  -7.462
   53    HE3  LYS   7           HE1      LYS   7  57.163   9.538  -6.784
   54    HZ1  LYS   7           HZ1      LYS   7  56.233   8.797  -4.787
   55    HZ2  LYS   7           HZ2      LYS   7  55.234   8.118  -5.982
   56    HZ3  LYS   7           HZ3      LYS   7  54.716   9.483  -5.111
   57    H    HIS   8           HN       HIS   8  57.185  13.090  -1.461
   58    HA   HIS   8           HA       HIS   8  55.301  11.279  -0.129
   59    HB2  HIS   8           HB2      HIS   8  57.817  11.151   0.070
   60    HB3  HIS   8           HB1      HIS   8  57.760  12.655   1.019
   61    HD1  HIS   8           HD1      HIS   8  58.851  10.586   2.711
   62    HD2  HIS   8           HD2      HIS   8  54.695  10.875   2.140
   63    HE1  HIS   8           HE1      HIS   8  57.730   9.325   4.629
   64    H    GLY   9           HN       GLY   9  53.482  12.888  -0.265
   65    HA2  GLY   9           HA1      GLY   9  53.058  14.038   2.322
   66    HA3  GLY   9           HA2      GLY   9  53.486  15.323   1.176
   67    H    ARG  10           HN       ARG  10  52.293  14.635  -1.136
   68    HA   ARG  10           HA       ARG  10  49.386  14.799  -0.407
   69    HB2  ARG  10           HB2      ARG  10  50.694  15.360  -3.093
   70    HB3  ARG  10           HB1      ARG  10  49.065  15.830  -2.550
   71    HG2  ARG  10           HG2      ARG  10  50.100  17.249  -0.770
   72    HG3  ARG  10           HG1      ARG  10  51.709  16.833  -1.408
   73    HD2  ARG  10           HD2      ARG  10  51.129  17.823  -3.586
   74    HD3  ARG  10           HD1      ARG  10  49.490  18.193  -2.999
   75    HE   ARG  10           HE       ARG  10  51.222  19.432  -1.177
   76   HH11  ARG  10          HH11      ARG  10  50.141  21.640  -1.761
   77   HH12  ARG  10          HH12      ARG  10  50.818  22.343  -3.191
   78   HH21  ARG  10          HH21      ARG  10  52.319  19.401  -4.245
   79   HH22  ARG  10          HH22      ARG  10  52.052  21.075  -4.598
   80    H    HIS  11           HN       HIS  11  51.629  12.532  -1.253
   81    HA   HIS  11           HA       HIS  11  49.521  10.677  -2.151
   82    HB2  HIS  11           HB2      HIS  11  51.988  11.102  -3.884
   83    HB3  HIS  11           HB1      HIS  11  50.634   9.988  -4.192
   84    HD1  HIS  11           HD1      HIS  11  51.611  13.638  -4.295
   85    HD2  HIS  11           HD2      HIS  11  48.211  11.281  -5.044
   86    HE1  HIS  11           HE1      HIS  11  49.933  15.098  -5.553
   87    H    ALA  12           HN       ALA  12  49.861   8.682  -1.809
   88    HA   ALA  12           HA       ALA  12  50.716   6.766  -0.895
   89    HB1  ALA  12           HB1      ALA  12  53.146   8.297  -0.427
   90    HB2  ALA  12           HB2      ALA  12  52.827   7.604  -2.020
   91    HB3  ALA  12           HB3      ALA  12  53.031   6.555  -0.593
   92    H    ALA  13           HN       ALA  13  51.525   9.943   0.414
   93    HA   ALA  13           HA       ALA  13  51.554   9.008   3.193
   94    HB1  ALA  13           HB1      ALA  13  50.961  11.346   3.712
   95    HB2  ALA  13           HB2      ALA  13  50.550  11.661   2.009
   96    HB3  ALA  13           HB3      ALA  13  52.245  11.394   2.481
   97    H    LYS  14           HN       LYS  14  50.241   8.603   0.328
   98    HA   LYS  14           HA       LYS  14  47.295   8.289   1.332
   99    HB2  LYS  14           HB2      LYS  14  48.038   9.820  -0.659
  100    HB3  LYS  14           HB1      LYS  14  48.467   8.269  -1.473
  101    HG2  LYS  14           HG2      LYS  14  46.237   7.777  -1.908
  102    HG3  LYS  14           HG1      LYS  14  45.672   8.374  -0.333
  103    HD2  LYS  14           HD2      LYS  14  45.765  10.685  -1.128
  104    HD3  LYS  14           HD1      LYS  14  46.482  10.158  -2.671
  105    HE2  LYS  14           HE2      LYS  14  44.427   8.783  -3.106
  106    HE3  LYS  14           HE1      LYS  14  43.707   9.452  -1.620
  107    HZ1  LYS  14           HZ1      LYS  14  42.934  10.951  -3.117
  108    HZ2  LYS  14           HZ2      LYS  14  44.235  10.748  -4.192
  109    HZ3  LYS  14           HZ3      LYS  14  44.424  11.695  -2.794
  110    H    HIS  15           HN       HIS  15  46.347   6.694  -0.546
  111    HA   HIS  15           HA       HIS  15  45.989   4.383  -0.744
  112    HB2  HIS  15           HB2      HIS  15  48.732   4.657  -2.022
  113    HB3  HIS  15           HB1      HIS  15  47.474   3.461  -2.420
  114    HD1  HIS  15           HD1      HIS  15  44.971   4.879  -2.864
  115    HD2  HIS  15           HD2      HIS  15  48.643   6.616  -3.953
  116    HE1  HIS  15           HE1      HIS  15  44.471   6.708  -4.577
  117    H    ILE  16           HN       ILE  16  47.609   5.232   1.695
  118    HA   ILE  16           HA       ILE  16  47.930   2.849   2.862
  119    HB   ILE  16           HB       ILE  16  49.708   2.036   1.508
  120   HG12  ILE  16          HG12      ILE  16  51.395   3.301   3.691
  121   HG13  ILE  16          HG11      ILE  16  50.100   2.183   4.157
  122   HG21  ILE  16          HG21      ILE  16  50.322   4.072   0.275
  123   HG22  ILE  16          HG22      ILE  16  51.780   3.495   1.101
  124   HG23  ILE  16          HG23      ILE  16  50.866   4.842   1.777
  125   HD11  ILE  16           HD1      ILE  16  52.188   0.938   3.909
  126   HD12  ILE  16           HD2      ILE  16  52.415   1.571   2.264
  127   HD13  ILE  16           HD3      ILE  16  51.069   0.460   2.612
  128    H    GLY  17           HN       GLY  17  49.399   5.789   2.442
  129    HA2  GLY  17           HA1      GLY  17  49.790   6.216   5.322
  130    HA3  GLY  17           HA2      GLY  17  49.968   7.436   4.044
  131    H    HIS  18           HN       HIS  18  47.343   6.110   2.947
  132    HA   HIS  18           HA       HIS  18  45.523   7.962   4.467
  133    HB2  HIS  18           HB2      HIS  18  45.588   6.731   1.746
  134    HB3  HIS  18           HB1      HIS  18  43.972   6.774   2.475
  135    HD1  HIS  18           HD1      HIS  18  43.251   8.589   0.708
  136    HD2  HIS  18           HD2      HIS  18  46.399   9.783   3.226
  137    HE1  HIS  18           HE1      HIS  18  43.476  11.124   0.497
  138    H    ALA  19           HN       ALA  19  45.858   4.453   3.599
  139    HA   ALA  19           HA       ALA  19  44.563   3.720   6.109
  140    HB1  ALA  19           HB1      ALA  19  42.454   2.945   5.356
  141    HB2  ALA  19           HB2      ALA  19  42.905   3.131   3.643
  142    HB3  ALA  19           HB3      ALA  19  42.625   4.570   4.655
  143    H    ALA  20           HN       ALA  20  46.971   2.940   4.793
  144    HA   ALA  20           HA       ALA  20  48.117   0.963   4.414
  145    HB1  ALA  20           HB1      ALA  20  46.370   0.158   6.209
  146    HB2  ALA  20           HB2      ALA  20  47.308  -1.043   5.290
  147    HB3  ALA  20           HB3      ALA  20  45.626  -0.692   4.836
  148    H    VAL  21           HN       VAL  21  45.160   1.752   2.753
  149    HA   VAL  21           HA       VAL  21  46.278   0.531   0.279
  150    HB   VAL  21           HB       VAL  21  43.405  -0.025   1.136
  151   HG11  VAL  21          HG11      VAL  21  43.525  -1.612  -0.798
  152   HG12  VAL  21          HG12      VAL  21  45.159  -1.006  -1.159
  153   HG13  VAL  21          HG13      VAL  21  43.756   0.082  -1.289
  154   HG21  VAL  21          HG21      VAL  21  44.852  -1.323   2.593
  155   HG22  VAL  21          HG22      VAL  21  45.896  -1.783   1.226
  156   HG23  VAL  21          HG23      VAL  21  44.236  -2.415   1.330
  157    H    ASN  22           HN       ASN  22  43.946   2.574   1.962
  158    HA   ASN  22           HA       ASN  22  44.081   4.885   0.567
  159    HB2  ASN  22           HB2      ASN  22  43.712   4.110  -1.631
  160    HB3  ASN  22           HB1      ASN  22  42.522   2.895  -1.112
  161   HD21  ASN  22          HD21      ASN  22  40.298   3.588  -0.793
  162   HD22  ASN  22          HD22      ASN  22  39.754   5.184  -1.320
  163    H    HIS  23           HN       HIS  23  41.575   2.437   1.307
  164    HA   HIS  23           HA       HIS  23  40.538   3.966   3.519
  165    HB2  HIS  23           HB2      HIS  23  39.642   5.423   1.751
  166    HB3  HIS  23           HB1      HIS  23  38.901   4.018   0.949
  167    HD1  HIS  23           HD1      HIS  23  38.940   4.957   4.678
  168    HD2  HIS  23           HD2      HIS  23  36.211   4.393   1.529
  169    HE1  HIS  23           HE1      HIS  23  36.590   5.090   5.673
  170    H    TYR  24           HN       TYR  24  40.598   2.050   4.627
  171    HA   TYR  24           HA       TYR  24  38.318   0.274   4.211
  172    HB2  TYR  24           HB2      TYR  24  39.999  -0.570   2.518
  173    HB3  TYR  24           HB1      TYR  24  41.094  -0.928   3.875
  174    HD1  TYR  24           HD1      TYR  24  40.714  -2.826   5.325
  175    HD2  TYR  24           HD2      TYR  24  37.780  -1.728   2.354
  176    HE1  TYR  24           HE1      TYR  24  39.518  -4.977   5.710
  177    HE2  TYR  24           HE2      TYR  24  36.586  -3.880   2.739
  178    HH   TYR  24           HH       TYR  24  37.855  -6.409   3.741
  179    H    LEU  25           HN       LEU  25  40.517   1.857   6.057
  180    HA   LEU  25           HA       LEU  25  41.001  -0.085   8.154
  181    HB2  LEU  25           HB2      LEU  25  42.195   2.202   7.597
  182    HB3  LEU  25           HB1      LEU  25  40.933   2.911   8.627
  183    HG   LEU  25           HG       LEU  25  42.860   0.684   9.438
  184   HD11  LEU  25          HD11      LEU  25  42.685   3.609  10.289
  185   HD12  LEU  25          HD12      LEU  25  43.916   2.923   9.201
  186   HD13  LEU  25          HD13      LEU  25  43.846   2.408  10.903
  187   HD21  LEU  25          HD21      LEU  25  40.536   2.058  10.843
  188   HD22  LEU  25          HD22      LEU  25  41.875   1.342  11.773
  189   HD23  LEU  25          HD23      LEU  25  40.886   0.318  10.709
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1  61.895  15.305   6.532
    2    H2   GLY   1           HT2      GLY   1  62.345  16.792   7.221
    3    H3   GLY   1           HT3      GLY   1  62.484  15.356   8.120
    4    HA2  GLY   1           HA1      GLY   1  64.504  16.481   6.929
    5    HA3  GLY   1           HA2      GLY   1  64.360  14.728   7.160
    6    H    TRP   2           HN       TRP   2  62.562  16.867   4.939
    7    HA   TRP   2           HA       TRP   2  64.103  15.964   2.616
    8    HB2  TRP   2           HB2      TRP   2  61.938  14.967   1.551
    9    HB3  TRP   2           HB1      TRP   2  62.855  13.963   2.698
   10    HD1  TRP   2           HD1      TRP   2  59.626  15.988   2.381
   11    HE1  TRP   2           HE1      TRP   2  58.008  15.360   4.314
   12    HE3  TRP   2           HE3      TRP   2  62.771  13.035   5.141
   13    HZ2  TRP   2           HZ2      TRP   2  58.094  13.785   6.720
   14    HZ3  TRP   2           HZ3      TRP   2  61.980  11.980   7.253
   15    HH2  TRP   2           HH2      TRP   2  59.648  12.351   8.044
   16    H    GLY   3           HN       GLY   3  60.850  17.166   3.588
   17    HA2  GLY   3           HA1      GLY   3  59.690  19.041   2.895
   18    HA3  GLY   3           HA2      GLY   3  61.271  19.795   2.616
   19    H    SER   4           HN       SER   4  60.333  16.850   0.956
   20    HA   SER   4           HA       SER   4  60.949  17.735  -1.616
   21    HB2  SER   4           HB2      SER   4  60.365  15.378  -0.892
   22    HB3  SER   4           HB1      SER   4  58.653  15.849  -0.975
   23    HG   SER   4           HG       SER   4  59.984  14.935  -2.931
   24    H    ILE   5           HN       ILE   5  59.599  18.275  -3.466
   25    HA   ILE   5           HA       ILE   5  57.788  20.454  -2.801
   26    HB   ILE   5           HB       ILE   5  57.399  20.418  -5.375
   27   HG12  ILE   5          HG12      ILE   5  59.800  18.532  -5.255
   28   HG13  ILE   5          HG11      ILE   5  58.140  17.952  -5.505
   29   HG21  ILE   5          HG21      ILE   5  60.270  20.674  -4.365
   30   HG22  ILE   5          HG22      ILE   5  59.013  21.919  -4.165
   31   HG23  ILE   5          HG23      ILE   5  59.570  21.472  -5.792
   32   HD11  ILE   5           HD1      ILE   5  59.001  18.185  -7.702
   33   HD12  ILE   5           HD2      ILE   5  59.828  19.709  -7.318
   34   HD13  ILE   5           HD3      ILE   5  58.055  19.671  -7.472
   35    H    PHE   6           HN       PHE   6  56.335  19.102  -1.462
   36    HA   PHE   6           HA       PHE   6  54.325  17.985  -1.167
   37    HB2  PHE   6           HB2      PHE   6  53.815  19.146  -3.935
   38    HB3  PHE   6           HB1      PHE   6  52.567  18.464  -2.863
   39    HD1  PHE   6           HD1      PHE   6  52.281  19.478  -0.521
   40    HD2  PHE   6           HD2      PHE   6  54.548  21.402  -3.650
   41    HE1  PHE   6           HE1      PHE   6  52.104  21.651   0.687
   42    HE2  PHE   6           HE2      PHE   6  54.370  23.574  -2.442
   43    HZ   PHE   6           HZ       PHE   6  53.173  23.692  -0.261
   44    H    LYS   7           HN       LYS   7  55.867  16.048  -1.422
   45    HA   LYS   7           HA       LYS   7  54.585  14.201  -3.398
   46    HB2  LYS   7           HB2      LYS   7  57.571  14.737  -3.146
   47    HB3  LYS   7           HB1      LYS   7  56.916  13.245  -3.864
   48    HG2  LYS   7           HG2      LYS   7  55.615  14.632  -5.489
   49    HG3  LYS   7           HG1      LYS   7  56.367  16.094  -4.808
   50    HD2  LYS   7           HD2      LYS   7  58.560  15.409  -5.514
   51    HD3  LYS   7           HD1      LYS   7  57.994  13.770  -5.914
   52    HE2  LYS   7           HE2      LYS   7  58.319  15.457  -7.873
   53    HE3  LYS   7           HE1      LYS   7  56.810  14.514  -7.827
   54    HZ1  LYS   7           HZ1      LYS   7  56.220  16.756  -8.210
   55    HZ2  LYS   7           HZ2      LYS   7  57.224  17.328  -6.965
   56    HZ3  LYS   7           HZ3      LYS   7  55.825  16.440  -6.591
   57    H    HIS   8           HN       HIS   8  57.262  14.285  -0.985
   58    HA   HIS   8           HA       HIS   8  56.504  11.634   0.012
   59    HB2  HIS   8           HB2      HIS   8  58.485  13.715   1.015
   60    HB3  HIS   8           HB1      HIS   8  58.302  12.081   1.696
   61    HD1  HIS   8           HD1      HIS   8  57.628  11.103  -1.476
   62    HD2  HIS   8           HD2      HIS   8  61.123  12.834   0.098
   63    HE1  HIS   8           HE1      HIS   8  59.564  10.435  -3.004
   64    H    GLY   9           HN       GLY   9  54.280  13.290   0.163
   65    HA2  GLY   9           HA1      GLY   9  53.553  12.966   2.914
   66    HA3  GLY   9           HA2      GLY   9  53.929  14.673   2.607
   67    H    ARG  10           HN       ARG  10  53.038  14.251  -0.274
   68    HA   ARG  10           HA       ARG  10  50.123  14.679   0.273
   69    HB2  ARG  10           HB2      ARG  10  51.556  16.388  -0.995
   70    HB3  ARG  10           HB1      ARG  10  51.644  15.196  -2.311
   71    HG2  ARG  10           HG2      ARG  10  49.244  15.229  -2.610
   72    HG3  ARG  10           HG1      ARG  10  49.011  16.185  -1.128
   73    HD2  ARG  10           HD2      ARG  10  50.040  18.123  -2.104
   74    HD3  ARG  10           HD1      ARG  10  50.647  17.186  -3.492
   75    HE   ARG  10           HE       ARG  10  48.521  17.427  -4.489
   76   HH11  ARG  10          HH11      ARG  10  46.246  16.757  -3.798
   77   HH12  ARG  10          HH12      ARG  10  45.534  17.819  -2.631
   78   HH21  ARG  10          HH21      ARG  10  48.533  19.357  -1.811
   79   HH22  ARG  10          HH22      ARG  10  46.829  19.291  -1.505
   80    H    HIS  11           HN       HIS  11  52.218  12.267  -0.557
   81    HA   HIS  11           HA       HIS  11  50.013  10.639  -1.698
   82    HB2  HIS  11           HB2      HIS  11  51.243  11.632  -3.675
   83    HB3  HIS  11           HB1      HIS  11  52.717  10.827  -3.089
   84    HD1  HIS  11           HD1      HIS  11  52.549   8.125  -2.832
   85    HD2  HIS  11           HD2      HIS  11  49.655   9.992  -5.242
   86    HE1  HIS  11           HE1      HIS  11  51.438   6.303  -4.239
   87    H    ALA  12           HN       ALA  12  50.104   8.610  -1.376
   88    HA   ALA  12           HA       ALA  12  50.632   6.603  -0.411
   89    HB1  ALA  12           HB1      ALA  12  52.853   6.143   0.172
   90    HB2  ALA  12           HB2      ALA  12  53.124   7.870   0.402
   91    HB3  ALA  12           HB3      ALA  12  52.949   7.227  -1.233
   92    H    ALA  13           HN       ALA  13  51.581   9.661   1.074
   93    HA   ALA  13           HA       ALA  13  51.162   8.697   3.810
   94    HB1  ALA  13           HB1      ALA  13  50.915  11.421   2.410
   95    HB2  ALA  13           HB2      ALA  13  52.138  10.942   3.612
   96    HB3  ALA  13           HB3      ALA  13  50.445  11.175   4.108
   97    H    LYS  14           HN       LYS  14  50.194   8.463   0.791
   98    HA   LYS  14           HA       LYS  14  47.130   8.428   1.412
   99    HB2  LYS  14           HB2      LYS  14  48.269   9.911  -0.427
  100    HB3  LYS  14           HB1      LYS  14  48.637   8.337  -1.226
  101    HG2  LYS  14           HG2      LYS  14  46.436   8.083  -1.938
  102    HG3  LYS  14           HG1      LYS  14  45.745   8.721  -0.430
  103    HD2  LYS  14           HD2      LYS  14  46.218  11.024  -1.163
  104    HD3  LYS  14           HD1      LYS  14  46.999  10.411  -2.641
  105    HE2  LYS  14           HE2      LYS  14  44.094   9.887  -1.870
  106    HE3  LYS  14           HE1      LYS  14  44.628  11.132  -3.025
  107    HZ1  LYS  14           HZ1      LYS  14  44.235   8.369  -3.460
  108    HZ2  LYS  14           HZ2      LYS  14  45.866   8.747  -3.752
  109    HZ3  LYS  14           HZ3      LYS  14  44.638   9.575  -4.584
  110    H    HIS  15           HN       HIS  15  46.267   6.981  -0.602
  111    HA   HIS  15           HA       HIS  15  45.709   4.729  -0.930
  112    HB2  HIS  15           HB2      HIS  15  48.588   4.944  -1.880
  113    HB3  HIS  15           HB1      HIS  15  47.480   3.618  -2.306
  114    HD1  HIS  15           HD1      HIS  15  44.874   5.410  -2.591
  115    HD2  HIS  15           HD2      HIS  15  48.574   6.113  -4.458
  116    HE1  HIS  15           HE1      HIS  15  44.431   6.891  -4.625
  117    H    ILE  16           HN       ILE  16  47.135   5.376   1.715
  118    HA   ILE  16           HA       ILE  16  47.013   2.955   2.863
  119    HB   ILE  16           HB       ILE  16  48.833   1.978   1.671
  120   HG12  ILE  16          HG12      ILE  16  50.237   2.982   4.176
  121   HG13  ILE  16          HG11      ILE  16  48.864   1.860   4.290
  122   HG21  ILE  16          HG21      ILE  16  51.101   3.200   1.620
  123   HG22  ILE  16          HG22      ILE  16  50.245   4.621   2.221
  124   HG23  ILE  16          HG23      ILE  16  49.836   3.956   0.629
  125   HD11  ILE  16           HD1      ILE  16  51.577   1.391   2.998
  126   HD12  ILE  16           HD2      ILE  16  50.175   0.365   2.612
  127   HD13  ILE  16           HD3      ILE  16  50.780   0.456   4.279
  128    H    GLY  17           HN       GLY  17  48.755   5.767   2.677
  129    HA2  GLY  17           HA1      GLY  17  48.887   6.069   5.605
  130    HA3  GLY  17           HA2      GLY  17  49.344   7.286   4.397
  131    H    HIS  18           HN       HIS  18  46.714   6.254   2.981
  132    HA   HIS  18           HA       HIS  18  44.944   8.246   4.414
  133    HB2  HIS  18           HB2      HIS  18  45.151   7.179   1.614
  134    HB3  HIS  18           HB1      HIS  18  43.504   7.499   2.195
  135    HD1  HIS  18           HD1      HIS  18  46.244   9.641   3.590
  136    HD2  HIS  18           HD2      HIS  18  43.375   9.840   0.522
  137    HE1  HIS  18           HE1      HIS  18  46.167  12.061   2.776
  138    H    ALA  19           HN       ALA  19  45.038   4.807   3.294
  139    HA   ALA  19           HA       ALA  19  43.698   3.723   5.486
  140    HB1  ALA  19           HB1      ALA  19  41.803   5.091   3.601
  141    HB2  ALA  19           HB2      ALA  19  41.663   4.832   5.355
  142    HB3  ALA  19           HB3      ALA  19  41.300   3.507   4.231
  143    H    ALA  20           HN       ALA  20  45.258   3.465   2.719
  144    HA   ALA  20           HA       ALA  20  45.758   1.696   1.296
  145    HB1  ALA  20           HB1      ALA  20  44.291  -0.094   3.258
  146    HB2  ALA  20           HB2      ALA  20  45.923   0.545   3.574
  147    HB3  ALA  20           HB3      ALA  20  45.634  -0.515   2.173
  148    H    VAL  21           HN       VAL  21  42.902   2.990   1.695
  149    HA   VAL  21           HA       VAL  21  41.691   1.535  -0.590
  150    HB   VAL  21           HB       VAL  21  40.159   2.014   2.011
  151   HG11  VAL  21          HG11      VAL  21  38.464   0.514   0.739
  152   HG12  VAL  21          HG12      VAL  21  39.425   0.868  -0.715
  153   HG13  VAL  21          HG13      VAL  21  38.636   2.190   0.177
  154   HG21  VAL  21          HG21      VAL  21  41.671   0.158   2.370
  155   HG22  VAL  21          HG22      VAL  21  41.313  -0.521   0.765
  156   HG23  VAL  21          HG23      VAL  21  40.073  -0.542   2.041
  157    H    ASN  22           HN       ASN  22  42.490   4.220   1.240
  158    HA   ASN  22           HA       ASN  22  42.435   6.440   0.368
  159    HB2  ASN  22           HB2      ASN  22  41.140   5.627  -1.712
  160    HB3  ASN  22           HB1      ASN  22  39.661   5.966  -0.779
  161   HD21  ASN  22          HD21      ASN  22  42.850   7.673  -1.243
  162   HD22  ASN  22          HD22      ASN  22  42.106   9.233  -1.604
  163    H    HIS  23           HN       HIS  23  39.604   4.766   1.704
  164    HA   HIS  23           HA       HIS  23  39.588   6.476   4.030
  165    HB2  HIS  23           HB2      HIS  23  38.613   8.047   2.306
  166    HB3  HIS  23           HB1      HIS  23  37.263   6.909   2.117
  167    HD1  HIS  23           HD1      HIS  23  39.010   7.877   5.383
  168    HD2  HIS  23           HD2      HIS  23  35.301   8.385   3.468
  169    HE1  HIS  23           HE1      HIS  23  37.409   8.907   7.086
  170    H    TYR  24           HN       TYR  24  37.339   6.174   5.222
  171    HA   TYR  24           HA       TYR  24  36.209   4.547   6.445
  172    HB2  TYR  24           HB2      TYR  24  34.610   3.193   4.988
  173    HB3  TYR  24           HB1      TYR  24  34.531   4.960   4.803
  174    HD1  TYR  24           HD1      TYR  24  35.814   1.802   3.270
  175    HD2  TYR  24           HD2      TYR  24  35.142   6.032   2.732
  176    HE1  TYR  24           HE1      TYR  24  36.300   1.569   0.839
  177    HE2  TYR  24           HE2      TYR  24  35.631   5.798   0.299
  178    HH   TYR  24           HH       TYR  24  37.192   3.431  -1.063
  179    H    LEU  25           HN       LEU  25  38.975   3.794   5.594
  180    HA   LEU  25           HA       LEU  25  40.322   1.902   5.654
  181    HB2  LEU  25           HB2      LEU  25  37.997   0.467   6.975
  182    HB3  LEU  25           HB1      LEU  25  39.742   0.226   7.232
  183    HG   LEU  25           HG       LEU  25  38.112   2.686   8.006
  184   HD11  LEU  25          HD11      LEU  25  38.721   2.003  10.308
  185   HD12  LEU  25          HD12      LEU  25  39.583   0.586   9.662
  186   HD13  LEU  25          HD13      LEU  25  37.816   0.713   9.479
  187   HD21  LEU  25          HD21      LEU  25  41.102   2.094   8.067
  188   HD22  LEU  25          HD22      LEU  25  40.360   3.307   9.139
  189   HD23  LEU  25          HD23      LEU  25  40.269   3.507   7.375
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1  70.296  14.893   1.556
    2    H2   GLY   1           HT2      GLY   1  69.015  13.826   1.883
    3    H3   GLY   1           HT3      GLY   1  69.693  14.757   3.133
    4    HA2  GLY   1           HA1      GLY   1  67.849  15.942   2.725
    5    HA3  GLY   1           HA2      GLY   1  69.031  16.729   1.660
    6    H    TRP   2           HN       TRP   2  66.507  14.208   1.781
    7    HA   TRP   2           HA       TRP   2  66.303  13.719  -0.999
    8    HB2  TRP   2           HB2      TRP   2  63.948  13.836   0.917
    9    HB3  TRP   2           HB1      TRP   2  64.132  12.822  -0.534
   10    HD1  TRP   2           HD1      TRP   2  66.760  11.425  -0.263
   11    HE1  TRP   2           HE1      TRP   2  67.370   9.829   1.698
   12    HE3  TRP   2           HE3      TRP   2  63.403  13.103   3.219
   13    HZ2  TRP   2           HZ2      TRP   2  66.496   9.368   4.403
   14    HZ3  TRP   2           HZ3      TRP   2  63.309  12.071   5.483
   15    HH2  TRP   2           HH2      TRP   2  64.850  10.207   6.077
   16    H    GLY   3           HN       GLY   3  65.487  14.776  -2.705
   17    HA2  GLY   3           HA1      GLY   3  64.753  17.580  -2.366
   18    HA3  GLY   3           HA2      GLY   3  64.826  16.670  -3.887
   19    H    SER   4           HN       SER   4  63.015  14.894  -1.723
   20    HA   SER   4           HA       SER   4  60.563  15.406  -3.176
   21    HB2  SER   4           HB2      SER   4  59.556  13.901  -1.431
   22    HB3  SER   4           HB1      SER   4  60.980  13.211  -2.243
   23    HG   SER   4           HG       SER   4  62.115  13.423  -0.442
   24    H    ILE   5           HN       ILE   5  58.532  16.128  -2.273
   25    HA   ILE   5           HA       ILE   5  58.470  17.567   0.240
   26    HB   ILE   5           HB       ILE   5  59.805  19.194  -1.128
   27   HG12  ILE   5          HG12      ILE   5  56.963  20.109  -0.480
   28   HG13  ILE   5          HG11      ILE   5  58.277  19.934   0.707
   29   HG21  ILE   5          HG21      ILE   5  58.908  20.235  -3.074
   30   HG22  ILE   5          HG22      ILE   5  57.279  19.580  -2.779
   31   HG23  ILE   5          HG23      ILE   5  58.595  18.500  -3.305
   32   HD11  ILE   5           HD1      ILE   5  58.288  22.245   0.125
   33   HD12  ILE   5           HD2      ILE   5  58.072  21.895  -1.605
   34   HD13  ILE   5           HD3      ILE   5  59.627  21.542  -0.812
   35    H    PHE   6           HN       PHE   6  57.111  17.322  -3.067
   36    HA   PHE   6           HA       PHE   6  54.354  17.632  -1.930
   37    HB2  PHE   6           HB2      PHE   6  53.643  17.851  -4.259
   38    HB3  PHE   6           HB1      PHE   6  54.984  18.974  -3.931
   39    HD1  PHE   6           HD1      PHE   6  54.113  15.659  -5.440
   40    HD2  PHE   6           HD2      PHE   6  57.077  18.780  -5.099
   41    HE1  PHE   6           HE1      PHE   6  55.428  14.611  -7.276
   42    HE2  PHE   6           HE2      PHE   6  58.393  17.728  -6.935
   43    HZ   PHE   6           HZ       PHE   6  57.601  15.609  -7.979
   44    H    LYS   7           HN       LYS   7  56.605  15.294  -3.189
   45    HA   LYS   7           HA       LYS   7  54.655  13.310  -3.985
   46    HB2  LYS   7           HB2      LYS   7  57.117  13.430  -4.654
   47    HB3  LYS   7           HB1      LYS   7  57.497  12.791  -3.036
   48    HG2  LYS   7           HG2      LYS   7  55.878  10.875  -3.551
   49    HG3  LYS   7           HG1      LYS   7  55.860  11.458  -5.232
   50    HD2  LYS   7           HD2      LYS   7  58.342  10.615  -3.666
   51    HD3  LYS   7           HD1      LYS   7  57.538   9.657  -4.931
   52    HE2  LYS   7           HE2      LYS   7  57.903  11.756  -6.450
   53    HE3  LYS   7           HE1      LYS   7  59.084  12.253  -5.213
   54    HZ1  LYS   7           HZ1      LYS   7  59.315   9.491  -6.017
   55    HZ2  LYS   7           HZ2      LYS   7  60.513  10.684  -5.855
   56    HZ3  LYS   7           HZ3      LYS   7  59.594  10.587  -7.280
   57    H    HIS   8           HN       HIS   8  56.957  13.202  -1.220
   58    HA   HIS   8           HA       HIS   8  55.266  11.263   0.169
   59    HB2  HIS   8           HB2      HIS   8  56.953  11.435   1.951
   60    HB3  HIS   8           HB1      HIS   8  57.735  11.250   0.362
   61    HD1  HIS   8           HD1      HIS   8  59.583  12.460   2.298
   62    HD2  HIS   8           HD2      HIS   8  56.786  14.797   0.203
   63    HE1  HIS   8           HE1      HIS   8  60.400  14.879   2.378
   64    H    GLY   9           HN       GLY   9  53.354  12.860  -0.041
   65    HA2  GLY   9           HA1      GLY   9  52.724  13.797   2.564
   66    HA3  GLY   9           HA2      GLY   9  53.273  15.188   1.612
   67    H    ARG  10           HN       ARG  10  52.288  14.601  -0.901
   68    HA   ARG  10           HA       ARG  10  49.343  14.916  -0.411
   69    HB2  ARG  10           HB2      ARG  10  51.094  15.571  -2.817
   70    HB3  ARG  10           HB1      ARG  10  49.335  15.829  -2.732
   71    HG2  ARG  10           HG2      ARG  10  49.654  17.314  -0.764
   72    HG3  ARG  10           HG1      ARG  10  51.416  17.080  -0.887
   73    HD2  ARG  10           HD2      ARG  10  51.483  18.136  -3.061
   74    HD3  ARG  10           HD1      ARG  10  49.706  18.163  -3.163
   75    HE   ARG  10           HE       ARG  10  49.724  20.102  -1.812
   76   HH11  ARG  10          HH11      ARG  10  51.014  19.356   0.615
   77   HH12  ARG  10          HH12      ARG  10  52.550  20.155   0.571
   78   HH21  ARG  10          HH21      ARG  10  52.446  20.731  -2.846
   79   HH22  ARG  10          HH22      ARG  10  53.362  20.933  -1.390
   80    H    HIS  11           HN       HIS  11  51.475  12.495  -1.092
   81    HA   HIS  11           HA       HIS  11  49.340  10.797  -2.134
   82    HB2  HIS  11           HB2      HIS  11  50.189  11.914  -4.231
   83    HB3  HIS  11           HB1      HIS  11  51.793  11.227  -3.887
   84    HD1  HIS  11           HD1      HIS  11  51.874   8.510  -3.677
   85    HD2  HIS  11           HD2      HIS  11  48.498  10.166  -5.564
   86    HE1  HIS  11           HE1      HIS  11  50.729   6.631  -4.974
   87    H    ALA  12           HN       ALA  12  49.594   8.787  -1.898
   88    HA   ALA  12           HA       ALA  12  50.362   6.795  -1.099
   89    HB1  ALA  12           HB1      ALA  12  52.498   7.581  -2.220
   90    HB2  ALA  12           HB2      ALA  12  52.664   6.441  -0.861
   91    HB3  ALA  12           HB3      ALA  12  52.878   8.175  -0.614
   92    H    ALA  13           HN       ALA  13  51.371   9.847   0.350
   93    HA   ALA  13           HA       ALA  13  51.423   8.785   3.077
   94    HB1  ALA  13           HB1      ALA  13  50.691  11.195   3.604
   95    HB2  ALA  13           HB2      ALA  13  50.775  11.532   1.859
   96    HB3  ALA  13           HB3      ALA  13  52.250  11.095   2.754
   97    H    LYS  14           HN       LYS  14  50.014   8.585   0.237
   98    HA   LYS  14           HA       LYS  14  47.082   8.364   1.320
   99    HB2  LYS  14           HB2      LYS  14  47.856   9.971  -0.607
  100    HB3  LYS  14           HB1      LYS  14  48.182   8.447  -1.514
  101    HG2  LYS  14           HG2      LYS  14  45.918   8.096  -1.916
  102    HG3  LYS  14           HG1      LYS  14  45.425   8.636  -0.299
  103    HD2  LYS  14           HD2      LYS  14  45.650  10.984  -0.979
  104    HD3  LYS  14           HD1      LYS  14  46.257  10.486  -2.577
  105    HE2  LYS  14           HE2      LYS  14  43.542   9.637  -1.493
  106    HE3  LYS  14           HE1      LYS  14  43.779  11.085  -2.500
  107    HZ1  LYS  14           HZ1      LYS  14  43.458   8.474  -3.363
  108    HZ2  LYS  14           HZ2      LYS  14  45.090   8.846  -3.649
  109    HZ3  LYS  14           HZ3      LYS  14  43.866   9.823  -4.305
  110    H    HIS  15           HN       HIS  15  45.998   6.950  -0.596
  111    HA   HIS  15           HA       HIS  15  45.502   4.684  -0.911
  112    HB2  HIS  15           HB2      HIS  15  48.135   5.139  -2.349
  113    HB3  HIS  15           HB1      HIS  15  47.070   3.741  -2.631
  114    HD1  HIS  15           HD1      HIS  15  44.321   5.273  -2.394
  115    HD2  HIS  15           HD2      HIS  15  47.572   6.444  -4.789
  116    HE1  HIS  15           HE1      HIS  15  43.403   6.790  -4.234
  117    H    ILE  16           HN       ILE  16  47.211   5.250   1.534
  118    HA   ILE  16           HA       ILE  16  47.490   2.800   2.547
  119    HB   ILE  16           HB       ILE  16  49.116   1.996   0.964
  120   HG12  ILE  16          HG12      ILE  16  50.750   2.928   3.364
  121   HG13  ILE  16          HG11      ILE  16  49.623   1.557   3.406
  122   HG21  ILE  16          HG21      ILE  16  49.863   4.061  -0.102
  123   HG22  ILE  16          HG22      ILE  16  51.302   3.343   0.645
  124   HG23  ILE  16          HG23      ILE  16  50.470   4.680   1.446
  125   HD11  ILE  16           HD1      ILE  16  51.590   0.409   2.914
  126   HD12  ILE  16           HD2      ILE  16  52.308   1.782   2.048
  127   HD13  ILE  16           HD3      ILE  16  51.072   0.778   1.254
  128    H    GLY  17           HN       GLY  17  48.906   5.767   2.157
  129    HA2  GLY  17           HA1      GLY  17  49.572   5.964   5.040
  130    HA3  GLY  17           HA2      GLY  17  49.792   7.230   3.817
  131    H    HIS  18           HN       HIS  18  47.039   6.076   2.780
  132    HA   HIS  18           HA       HIS  18  45.398   7.990   4.425
  133    HB2  HIS  18           HB2      HIS  18  45.296   6.886   1.659
  134    HB3  HIS  18           HB1      HIS  18  43.709   6.953   2.449
  135    HD1  HIS  18           HD1      HIS  18  46.409   9.490   3.257
  136    HD2  HIS  18           HD2      HIS  18  42.929   9.230   0.912
  137    HE1  HIS  18           HE1      HIS  18  45.803  11.862   2.530
  138    H    ALA  19           HN       ALA  19  45.677   4.475   3.620
  139    HA   ALA  19           HA       ALA  19  43.974   3.983   6.040
  140    HB1  ALA  19           HB1      ALA  19  42.425   2.485   4.819
  141    HB2  ALA  19           HB2      ALA  19  43.133   3.036   3.286
  142    HB3  ALA  19           HB3      ALA  19  42.272   4.187   4.334
  143    H    ALA  20           HN       ALA  20  46.765   3.428   5.072
  144    HA   ALA  20           HA       ALA  20  48.271   1.679   5.290
  145    HB1  ALA  20           HB1      ALA  20  47.816   0.004   6.897
  146    HB2  ALA  20           HB2      ALA  20  46.060   0.101   6.621
  147    HB3  ALA  20           HB3      ALA  20  46.909   1.436   7.437
  148    H    VAL  21           HN       VAL  21  45.478   1.434   3.429
  149    HA   VAL  21           HA       VAL  21  46.666  -0.807   1.887
  150    HB   VAL  21           HB       VAL  21  43.783  -0.935   2.889
  151   HG11  VAL  21          HG11      VAL  21  43.938  -3.241   1.813
  152   HG12  VAL  21          HG12      VAL  21  45.479  -2.720   1.093
  153   HG13  VAL  21          HG13      VAL  21  43.969  -1.881   0.670
  154   HG21  VAL  21          HG21      VAL  21  44.643  -3.043   4.038
  155   HG22  VAL  21          HG22      VAL  21  45.256  -1.524   4.722
  156   HG23  VAL  21          HG23      VAL  21  46.291  -2.499   3.650
  157    H    ASN  22           HN       ASN  22  44.381   1.871   2.255
  158    HA   ASN  22           HA       ASN  22  44.620   2.565  -0.528
  159    HB2  ASN  22           HB2      ASN  22  43.196   0.636  -0.949
  160    HB3  ASN  22           HB1      ASN  22  42.036   1.175   0.284
  161   HD21  ASN  22          HD21      ASN  22  40.392   2.602  -0.375
  162   HD22  ASN  22          HD22      ASN  22  40.356   3.381  -1.961
  163    H    HIS  23           HN       HIS  23  41.471   2.721   1.013
  164    HA   HIS  23           HA       HIS  23  41.964   5.315   2.297
  165    HB2  HIS  23           HB2      HIS  23  41.773   5.944  -0.111
  166    HB3  HIS  23           HB1      HIS  23  40.166   5.183  -0.156
  167    HD1  HIS  23           HD1      HIS  23  40.744   6.700   3.115
  168    HD2  HIS  23           HD2      HIS  23  39.346   8.027  -0.623
  169    HE1  HIS  23           HE1      HIS  23  39.560   8.933   3.493
  170    H    TYR  24           HN       TYR  24  40.918   2.563   2.845
  171    HA   TYR  24           HA       TYR  24  38.035   2.829   3.180
  172    HB2  TYR  24           HB2      TYR  24  39.311   0.652   2.928
  173    HB3  TYR  24           HB1      TYR  24  39.916   0.893   4.584
  174    HD1  TYR  24           HD1      TYR  24  38.557   0.329   6.470
  175    HD2  TYR  24           HD2      TYR  24  36.777   0.601   2.546
  176    HE1  TYR  24           HE1      TYR  24  36.435  -0.620   7.366
  177    HE2  TYR  24           HE2      TYR  24  34.656  -0.348   3.442
  178    HH   TYR  24           HH       TYR  24  33.543  -0.954   5.331
  179    H    LEU  25           HN       LEU  25  40.084   4.793   4.454
  180    HA   LEU  25           HA       LEU  25  38.537   5.193   6.887
  181    HB2  LEU  25           HB2      LEU  25  40.194   3.344   7.509
  182    HB3  LEU  25           HB1      LEU  25  41.482   4.542   7.252
  183    HG   LEU  25           HG       LEU  25  40.033   6.049   8.903
  184   HD11  LEU  25          HD11      LEU  25  39.100   3.220   9.584
  185   HD12  LEU  25          HD12      LEU  25  38.076   4.586   9.085
  186   HD13  LEU  25          HD13      LEU  25  38.911   4.628  10.652
  187   HD21  LEU  25          HD21      LEU  25  41.242   5.032  10.847
  188   HD22  LEU  25          HD22      LEU  25  42.291   5.251   9.426
  189   HD23  LEU  25          HD23      LEU  25  41.657   3.636   9.826
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  66.027  16.996  -0.811
    2    H2   GLY   1           HT2      GLY   1  66.910  18.448  -0.824
    3    H3   GLY   1           HT3      GLY   1  67.631  17.015  -0.266
    4    HA2  GLY   1           HA1      GLY   1  66.761  17.611  -3.015
    5    HA3  GLY   1           HA2      GLY   1  68.432  17.526  -2.425
    6    H    TRP   2           HN       TRP   2  65.896  15.847  -3.879
    7    HA   TRP   2           HA       TRP   2  67.469  13.418  -4.044
    8    HB2  TRP   2           HB2      TRP   2  66.522  13.200  -1.725
    9    HB3  TRP   2           HB1      TRP   2  64.892  13.237  -2.438
   10    HD1  TRP   2           HD1      TRP   2  63.948  11.006  -3.225
   11    HE1  TRP   2           HE1      TRP   2  64.869   8.611  -3.643
   12    HE3  TRP   2           HE3      TRP   2  68.936  11.931  -2.543
   13    HZ2  TRP   2           HZ2      TRP   2  67.437   7.305  -3.670
   14    HZ3  TRP   2           HZ3      TRP   2  70.605  10.097  -2.771
   15    HH2  TRP   2           HH2      TRP   2  69.860   7.787  -3.333
   16    H    GLY   3           HN       GLY   3  64.015  14.406  -3.990
   17    HA2  GLY   3           HA1      GLY   3  63.575  14.580  -6.724
   18    HA3  GLY   3           HA2      GLY   3  63.427  12.845  -6.372
   19    H    SER   4           HN       SER   4  62.491  13.517  -3.584
   20    HA   SER   4           HA       SER   4  59.626  13.708  -4.296
   21    HB2  SER   4           HB2      SER   4  59.285  13.261  -1.879
   22    HB3  SER   4           HB1      SER   4  60.360  12.063  -2.632
   23    HG   SER   4           HG       SER   4  61.833  14.122  -1.803
   24    H    ILE   5           HN       ILE   5  59.808  15.945  -5.118
   25    HA   ILE   5           HA       ILE   5  60.449  18.094  -3.278
   26    HB   ILE   5           HB       ILE   5  58.658  18.330  -5.732
   27   HG12  ILE   5          HG12      ILE   5  61.706  18.218  -5.577
   28   HG13  ILE   5          HG11      ILE   5  60.650  17.025  -6.367
   29   HG21  ILE   5          HG21      ILE   5  59.425  20.592  -5.792
   30   HG22  ILE   5          HG22      ILE   5  60.750  20.260  -4.650
   31   HG23  ILE   5          HG23      ILE   5  59.065  20.275  -4.080
   32   HD11  ILE   5           HD1      ILE   5  61.403  18.412  -8.146
   33   HD12  ILE   5           HD2      ILE   5  61.202  19.898  -7.188
   34   HD13  ILE   5           HD3      ILE   5  59.770  19.020  -7.784
   35    H    PHE   6           HN       PHE   6  57.582  16.223  -4.041
   36    HA   PHE   6           HA       PHE   6  56.194  17.379  -1.718
   37    HB2  PHE   6           HB2      PHE   6  55.148  17.812  -4.545
   38    HB3  PHE   6           HB1      PHE   6  54.157  17.987  -3.077
   39    HD1  PHE   6           HD1      PHE   6  56.269  19.734  -5.353
   40    HD2  PHE   6           HD2      PHE   6  55.247  19.494  -1.165
   41    HE1  PHE   6           HE1      PHE   6  57.131  22.045  -5.009
   42    HE2  PHE   6           HE2      PHE   6  56.113  21.805  -0.823
   43    HZ   PHE   6           HZ       PHE   6  57.051  23.082  -2.746
   44    H    LYS   7           HN       LYS   7  56.973  14.918  -3.819
   45    HA   LYS   7           HA       LYS   7  54.739  13.322  -4.193
   46    HB2  LYS   7           HB2      LYS   7  57.024  12.689  -4.881
   47    HB3  LYS   7           HB1      LYS   7  57.454  12.396  -3.179
   48    HG2  LYS   7           HG2      LYS   7  55.900  10.570  -3.001
   49    HG3  LYS   7           HG1      LYS   7  55.129  10.987  -4.548
   50    HD2  LYS   7           HD2      LYS   7  56.650   9.042  -4.800
   51    HD3  LYS   7           HD1      LYS   7  57.205  10.432  -5.761
   52    HE2  LYS   7           HE2      LYS   7  58.980   9.157  -4.357
   53    HE3  LYS   7           HE1      LYS   7  58.964  10.931  -4.243
   54    HZ1  LYS   7           HZ1      LYS   7  59.009   9.469  -2.104
   55    HZ2  LYS   7           HZ2      LYS   7  57.334   9.347  -2.367
   56    HZ3  LYS   7           HZ3      LYS   7  58.054  10.870  -2.151
   57    H    HIS   8           HN       HIS   8  56.880  12.523  -1.448
   58    HA   HIS   8           HA       HIS   8  54.680  11.332   0.016
   59    HB2  HIS   8           HB2      HIS   8  56.377  11.161   1.857
   60    HB3  HIS   8           HB1      HIS   8  56.944  10.492   0.308
   61    HD1  HIS   8           HD1      HIS   8  56.868  14.126   0.102
   62    HD2  HIS   8           HD2      HIS   8  59.593  11.247   1.503
   63    HE1  HIS   8           HE1      HIS   8  59.139  15.275   0.331
   64    H    GLY   9           HN       GLY   9  55.315  14.490  -0.628
   65    HA2  GLY   9           HA1      GLY   9  54.861  15.605   2.052
   66    HA3  GLY   9           HA2      GLY   9  54.980  16.497   0.524
   67    H    ARG  10           HN       ARG  10  52.902  14.449  -0.559
   68    HA   ARG  10           HA       ARG  10  50.481  15.069   0.941
   69    HB2  ARG  10           HB2      ARG  10  49.432  16.561  -0.675
   70    HB3  ARG  10           HB1      ARG  10  50.961  17.285  -0.121
   71    HG2  ARG  10           HG2      ARG  10  52.053  16.184  -2.181
   72    HG3  ARG  10           HG1      ARG  10  50.400  15.875  -2.761
   73    HD2  ARG  10           HD2      ARG  10  51.663  18.578  -2.140
   74    HD3  ARG  10           HD1      ARG  10  51.148  17.968  -3.731
   75    HE   ARG  10           HE       ARG  10  49.406  19.130  -1.694
   76   HH11  ARG  10          HH11      ARG  10  48.463  19.860  -4.167
   77   HH12  ARG  10          HH12      ARG  10  47.321  18.653  -4.655
   78   HH21  ARG  10          HH21      ARG  10  48.447  16.289  -2.381
   79   HH22  ARG  10          HH22      ARG  10  47.312  16.631  -3.644
   80    H    HIS  11           HN       HIS  11  51.954  12.809  -0.330
   81    HA   HIS  11           HA       HIS  11  49.618  11.515  -1.459
   82    HB2  HIS  11           HB2      HIS  11  50.372  12.832  -3.452
   83    HB3  HIS  11           HB1      HIS  11  51.947  12.010  -3.354
   84    HD1  HIS  11           HD1      HIS  11  48.312  10.739  -3.145
   85    HD2  HIS  11           HD2      HIS  11  51.913   9.942  -5.169
   86    HE1  HIS  11           HE1      HIS  11  47.898   8.737  -4.677
   87    H    ALA  12           HN       ALA  12  49.698   9.459  -1.639
   88    HA   ALA  12           HA       ALA  12  50.315   7.299  -1.241
   89    HB1  ALA  12           HB1      ALA  12  52.976   8.365  -0.733
   90    HB2  ALA  12           HB2      ALA  12  52.423   8.093  -2.390
   91    HB3  ALA  12           HB3      ALA  12  52.596   6.732  -1.251
   92    H    ALA  13           HN       ALA  13  51.714   9.931   0.649
   93    HA   ALA  13           HA       ALA  13  51.830   8.370   3.123
   94    HB1  ALA  13           HB1      ALA  13  52.857  10.670   3.038
   95    HB2  ALA  13           HB2      ALA  13  51.495  10.636   4.185
   96    HB3  ALA  13           HB3      ALA  13  51.281  11.347   2.567
   97    H    LYS  14           HN       LYS  14  50.232   8.853   0.412
   98    HA   LYS  14           HA       LYS  14  47.370   8.690   1.668
   99    HB2  LYS  14           HB2      LYS  14  48.180  10.535  -0.008
  100    HB3  LYS  14           HB1      LYS  14  48.283   9.176  -1.189
  101    HG2  LYS  14           HG2      LYS  14  45.969   9.096  -1.436
  102    HG3  LYS  14           HG1      LYS  14  45.650   9.413   0.284
  103    HD2  LYS  14           HD2      LYS  14  46.188  11.824  -0.090
  104    HD3  LYS  14           HD1      LYS  14  46.431  11.479  -1.819
  105    HE2  LYS  14           HE2      LYS  14  43.849  10.884  -0.314
  106    HE3  LYS  14           HE1      LYS  14  44.127  12.362  -1.264
  107    HZ1  LYS  14           HZ1      LYS  14  43.315   9.849  -2.183
  108    HZ2  LYS  14           HZ2      LYS  14  44.868  10.132  -2.809
  109    HZ3  LYS  14           HZ3      LYS  14  43.618  11.247  -3.092
  110    H    HIS  15           HN       HIS  15  46.023   7.742  -0.357
  111    HA   HIS  15           HA       HIS  15  45.267   5.630  -1.024
  112    HB2  HIS  15           HB2      HIS  15  46.448   6.748  -2.956
  113    HB3  HIS  15           HB1      HIS  15  47.881   5.766  -2.568
  114    HD1  HIS  15           HD1      HIS  15  48.012   3.707  -3.960
  115    HD2  HIS  15           HD2      HIS  15  44.032   4.806  -3.160
  116    HE1  HIS  15           HE1      HIS  15  46.504   1.972  -5.075
  117    H    ILE  16           HN       ILE  16  47.285   5.630   1.288
  118    HA   ILE  16           HA       ILE  16  47.275   3.005   1.845
  119    HB   ILE  16           HB       ILE  16  48.733   2.332   0.080
  120   HG12  ILE  16          HG12      ILE  16  50.804   2.663   2.269
  121   HG13  ILE  16          HG11      ILE  16  49.360   1.686   2.605
  122   HG21  ILE  16          HG21      ILE  16  49.598   4.485  -0.682
  123   HG22  ILE  16          HG22      ILE  16  51.010   3.529  -0.181
  124   HG23  ILE  16          HG23      ILE  16  50.366   4.772   0.892
  125   HD11  ILE  16           HD1      ILE  16  49.869   0.116   0.904
  126   HD12  ILE  16           HD2      ILE  16  51.445   0.463   1.653
  127   HD13  ILE  16           HD3      ILE  16  51.015   1.213   0.100
  128    H    GLY  17           HN       GLY  17  49.064   5.792   1.920
  129    HA2  GLY  17           HA1      GLY  17  49.838   5.406   4.745
  130    HA3  GLY  17           HA2      GLY  17  50.102   6.865   3.767
  131    H    HIS  18           HN       HIS  18  47.210   6.199   2.732
  132    HA   HIS  18           HA       HIS  18  45.841   7.852   4.849
  133    HB2  HIS  18           HB2      HIS  18  45.473   7.332   1.928
  134    HB3  HIS  18           HB1      HIS  18  43.957   7.412   2.844
  135    HD1  HIS  18           HD1      HIS  18  43.360   9.690   1.680
  136    HD2  HIS  18           HD2      HIS  18  46.892   9.784   3.960
  137    HE1  HIS  18           HE1      HIS  18  43.971  12.145   2.038
  138    H    ALA  19           HN       ALA  19  45.531   4.707   3.101
  139    HA   ALA  19           HA       ALA  19  44.759   3.135   5.249
  140    HB1  ALA  19           HB1      ALA  19  42.835   4.264   5.937
  141    HB2  ALA  19           HB2      ALA  19  42.120   3.149   4.753
  142    HB3  ALA  19           HB3      ALA  19  42.460   4.835   4.293
  143    H    ALA  20           HN       ALA  20  45.554   3.543   2.227
  144    HA   ALA  20           HA       ALA  20  45.576   2.190   0.342
  145    HB1  ALA  20           HB1      ALA  20  44.491  -0.024   2.111
  146    HB2  ALA  20           HB2      ALA  20  46.192   0.498   2.156
  147    HB3  ALA  20           HB3      ALA  20  45.505  -0.171   0.656
  148    H    VAL  21           HN       VAL  21  42.976   3.362   1.736
  149    HA   VAL  21           HA       VAL  21  41.153   2.439  -0.442
  150    HB   VAL  21           HB       VAL  21  40.413   2.459   2.523
  151   HG11  VAL  21          HG11      VAL  21  38.796   2.148  -0.035
  152   HG12  VAL  21          HG12      VAL  21  38.478   3.203   1.363
  153   HG13  VAL  21          HG13      VAL  21  38.229   1.450   1.500
  154   HG21  VAL  21          HG21      VAL  21  39.989   0.012   2.108
  155   HG22  VAL  21          HG22      VAL  21  41.697   0.462   1.911
  156   HG23  VAL  21          HG23      VAL  21  40.675   0.206   0.477
  157    H    ASN  22           HN       ASN  22  42.578   4.745   1.531
  158    HA   ASN  22           HA       ASN  22  42.486   7.087   0.999
  159    HB2  ASN  22           HB2      ASN  22  40.604   6.721  -0.703
  160    HB3  ASN  22           HB1      ASN  22  39.470   6.872   0.667
  161   HD21  ASN  22          HD21      ASN  22  40.284   8.914   2.195
  162   HD22  ASN  22          HD22      ASN  22  40.504  10.396   1.256
  163    H    HIS  23           HN       HIS  23  40.053   5.305   2.859
  164    HA   HIS  23           HA       HIS  23  40.845   6.652   5.291
  165    HB2  HIS  23           HB2      HIS  23  39.415   8.416   4.086
  166    HB3  HIS  23           HB1      HIS  23  38.034   7.328   4.350
  167    HD1  HIS  23           HD1      HIS  23  36.781   7.770   6.454
  168    HD2  HIS  23           HD2      HIS  23  40.844   8.796   6.807
  169    HE1  HIS  23           HE1      HIS  23  37.116   8.763   8.786
  170    H    TYR  24           HN       TYR  24  37.781   6.365   6.043
  171    HA   TYR  24           HA       TYR  24  36.573   4.728   7.155
  172    HB2  TYR  24           HB2      TYR  24  37.649   2.974   4.910
  173    HB3  TYR  24           HB1      TYR  24  36.265   2.591   5.962
  174    HD1  TYR  24           HD1      TYR  24  37.495   4.739   3.210
  175    HD2  TYR  24           HD2      TYR  24  34.143   3.810   5.765
  176    HE1  TYR  24           HE1      TYR  24  35.993   6.047   1.713
  177    HE2  TYR  24           HE2      TYR  24  32.641   5.119   4.268
  178    HH   TYR  24           HH       TYR  24  32.556   6.044   2.025
  179    H    LEU  25           HN       LEU  25  39.593   5.087   7.616
  180    HA   LEU  25           HA       LEU  25  40.715   2.565   8.327
  181    HB2  LEU  25           HB2      LEU  25  41.745   5.000   8.205
  182    HB3  LEU  25           HB1      LEU  25  41.294   5.081   9.920
  183    HG   LEU  25           HG       LEU  25  43.083   2.977   8.614
  184   HD11  LEU  25          HD11      LEU  25  43.672   5.175  10.648
  185   HD12  LEU  25          HD12      LEU  25  44.118   5.219   8.925
  186   HD13  LEU  25          HD13      LEU  25  44.846   4.004  10.002
  187   HD21  LEU  25          HD21      LEU  25  41.947   1.836  10.371
  188   HD22  LEU  25          HD22      LEU  25  41.948   3.270  11.426
  189   HD23  LEU  25          HD23      LEU  25  43.462   2.384  11.123
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1  65.339  21.775   1.558
    2    H2   GLY   1           HT2      GLY   1  64.641  20.227   1.618
    3    H3   GLY   1           HT3      GLY   1  64.943  20.970   0.120
    4    HA2  GLY   1           HA1      GLY   1  66.902  20.078   0.026
    5    HA3  GLY   1           HA2      GLY   1  67.322  20.939   1.519
    6    H    TRP   2           HN       TRP   2  64.751  19.229   2.463
    7    HA   TRP   2           HA       TRP   2  66.293  17.331   3.959
    8    HB2  TRP   2           HB2      TRP   2  64.058  18.154   4.647
    9    HB3  TRP   2           HB1      TRP   2  63.325  17.281   3.279
   10    HD1  TRP   2           HD1      TRP   2  63.031  14.705   3.486
   11    HE1  TRP   2           HE1      TRP   2  63.343  12.979   5.406
   12    HE3  TRP   2           HE3      TRP   2  65.590  17.644   6.802
   13    HZ2  TRP   2           HZ2      TRP   2  64.549  12.917   8.020
   14    HZ3  TRP   2           HZ3      TRP   2  66.313  16.733   9.002
   15    HH2  TRP   2           HH2      TRP   2  65.795  14.373   9.615
   16    H    GLY   3           HN       GLY   3  63.676  16.413   1.704
   17    HA2  GLY   3           HA1      GLY   3  65.232  14.916  -0.117
   18    HA3  GLY   3           HA2      GLY   3  64.810  13.826   1.219
   19    H    SER   4           HN       SER   4  62.467  16.206   0.955
   20    HA   SER   4           HA       SER   4  60.909  15.008  -1.219
   21    HB2  SER   4           HB2      SER   4  59.896  14.639   1.625
   22    HB3  SER   4           HB1      SER   4  59.110  14.106   0.123
   23    HG   SER   4           HG       SER   4  60.568  12.607   1.478
   24    H    ILE   5           HN       ILE   5  60.341  16.893  -2.107
   25    HA   ILE   5           HA       ILE   5  59.976  19.352  -0.804
   26    HB   ILE   5           HB       ILE   5  60.066  18.993  -3.298
   27   HG12  ILE   5          HG12      ILE   5  57.636  20.553  -2.308
   28   HG13  ILE   5          HG11      ILE   5  59.314  21.139  -2.242
   29   HG21  ILE   5          HG21      ILE   5  58.317  17.095  -3.184
   30   HG22  ILE   5          HG22      ILE   5  58.149  18.260  -4.516
   31   HG23  ILE   5          HG23      ILE   5  57.091  18.382  -3.090
   32   HD11  ILE   5           HD1      ILE   5  58.408  22.082  -4.238
   33   HD12  ILE   5           HD2      ILE   5  57.619  20.557  -4.697
   34   HD13  ILE   5           HD3      ILE   5  59.390  20.705  -4.791
   35    H    PHE   6           HN       PHE   6  57.585  16.784  -1.461
   36    HA   PHE   6           HA       PHE   6  56.065  17.351   0.893
   37    HB2  PHE   6           HB2      PHE   6  55.276  18.821  -1.609
   38    HB3  PHE   6           HB1      PHE   6  53.949  18.061  -0.706
   39    HD1  PHE   6           HD1      PHE   6  55.722  21.071  -1.032
   40    HD2  PHE   6           HD2      PHE   6  54.243  18.379   2.006
   41    HE1  PHE   6           HE1      PHE   6  55.736  22.929   0.625
   42    HE2  PHE   6           HE2      PHE   6  54.260  20.240   3.660
   43    HZ   PHE   6           HZ       PHE   6  55.062  22.499   2.983
   44    H    LYS   7           HN       LYS   7  57.098  15.502  -1.540
   45    HA   LYS   7           HA       LYS   7  54.914  13.942  -2.406
   46    HB2  LYS   7           HB2      LYS   7  57.244  13.747  -3.252
   47    HB3  LYS   7           HB1      LYS   7  57.715  12.971  -1.721
   48    HG2  LYS   7           HG2      LYS   7  56.264  11.092  -2.125
   49    HG3  LYS   7           HG1      LYS   7  55.480  11.911  -3.497
   50    HD2  LYS   7           HD2      LYS   7  57.502  11.796  -4.820
   51    HD3  LYS   7           HD1      LYS   7  58.447  11.223  -3.424
   52    HE2  LYS   7           HE2      LYS   7  56.085   9.716  -4.626
   53    HE3  LYS   7           HE1      LYS   7  57.787   9.385  -5.023
   54    HZ1  LYS   7           HZ1      LYS   7  57.702   8.014  -3.278
   55    HZ2  LYS   7           HZ2      LYS   7  56.278   8.705  -2.659
   56    HZ3  LYS   7           HZ3      LYS   7  57.786   9.409  -2.317
   57    H    HIS   8           HN       HIS   8  56.573  14.021   0.700
   58    HA   HIS   8           HA       HIS   8  55.293  11.517   1.621
   59    HB2  HIS   8           HB2      HIS   8  56.393  12.111   3.791
   60    HB3  HIS   8           HB1      HIS   8  57.529  12.019   2.424
   61    HD1  HIS   8           HD1      HIS   8  58.771  13.645   4.441
   62    HD2  HIS   8           HD2      HIS   8  55.746  15.316   2.048
   63    HE1  HIS   8           HE1      HIS   8  59.053  16.182   4.519
   64    H    GLY   9           HN       GLY   9  53.259  13.053   0.792
   65    HA2  GLY   9           HA1      GLY   9  51.592  13.266   3.062
   66    HA3  GLY   9           HA2      GLY   9  52.232  14.889   2.743
   67    H    ARG  10           HN       ARG  10  52.419  14.096  -0.202
   68    HA   ARG  10           HA       ARG  10  49.748  15.086  -0.908
   69    HB2  ARG  10           HB2      ARG  10  52.203  14.338  -2.523
   70    HB3  ARG  10           HB1      ARG  10  50.686  14.910  -3.258
   71    HG2  ARG  10           HG2      ARG  10  50.821  17.023  -2.095
   72    HG3  ARG  10           HG1      ARG  10  52.175  16.449  -1.091
   73    HD2  ARG  10           HD2      ARG  10  53.670  16.396  -2.970
   74    HD3  ARG  10           HD1      ARG  10  52.334  16.603  -4.128
   75    HE   ARG  10           HE       ARG  10  52.469  18.832  -2.282
   76   HH11  ARG  10          HH11      ARG  10  55.290  18.299  -3.446
   77   HH12  ARG  10          HH12      ARG  10  55.277  19.385  -4.795
   78   HH21  ARG  10          HH21      ARG  10  51.841  19.852  -4.726
   79   HH22  ARG  10          HH22      ARG  10  53.324  20.263  -5.521
   80    H    HIS  11           HN       HIS  11  50.815  13.096  -3.319
   81    HA   HIS  11           HA       HIS  11  48.622  11.166  -2.829
   82    HB2  HIS  11           HB2      HIS  11  48.803  12.254  -5.055
   83    HB3  HIS  11           HB1      HIS  11  50.431  11.561  -5.246
   84    HD1  HIS  11           HD1      HIS  11  50.596   8.886  -5.314
   85    HD2  HIS  11           HD2      HIS  11  46.743  10.513  -5.748
   86    HE1  HIS  11           HE1      HIS  11  49.080   7.030  -6.203
   87    H    ALA  12           HN       ALA  12  48.776   9.094  -2.757
   88    HA   ALA  12           HA       ALA  12  49.598   7.018  -2.281
   89    HB1  ALA  12           HB1      ALA  12  51.262   7.712  -4.064
   90    HB2  ALA  12           HB2      ALA  12  51.813   6.502  -2.876
   91    HB3  ALA  12           HB3      ALA  12  52.226   8.209  -2.684
   92    H    ALA  13           HN       ALA  13  51.340   9.893  -1.179
   93    HA   ALA  13           HA       ALA  13  52.221   8.656   1.321
   94    HB1  ALA  13           HB1      ALA  13  53.124  10.886   0.898
   95    HB2  ALA  13           HB2      ALA  13  51.866  11.103   2.137
   96    HB3  ALA  13           HB3      ALA  13  51.524  11.510   0.438
   97    H    LYS  14           HN       LYS  14  49.908   8.825  -0.874
   98    HA   LYS  14           HA       LYS  14  47.513   8.756   1.144
   99    HB2  LYS  14           HB2      LYS  14  47.738  10.369  -0.907
  100    HB3  LYS  14           HB1      LYS  14  47.575   8.867  -1.892
  101    HG2  LYS  14           HG2      LYS  14  45.289   8.737  -1.471
  102    HG3  LYS  14           HG1      LYS  14  45.443   9.259   0.221
  103    HD2  LYS  14           HD2      LYS  14  45.702  11.607  -0.527
  104    HD3  LYS  14           HD1      LYS  14  45.567  11.082  -2.224
  105    HE2  LYS  14           HE2      LYS  14  43.427  10.569  -0.116
  106    HE3  LYS  14           HE1      LYS  14  43.403  11.951  -1.238
  107    HZ1  LYS  14           HZ1      LYS  14  43.816   9.314  -2.417
  108    HZ2  LYS  14           HZ2      LYS  14  42.913  10.636  -2.988
  109    HZ3  LYS  14           HZ3      LYS  14  42.271   9.618  -1.788
  110    H    HIS  15           HN       HIS  15  45.699   7.527  -0.301
  111    HA   HIS  15           HA       HIS  15  44.892   5.339  -0.490
  112    HB2  HIS  15           HB2      HIS  15  45.445   6.186  -2.784
  113    HB3  HIS  15           HB1      HIS  15  47.011   5.350  -2.669
  114    HD1  HIS  15           HD1      HIS  15  47.017   3.052  -3.622
  115    HD2  HIS  15           HD2      HIS  15  43.192   4.194  -2.298
  116    HE1  HIS  15           HE1      HIS  15  45.426   1.117  -4.128
  117    H    ILE  16           HN       ILE  16  47.441   5.670   1.184
  118    HA   ILE  16           HA       ILE  16  47.712   3.146   2.045
  119    HB   ILE  16           HB       ILE  16  48.671   2.265   0.048
  120   HG12  ILE  16          HG12      ILE  16  50.981   1.679   0.646
  121   HG13  ILE  16          HG11      ILE  16  51.013   2.960   1.875
  122   HG21  ILE  16          HG21      ILE  16  50.715   3.403  -0.993
  123   HG22  ILE  16          HG22      ILE  16  50.374   4.787   0.050
  124   HG23  ILE  16          HG23      ILE  16  49.196   4.308  -1.185
  125   HD11  ILE  16           HD1      ILE  16  48.942   0.725   1.875
  126   HD12  ILE  16           HD2      ILE  16  49.331   1.849   3.197
  127   HD13  ILE  16           HD3      ILE  16  50.499   0.594   2.726
  128    H    GLY  17           HN       GLY  17  49.453   5.845   1.232
  129    HA2  GLY  17           HA1      GLY  17  50.927   5.891   3.768
  130    HA3  GLY  17           HA2      GLY  17  50.841   7.205   2.580
  131    H    HIS  18           HN       HIS  18  47.797   6.428   2.506
  132    HA   HIS  18           HA       HIS  18  47.039   8.331   4.715
  133    HB2  HIS  18           HB2      HIS  18  45.847   7.426   2.124
  134    HB3  HIS  18           HB1      HIS  18  44.672   7.627   3.436
  135    HD1  HIS  18           HD1      HIS  18  43.671   9.710   2.167
  136    HD2  HIS  18           HD2      HIS  18  47.685  10.147   3.342
  137    HE1  HIS  18           HE1      HIS  18  44.245  12.194   2.011
  138    H    ALA  19           HN       ALA  19  46.319   5.003   3.513
  139    HA   ALA  19           HA       ALA  19  46.288   3.693   5.960
  140    HB1  ALA  19           HB1      ALA  19  43.739   5.254   5.540
  141    HB2  ALA  19           HB2      ALA  19  44.618   4.915   7.051
  142    HB3  ALA  19           HB3      ALA  19  43.634   3.647   6.295
  143    H    ALA  20           HN       ALA  20  46.132   3.749   2.811
  144    HA   ALA  20           HA       ALA  20  45.647   2.181   1.170
  145    HB1  ALA  20           HB1      ALA  20  46.806   0.709   2.917
  146    HB2  ALA  20           HB2      ALA  20  45.751  -0.122   1.751
  147    HB3  ALA  20           HB3      ALA  20  45.179   0.187   3.408
  148    H    VAL  21           HN       VAL  21  43.538   3.521   3.129
  149    HA   VAL  21           HA       VAL  21  41.181   2.368   1.700
  150    HB   VAL  21           HB       VAL  21  41.313   2.763   4.726
  151   HG11  VAL  21          HG11      VAL  21  38.997   1.565   4.489
  152   HG12  VAL  21          HG12      VAL  21  39.079   2.064   2.783
  153   HG13  VAL  21          HG13      VAL  21  39.092   3.289   4.074
  154   HG21  VAL  21          HG21      VAL  21  42.500   0.728   4.053
  155   HG22  VAL  21          HG22      VAL  21  41.146   0.247   3.002
  156   HG23  VAL  21          HG23      VAL  21  40.938   0.272   4.770
  157    H    ASN  22           HN       ASN  22  43.057   4.878   2.886
  158    HA   ASN  22           HA       ASN  22  42.741   7.151   2.178
  159    HB2  ASN  22           HB2      ASN  22  40.456   6.581   1.140
  160    HB3  ASN  22           HB1      ASN  22  39.765   6.909   2.750
  161   HD21  ASN  22          HD21      ASN  22  39.723   9.107   3.526
  162   HD22  ASN  22          HD22      ASN  22  40.141  10.463   2.474
  163    H    HIS  23           HN       HIS  23  41.018   5.539   4.793
  164    HA   HIS  23           HA       HIS  23  42.395   6.972   6.840
  165    HB2  HIS  23           HB2      HIS  23  40.326   8.237   7.722
  166    HB3  HIS  23           HB1      HIS  23  41.168   8.946   6.325
  167    HD1  HIS  23           HD1      HIS  23  39.238   5.898   5.504
  168    HD2  HIS  23           HD2      HIS  23  38.496  10.035   5.673
  169    HE1  HIS  23           HE1      HIS  23  37.079   6.338   4.208
  170    H    TYR  24           HN       TYR  24  42.584   4.887   7.649
  171    HA   TYR  24           HA       TYR  24  40.139   3.896   9.066
  172    HB2  TYR  24           HB2      TYR  24  40.245   2.626   6.948
  173    HB3  TYR  24           HB1      TYR  24  41.929   2.169   7.302
  174    HD1  TYR  24           HD1      TYR  24  38.438   1.997   8.699
  175    HD2  TYR  24           HD2      TYR  24  42.387   0.252   8.633
  176    HE1  TYR  24           HE1      TYR  24  37.618   0.085  10.067
  177    HE2  TYR  24           HE2      TYR  24  41.564  -1.661  10.000
  178    HH   TYR  24           HH       TYR  24  38.871  -2.705  10.112
  179    H    LEU  25           HN       LEU  25  43.101   5.079   9.316
  180    HA   LEU  25           HA       LEU  25  44.827   4.873  10.857
  181    HB2  LEU  25           HB2      LEU  25  42.472   3.689  12.367
  182    HB3  LEU  25           HB1      LEU  25  44.077   3.835  13.119
  183    HG   LEU  25           HG       LEU  25  44.083   6.251  12.762
  184   HD11  LEU  25          HD11      LEU  25  41.519   5.669  11.230
  185   HD12  LEU  25          HD12      LEU  25  42.962   6.558  10.684
  186   HD13  LEU  25          HD13      LEU  25  41.870   7.289  11.881
  187   HD21  LEU  25          HD21      LEU  25  41.354   5.424  13.845
  188   HD22  LEU  25          HD22      LEU  25  42.304   6.861  14.296
  189   HD23  LEU  25          HD23      LEU  25  42.873   5.237  14.752
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1  67.537   7.832  -3.553
    2    H2   GLY   1           HT2      GLY   1  66.062   6.987  -3.518
    3    H3   GLY   1           HT3      GLY   1  66.943   7.229  -2.085
    4    HA2  GLY   1           HA1      GLY   1  64.999   8.672  -2.323
    5    HA3  GLY   1           HA2      GLY   1  66.545   9.511  -2.088
    6    H    TRP   2           HN       TRP   2  64.756  11.113  -3.042
    7    HA   TRP   2           HA       TRP   2  65.724  11.727  -5.715
    8    HB2  TRP   2           HB2      TRP   2  64.057   9.961  -6.264
    9    HB3  TRP   2           HB1      TRP   2  62.801  10.918  -5.442
   10    HD1  TRP   2           HD1      TRP   2  61.637  12.728  -6.818
   11    HE1  TRP   2           HE1      TRP   2  61.964  13.805  -9.162
   12    HE3  TRP   2           HE3      TRP   2  66.127  10.606  -8.064
   13    HZ2  TRP   2           HZ2      TRP   2  63.924  13.734 -11.270
   14    HZ3  TRP   2           HZ3      TRP   2  67.206  11.125 -10.247
   15    HH2  TRP   2           HH2      TRP   2  66.110  12.686 -11.849
   16    H    GLY   3           HN       GLY   3  64.856  12.621  -2.783
   17    HA2  GLY   3           HA1      GLY   3  64.478  14.739  -1.905
   18    HA3  GLY   3           HA2      GLY   3  64.431  15.391  -3.555
   19    H    SER   4           HN       SER   4  62.348  12.922  -3.739
   20    HA   SER   4           HA       SER   4  60.032  12.894  -3.934
   21    HB2  SER   4           HB2      SER   4  58.809  13.478  -1.851
   22    HB3  SER   4           HB1      SER   4  60.239  12.470  -1.533
   23    HG   SER   4           HG       SER   4  59.692  14.747  -0.433
   24    H    ILE   5           HN       ILE   5  59.562  14.212  -5.652
   25    HA   ILE   5           HA       ILE   5  59.572  17.098  -5.457
   26    HB   ILE   5           HB       ILE   5  59.762  15.764  -7.607
   27   HG12  ILE   5          HG12      ILE   5  57.565  17.872  -7.389
   28   HG13  ILE   5          HG11      ILE   5  59.298  18.171  -7.646
   29   HG21  ILE   5          HG21      ILE   5  57.822  14.802  -8.619
   30   HG22  ILE   5          HG22      ILE   5  56.732  15.549  -7.426
   31   HG23  ILE   5          HG23      ILE   5  57.811  14.220  -6.939
   32   HD11  ILE   5           HD1      ILE   5  58.348  18.320  -9.819
   33   HD12  ILE   5           HD2      ILE   5  57.296  16.911  -9.551
   34   HD13  ILE   5           HD3      ILE   5  59.050  16.686  -9.764
   35    H    PHE   6           HN       PHE   6  57.054  14.585  -5.226
   36    HA   PHE   6           HA       PHE   6  55.392  16.394  -3.601
   37    HB2  PHE   6           HB2      PHE   6  54.584  15.532  -6.404
   38    HB3  PHE   6           HB1      PHE   6  53.360  15.874  -5.160
   39    HD1  PHE   6           HD1      PHE   6  53.833  18.151  -3.774
   40    HD2  PHE   6           HD2      PHE   6  55.224  17.343  -7.785
   41    HE1  PHE   6           HE1      PHE   6  54.048  20.594  -4.196
   42    HE2  PHE   6           HE2      PHE   6  55.436  19.788  -8.200
   43    HZ   PHE   6           HZ       PHE   6  54.805  21.414  -6.423
   44    H    LYS   7           HN       LYS   7  56.622  13.423  -4.487
   45    HA   LYS   7           HA       LYS   7  54.514  11.609  -3.901
   46    HB2  LYS   7           HB2      LYS   7  57.448  11.256  -3.173
   47    HB3  LYS   7           HB1      LYS   7  56.254   9.973  -3.467
   48    HG2  LYS   7           HG2      LYS   7  57.127  12.031  -5.547
   49    HG3  LYS   7           HG1      LYS   7  57.781  10.383  -5.422
   50    HD2  LYS   7           HD2      LYS   7  55.285   9.608  -5.585
   51    HD3  LYS   7           HD1      LYS   7  54.968  11.257  -6.175
   52    HE2  LYS   7           HE2      LYS   7  55.354   9.795  -8.090
   53    HE3  LYS   7           HE1      LYS   7  56.729  10.914  -7.934
   54    HZ1  LYS   7           HZ1      LYS   7  57.341   8.729  -6.358
   55    HZ2  LYS   7           HZ2      LYS   7  58.025   9.134  -7.859
   56    HZ3  LYS   7           HZ3      LYS   7  56.700   8.075  -7.786
   57    H    HIS   8           HN       HIS   8  57.232  12.261  -1.658
   58    HA   HIS   8           HA       HIS   8  55.496  11.610   0.631
   59    HB2  HIS   8           HB2      HIS   8  57.938  10.958   0.445
   60    HB3  HIS   8           HB1      HIS   8  58.345  12.680   0.643
   61    HD1  HIS   8           HD1      HIS   8  55.409  12.339   2.589
   62    HD2  HIS   8           HD2      HIS   8  59.363  11.024   3.149
   63    HE1  HIS   8           HE1      HIS   8  55.732  11.940   5.092
   64    H    GLY   9           HN       GLY   9  54.039  13.499  -0.105
   65    HA2  GLY   9           HA1      GLY   9  54.469  15.652   1.786
   66    HA3  GLY   9           HA2      GLY   9  54.741  16.189   0.117
   67    H    ARG  10           HN       ARG  10  52.679  13.955  -0.612
   68    HA   ARG  10           HA       ARG  10  50.168  14.819   0.497
   69    HB2  ARG  10           HB2      ARG  10  49.311  15.967  -1.593
   70    HB3  ARG  10           HB1      ARG  10  50.508  16.902  -0.664
   71    HG2  ARG  10           HG2      ARG  10  52.297  16.195  -2.187
   72    HG3  ARG  10           HG1      ARG  10  51.159  15.160  -3.082
   73    HD2  ARG  10           HD2      ARG  10  50.965  18.192  -2.803
   74    HD3  ARG  10           HD1      ARG  10  51.498  17.313  -4.255
   75    HE   ARG  10           HE       ARG  10  48.926  16.327  -3.525
   76   HH11  ARG  10          HH11      ARG  10  49.009  19.462  -3.154
   77   HH12  ARG  10          HH12      ARG  10  48.280  19.937  -4.650
   78   HH21  ARG  10          HH21      ARG  10  48.613  16.811  -6.112
   79   HH22  ARG  10          HH22      ARG  10  48.055  18.437  -6.326
   80    H    HIS  11           HN       HIS  11  51.934  12.547  -0.666
   81    HA   HIS  11           HA       HIS  11  49.656  11.009  -1.680
   82    HB2  HIS  11           HB2      HIS  11  51.996  11.681  -3.507
   83    HB3  HIS  11           HB1      HIS  11  50.869  10.335  -3.800
   84    HD1  HIS  11           HD1      HIS  11  48.157  11.428  -3.263
   85    HD2  HIS  11           HD2      HIS  11  51.139  13.788  -5.060
   86    HE1  HIS  11           HE1      HIS  11  46.979  13.298  -4.547
   87    H    ALA  12           HN       ALA  12  49.843   8.953  -1.650
   88    HA   ALA  12           HA       ALA  12  50.543   6.877  -1.012
   89    HB1  ALA  12           HB1      ALA  12  52.841   6.426  -0.878
   90    HB2  ALA  12           HB2      ALA  12  53.124   8.127  -0.506
   91    HB3  ALA  12           HB3      ALA  12  52.665   7.660  -2.146
   92    H    ALA  13           HN       ALA  13  51.713   9.757   0.654
   93    HA   ALA  13           HA       ALA  13  51.799   8.463   3.278
   94    HB1  ALA  13           HB1      ALA  13  50.990  11.327   2.510
   95    HB2  ALA  13           HB2      ALA  13  52.673  10.851   2.838
   96    HB3  ALA  13           HB3      ALA  13  51.451  10.754   4.129
   97    H    LYS  14           HN       LYS  14  50.308   8.575   0.468
   98    HA   LYS  14           HA       LYS  14  47.403   8.370   1.611
   99    HB2  LYS  14           HB2      LYS  14  48.191  10.094  -0.202
  100    HB3  LYS  14           HB1      LYS  14  48.422   8.638  -1.240
  101    HG2  LYS  14           HG2      LYS  14  46.129   8.414  -1.583
  102    HG3  LYS  14           HG1      LYS  14  45.712   8.846   0.091
  103    HD2  LYS  14           HD2      LYS  14  46.001  11.224  -0.410
  104    HD3  LYS  14           HD1      LYS  14  46.572  10.841  -2.053
  105    HE2  LYS  14           HE2      LYS  14  43.836  10.016  -0.996
  106    HE3  LYS  14           HE1      LYS  14  44.123  11.520  -1.905
  107    HZ1  LYS  14           HZ1      LYS  14  43.958   8.814  -2.851
  108    HZ2  LYS  14           HZ2      LYS  14  45.359   9.604  -3.396
  109    HZ3  LYS  14           HZ3      LYS  14  43.828  10.271  -3.709
  110    H    HIS  15           HN       HIS  15  46.206   7.153  -0.383
  111    HA   HIS  15           HA       HIS  15  45.614   4.944  -0.886
  112    HB2  HIS  15           HB2      HIS  15  48.291   5.288  -2.287
  113    HB3  HIS  15           HB1      HIS  15  47.056   4.077  -2.705
  114    HD1  HIS  15           HD1      HIS  15  48.196   7.140  -3.950
  115    HD2  HIS  15           HD2      HIS  15  44.361   5.737  -2.939
  116    HE1  HIS  15           HE1      HIS  15  46.500   8.606  -5.177
  117    H    ILE  16           HN       ILE  16  47.482   5.301   1.529
  118    HA   ILE  16           HA       ILE  16  47.586   2.757   2.365
  119    HB   ILE  16           HB       ILE  16  49.164   1.986   0.759
  120   HG12  ILE  16          HG12      ILE  16  51.010   2.706   3.064
  121   HG13  ILE  16          HG11      ILE  16  49.671   1.564   3.307
  122   HG21  ILE  16          HG21      ILE  16  50.641   4.579   1.372
  123   HG22  ILE  16          HG22      ILE  16  49.956   4.099  -0.191
  124   HG23  ILE  16          HG23      ILE  16  51.381   3.264   0.456
  125   HD11  ILE  16           HD1      ILE  16  51.561   0.211   2.775
  126   HD12  ILE  16           HD2      ILE  16  52.065   1.277   1.448
  127   HD13  ILE  16           HD3      ILE  16  50.611   0.267   1.275
  128    H    GLY  17           HN       GLY  17  49.262   5.611   2.226
  129    HA2  GLY  17           HA1      GLY  17  49.916   5.562   5.097
  130    HA3  GLY  17           HA2      GLY  17  50.135   6.931   3.990
  131    H    HIS  18           HN       HIS  18  47.309   6.010   2.943
  132    HA   HIS  18           HA       HIS  18  45.802   7.761   4.891
  133    HB2  HIS  18           HB2      HIS  18  45.520   7.007   1.999
  134    HB3  HIS  18           HB1      HIS  18  43.996   7.185   2.893
  135    HD1  HIS  18           HD1      HIS  18  47.011   9.275   3.817
  136    HD2  HIS  18           HD2      HIS  18  43.468   9.683   1.589
  137    HE1  HIS  18           HE1      HIS  18  46.688  11.766   3.348
  138    H    ALA  19           HN       ALA  19  45.691   4.484   3.356
  139    HA   ALA  19           HA       ALA  19  44.845   3.082   5.611
  140    HB1  ALA  19           HB1      ALA  19  42.827   4.176   6.034
  141    HB2  ALA  19           HB2      ALA  19  42.255   2.913   4.924
  142    HB3  ALA  19           HB3      ALA  19  42.557   4.559   4.317
  143    H    ALA  20           HN       ALA  20  45.835   3.233   2.609
  144    HA   ALA  20           HA       ALA  20  46.064   1.692   0.889
  145    HB1  ALA  20           HB1      ALA  20  46.103  -0.619   1.453
  146    HB2  ALA  20           HB2      ALA  20  44.963  -0.390   2.800
  147    HB3  ALA  20           HB3      ALA  20  46.623   0.240   2.921
  148    H    VAL  21           HN       VAL  21  43.320   2.847   1.974
  149    HA   VAL  21           HA       VAL  21  41.717   1.667  -0.238
  150    HB   VAL  21           HB       VAL  21  40.707   1.794   2.643
  151   HG11  VAL  21          HG11      VAL  21  39.430   1.074  -0.024
  152   HG12  VAL  21          HG12      VAL  21  38.847   2.203   1.221
  153   HG13  VAL  21          HG13      VAL  21  38.772   0.455   1.509
  154   HG21  VAL  21          HG21      VAL  21  42.230  -0.084   2.425
  155   HG22  VAL  21          HG22      VAL  21  41.519  -0.548   0.861
  156   HG23  VAL  21          HG23      VAL  21  40.580  -0.737   2.361
  157    H    ASN  22           HN       ASN  22  42.831   4.147   1.721
  158    HA   ASN  22           HA       ASN  22  42.596   6.456   1.143
  159    HB2  ASN  22           HB2      ASN  22  40.929   5.855  -0.736
  160    HB3  ASN  22           HB1      ASN  22  39.656   6.022   0.502
  161   HD21  ASN  22          HD21      ASN  22  42.328   7.809  -1.144
  162   HD22  ASN  22          HD22      ASN  22  41.654   9.408  -0.815
  163    H    HIS  23           HN       HIS  23  40.146   4.502   2.756
  164    HA   HIS  23           HA       HIS  23  40.521   5.847   5.263
  165    HB2  HIS  23           HB2      HIS  23  38.178   6.843   5.401
  166    HB3  HIS  23           HB1      HIS  23  39.327   7.720   4.363
  167    HD1  HIS  23           HD1      HIS  23  38.585   4.757   2.533
  168    HD2  HIS  23           HD2      HIS  23  36.529   8.360   3.213
  169    HE1  HIS  23           HE1      HIS  23  36.792   4.963   0.724
  170    H    TYR  24           HN       TYR  24  38.569   5.274   6.798
  171    HA   TYR  24           HA       TYR  24  37.493   3.505   7.847
  172    HB2  TYR  24           HB2      TYR  24  36.659   2.892   4.982
  173    HB3  TYR  24           HB1      TYR  24  35.913   2.201   6.443
  174    HD1  TYR  24           HD1      TYR  24  35.927   5.002   4.159
  175    HD2  TYR  24           HD2      TYR  24  34.973   3.848   8.209
  176    HE1  TYR  24           HE1      TYR  24  34.474   7.013   4.389
  177    HE2  TYR  24           HE2      TYR  24  33.519   5.858   8.437
  178    HH   TYR  24           HH       TYR  24  33.178   8.020   7.439
  179    H    LEU  25           HN       LEU  25  40.273   3.136   6.970
  180    HA   LEU  25           HA       LEU  25  41.836   1.429   6.808
  181    HB2  LEU  25           HB2      LEU  25  39.713  -0.445   7.904
  182    HB3  LEU  25           HB1      LEU  25  41.473  -0.477   8.171
  183    HG   LEU  25           HG       LEU  25  39.514   1.627   9.195
  184   HD11  LEU  25          HD11      LEU  25  41.292  -0.334  10.706
  185   HD12  LEU  25          HD12      LEU  25  39.573  -0.627  10.352
  186   HD13  LEU  25          HD13      LEU  25  40.048   0.739  11.389
  187   HD21  LEU  25          HD21      LEU  25  41.554   2.791   8.711
  188   HD22  LEU  25          HD22      LEU  25  42.555   1.432   9.278
  189   HD23  LEU  25          HD23      LEU  25  41.635   2.412  10.446
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1  68.370  11.240  -1.165
    2    H2   GLY   1           HT2      GLY   1  68.046   9.578  -1.319
    3    H3   GLY   1           HT3      GLY   1  67.494  10.434   0.042
    4    HA2  GLY   1           HA1      GLY   1  66.385  10.195  -2.585
    5    HA3  GLY   1           HA2      GLY   1  65.596  10.532  -1.031
    6    H    TRP   2           HN       TRP   2  65.936  11.761  -3.973
    7    HA   TRP   2           HA       TRP   2  66.881  14.426  -3.596
    8    HB2  TRP   2           HB2      TRP   2  64.674  13.514  -5.482
    9    HB3  TRP   2           HB1      TRP   2  65.720  14.944  -5.659
   10    HD1  TRP   2           HD1      TRP   2  68.087  14.606  -6.653
   11    HE1  TRP   2           HE1      TRP   2  69.391  12.588  -7.652
   12    HE3  TRP   2           HE3      TRP   2  64.952  10.823  -5.212
   13    HZ2  TRP   2           HZ2      TRP   2  69.086   9.729  -7.789
   14    HZ3  TRP   2           HZ3      TRP   2  65.479   8.459  -5.787
   15    HH2  TRP   2           HH2      TRP   2  67.540   7.908  -7.073
   16    H    GLY   3           HN       GLY   3  64.198  12.859  -2.251
   17    HA2  GLY   3           HA1      GLY   3  62.541  13.690  -0.859
   18    HA3  GLY   3           HA2      GLY   3  63.283  15.297  -0.994
   19    H    SER   4           HN       SER   4  62.842  14.268  -4.095
   20    HA   SER   4           HA       SER   4  61.373  14.999  -5.740
   21    HB2  SER   4           HB2      SER   4  59.298  14.253  -3.643
   22    HB3  SER   4           HB1      SER   4  59.013  14.423  -5.390
   23    HG   SER   4           HG       SER   4  61.125  12.809  -4.919
   24    H    ILE   5           HN       ILE   5  59.263  16.416  -6.102
   25    HA   ILE   5           HA       ILE   5  59.889  19.015  -4.802
   26    HB   ILE   5           HB       ILE   5  58.260  19.938  -6.473
   27   HG12  ILE   5          HG12      ILE   5  58.149  17.023  -7.385
   28   HG13  ILE   5          HG11      ILE   5  56.803  17.962  -6.701
   29   HG21  ILE   5          HG21      ILE   5  60.767  19.568  -6.909
   30   HG22  ILE   5          HG22      ILE   5  59.737  19.724  -8.350
   31   HG23  ILE   5          HG23      ILE   5  60.293  18.117  -7.823
   32   HD11  ILE   5           HD1      ILE   5  58.174  18.298  -9.388
   33   HD12  ILE   5           HD2      ILE   5  57.237  19.627  -8.661
   34   HD13  ILE   5           HD3      ILE   5  56.444  18.081  -9.041
   35    H    PHE   6           HN       PHE   6  57.280  16.609  -4.992
   36    HA   PHE   6           HA       PHE   6  56.108  17.691  -2.530
   37    HB2  PHE   6           HB2      PHE   6  54.667  17.975  -5.196
   38    HB3  PHE   6           HB1      PHE   6  53.812  17.971  -3.636
   39    HD1  PHE   6           HD1      PHE   6  55.743  19.962  -5.979
   40    HD2  PHE   6           HD2      PHE   6  54.519  19.672  -1.850
   41    HE1  PHE   6           HE1      PHE   6  56.295  22.369  -5.646
   42    HE2  PHE   6           HE2      PHE   6  55.070  22.079  -1.518
   43    HZ   PHE   6           HZ       PHE   6  56.043  23.402  -3.393
   44    H    LYS   7           HN       LYS   7  56.792  15.253  -4.724
   45    HA   LYS   7           HA       LYS   7  54.638  13.458  -4.537
   46    HB2  LYS   7           HB2      LYS   7  56.775  13.145  -5.856
   47    HB3  LYS   7           HB1      LYS   7  57.569  12.673  -4.334
   48    HG2  LYS   7           HG2      LYS   7  55.916  10.852  -4.028
   49    HG3  LYS   7           HG1      LYS   7  55.118  11.322  -5.549
   50    HD2  LYS   7           HD2      LYS   7  57.207  10.863  -6.795
   51    HD3  LYS   7           HD1      LYS   7  58.014  10.400  -5.276
   52    HE2  LYS   7           HE2      LYS   7  56.506   8.526  -4.966
   53    HE3  LYS   7           HE1      LYS   7  55.492   9.052  -6.332
   54    HZ1  LYS   7           HZ1      LYS   7  57.572   7.298  -6.470
   55    HZ2  LYS   7           HZ2      LYS   7  58.262   8.744  -7.035
   56    HZ3  LYS   7           HZ3      LYS   7  56.875   8.112  -7.785
   57    H    HIS   8           HN       HIS   8  57.568  13.306  -2.454
   58    HA   HIS   8           HA       HIS   8  56.151  11.683  -0.481
   59    HB2  HIS   8           HB2      HIS   8  58.602  11.490  -0.925
   60    HB3  HIS   8           HB1      HIS   8  58.825  13.123  -0.252
   61    HD1  HIS   8           HD1      HIS   8  58.838  13.393   2.276
   62    HD2  HIS   8           HD2      HIS   8  57.583   9.570   1.055
   63    HE1  HIS   8           HE1      HIS   8  58.723  11.926   4.364
   64    H    GLY   9           HN       GLY   9  54.348  13.300  -0.280
   65    HA2  GLY   9           HA1      GLY   9  54.430  14.566   2.224
   66    HA3  GLY   9           HA2      GLY   9  54.846  15.817   1.035
   67    H    ARG  10           HN       ARG  10  53.089  14.010  -0.864
   68    HA   ARG  10           HA       ARG  10  50.389  14.782   0.168
   69    HB2  ARG  10           HB2      ARG  10  51.494  15.650  -2.537
   70    HB3  ARG  10           HB1      ARG  10  49.820  15.872  -1.974
   71    HG2  ARG  10           HG2      ARG  10  50.716  17.194  -0.024
   72    HG3  ARG  10           HG1      ARG  10  52.338  17.079  -0.749
   73    HD2  ARG  10           HD2      ARG  10  51.229  19.216  -1.357
   74    HD3  ARG  10           HD1      ARG  10  51.522  18.203  -2.791
   75    HE   ARG  10           HE       ARG  10  48.924  17.570  -1.882
   76   HH11  ARG  10          HH11      ARG  10  47.115  18.972  -2.203
   77   HH12  ARG  10          HH12      ARG  10  47.310  20.318  -3.275
   78   HH21  ARG  10          HH21      ARG  10  50.732  19.881  -3.630
   79   HH22  ARG  10          HH22      ARG  10  49.357  20.833  -4.083
   80    H    HIS  11           HN       HIS  11  52.291  12.408  -0.779
   81    HA   HIS  11           HA       HIS  11  50.036  10.829  -1.831
   82    HB2  HIS  11           HB2      HIS  11  52.584  11.156  -3.471
   83    HB3  HIS  11           HB1      HIS  11  51.243  10.041  -3.830
   84    HD1  HIS  11           HD1      HIS  11  52.266  13.659  -3.983
   85    HD2  HIS  11           HD2      HIS  11  48.889  11.307  -4.840
   86    HE1  HIS  11           HE1      HIS  11  50.623  15.127  -5.278
   87    H    ALA  12           HN       ALA  12  50.156   8.791  -1.630
   88    HA   ALA  12           HA       ALA  12  50.744   6.749  -0.799
   89    HB1  ALA  12           HB1      ALA  12  52.999   6.258  -0.401
   90    HB2  ALA  12           HB2      ALA  12  53.297   7.972  -0.122
   91    HB3  ALA  12           HB3      ALA  12  52.993   7.397  -1.764
   92    H    ALA  13           HN       ALA  13  51.816   9.725   0.741
   93    HA   ALA  13           HA       ALA  13  51.600   8.655   3.458
   94    HB1  ALA  13           HB1      ALA  13  50.916  11.133   3.891
   95    HB2  ALA  13           HB2      ALA  13  51.304  11.431   2.179
   96    HB3  ALA  13           HB3      ALA  13  52.577  10.894   3.301
   97    H    LYS  14           HN       LYS  14  50.403   8.528   0.523
   98    HA   LYS  14           HA       LYS  14  47.397   8.490   1.385
   99    HB2  LYS  14           HB2      LYS  14  48.400  10.055  -0.462
  100    HB3  LYS  14           HB1      LYS  14  48.698   8.524  -1.363
  101    HG2  LYS  14           HG2      LYS  14  46.445   8.300  -1.911
  102    HG3  LYS  14           HG1      LYS  14  45.877   8.913  -0.343
  103    HD2  LYS  14           HD2      LYS  14  46.297  11.217  -1.039
  104    HD3  LYS  14           HD1      LYS  14  47.031  10.656  -2.562
  105    HE2  LYS  14           HE2      LYS  14  44.580  11.415  -2.700
  106    HE3  LYS  14           HE1      LYS  14  44.942   9.807  -3.372
  107    HZ1  LYS  14           HZ1      LYS  14  44.155   8.785  -1.373
  108    HZ2  LYS  14           HZ2      LYS  14  42.958   9.864  -1.913
  109    HZ3  LYS  14           HZ3      LYS  14  43.956  10.284  -0.604
  110    H    HIS  15           HN       HIS  15  46.362   7.165  -0.613
  111    HA   HIS  15           HA       HIS  15  45.739   4.928  -0.964
  112    HB2  HIS  15           HB2      HIS  15  48.478   5.190  -2.248
  113    HB3  HIS  15           HB1      HIS  15  47.295   3.916  -2.627
  114    HD1  HIS  15           HD1      HIS  15  44.673   5.350  -2.832
  115    HD2  HIS  15           HD2      HIS  15  48.244   7.026  -4.295
  116    HE1  HIS  15           HE1      HIS  15  44.033   7.092  -4.589
  117    H    ILE  16           HN       ILE  16  47.239   5.347   1.587
  118    HA   ILE  16           HA       ILE  16  47.354   2.891   2.570
  119    HB   ILE  16           HB       ILE  16  49.066   2.024   1.104
  120   HG12  ILE  16          HG12      ILE  16  50.520   2.824   3.660
  121   HG13  ILE  16          HG11      ILE  16  49.329   1.511   3.561
  122   HG21  ILE  16          HG21      ILE  16  51.342   3.257   1.012
  123   HG22  ILE  16          HG22      ILE  16  50.508   4.624   1.755
  124   HG23  ILE  16          HG23      ILE  16  50.016   4.058   0.148
  125   HD11  ILE  16           HD1      ILE  16  51.269   0.270   3.220
  126   HD12  ILE  16           HD2      ILE  16  52.138   1.626   2.472
  127   HD13  ILE  16           HD3      ILE  16  50.936   0.712   1.531
  128    H    GLY  17           HN       GLY  17  48.862   5.827   2.339
  129    HA2  GLY  17           HA1      GLY  17  49.306   5.946   5.274
  130    HA3  GLY  17           HA2      GLY  17  49.658   7.228   4.100
  131    H    HIS  18           HN       HIS  18  47.019   6.183   2.769
  132    HA   HIS  18           HA       HIS  18  45.245   8.117   4.219
  133    HB2  HIS  18           HB2      HIS  18  45.219   8.138   1.759
  134    HB3  HIS  18           HB1      HIS  18  44.755   6.426   1.727
  135    HD1  HIS  18           HD1      HIS  18  43.201   8.302   4.497
  136    HD2  HIS  18           HD2      HIS  18  42.322   7.631   0.443
  137    HE1  HIS  18           HE1      HIS  18  40.733   8.861   4.151
  138    H    ALA  19           HN       ALA  19  45.489   4.574   3.500
  139    HA   ALA  19           HA       ALA  19  43.593   4.171   5.813
  140    HB1  ALA  19           HB1      ALA  19  42.188   2.619   4.425
  141    HB2  ALA  19           HB2      ALA  19  43.029   3.244   2.985
  142    HB3  ALA  19           HB3      ALA  19  42.052   4.339   3.994
  143    H    ALA  20           HN       ALA  20  46.483   3.507   5.050
  144    HA   ALA  20           HA       ALA  20  47.900   1.685   5.366
  145    HB1  ALA  20           HB1      ALA  20  46.619   1.738   7.542
  146    HB2  ALA  20           HB2      ALA  20  47.319   0.160   7.107
  147    HB3  ALA  20           HB3      ALA  20  45.579   0.458   6.874
  148    H    VAL  21           HN       VAL  21  45.314   1.575   3.384
  149    HA   VAL  21           HA       VAL  21  46.156  -1.032   2.236
  150    HB   VAL  21           HB       VAL  21  43.227  -0.464   2.893
  151   HG11  VAL  21          HG11      VAL  21  44.687  -2.811   1.604
  152   HG12  VAL  21          HG12      VAL  21  43.477  -1.751   0.843
  153   HG13  VAL  21          HG13      VAL  21  42.991  -2.870   2.137
  154   HG21  VAL  21          HG21      VAL  21  43.523  -2.499   4.401
  155   HG22  VAL  21          HG22      VAL  21  44.359  -1.033   4.959
  156   HG23  VAL  21          HG23      VAL  21  45.278  -2.333   4.162
  157    H    ASN  22           HN       ASN  22  44.350   2.008   2.092
  158    HA   ASN  22           HA       ASN  22  45.073   2.724  -0.492
  159    HB2  ASN  22           HB2      ASN  22  42.928   0.645  -0.496
  160    HB3  ASN  22           HB1      ASN  22  42.551   2.071  -1.482
  161   HD21  ASN  22          HD21      ASN  22  42.718   0.429  -3.323
  162   HD22  ASN  22          HD22      ASN  22  44.327   0.110  -3.979
  163    H    HIS  23           HN       HIS  23  41.718   2.398   0.708
  164    HA   HIS  23           HA       HIS  23  41.685   5.106   1.796
  165    HB2  HIS  23           HB2      HIS  23  40.042   6.022   0.196
  166    HB3  HIS  23           HB1      HIS  23  41.582   5.636  -0.612
  167    HD1  HIS  23           HD1      HIS  23  40.346   2.412  -0.081
  168    HD2  HIS  23           HD2      HIS  23  39.205   5.498  -2.700
  169    HE1  HIS  23           HE1      HIS  23  39.002   1.345  -1.976
  170    H    TYR  24           HN       TYR  24  41.004   2.205   2.353
  171    HA   TYR  24           HA       TYR  24  38.250   1.707   2.406
  172    HB2  TYR  24           HB2      TYR  24  40.032   0.127   3.156
  173    HB3  TYR  24           HB1      TYR  24  40.226   1.093   4.639
  174    HD1  TYR  24           HD1      TYR  24  38.496   1.115   6.373
  175    HD2  TYR  24           HD2      TYR  24  37.985  -1.182   2.755
  176    HE1  TYR  24           HE1      TYR  24  36.588  -0.102   7.415
  177    HE2  TYR  24           HE2      TYR  24  36.077  -2.399   3.798
  178    HH   TYR  24           HH       TYR  24  34.757  -2.575   5.601
  179    H    LEU  25           HN       LEU  25  40.117   4.001   4.289
  180    HA   LEU  25           HA       LEU  25  38.445   4.405   6.508
  181    HB2  LEU  25           HB2      LEU  25  40.701   5.552   5.751
  182    HB3  LEU  25           HB1      LEU  25  39.632   6.771   5.023
  183    HG   LEU  25           HG       LEU  25  39.641   5.902   7.954
  184   HD11  LEU  25          HD11      LEU  25  41.580   7.320   7.147
  185   HD12  LEU  25          HD12      LEU  25  40.579   8.095   8.398
  186   HD13  LEU  25          HD13      LEU  25  40.400   8.573   6.693
  187   HD21  LEU  25          HD21      LEU  25  37.879   7.795   6.346
  188   HD22  LEU  25          HD22      LEU  25  38.114   8.024   8.096
  189   HD23  LEU  25          HD23      LEU  25  37.393   6.517   7.487
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1  71.893  15.246  -2.973
    2    H2   GLY   1           HT2      GLY   1  70.862  16.172  -3.955
    3    H3   GLY   1           HT3      GLY   1  72.052  15.184  -4.659
    4    HA2  GLY   1           HA1      GLY   1  70.751  13.463  -4.689
    5    HA3  GLY   1           HA2      GLY   1  70.421  13.668  -2.957
    6    H    TRP   2           HN       TRP   2  68.317  12.758  -3.971
    7    HA   TRP   2           HA       TRP   2  66.629  14.485  -5.502
    8    HB2  TRP   2           HB2      TRP   2  65.714  12.465  -3.424
    9    HB3  TRP   2           HB1      TRP   2  64.838  13.013  -4.873
   10    HD1  TRP   2           HD1      TRP   2  67.697  10.755  -3.751
   11    HE1  TRP   2           HE1      TRP   2  68.409   9.197  -5.708
   12    HE3  TRP   2           HE3      TRP   2  64.908  12.843  -7.501
   13    HZ2  TRP   2           HZ2      TRP   2  67.827   8.923  -8.514
   14    HZ3  TRP   2           HZ3      TRP   2  65.002  11.917  -9.811
   15    HH2  TRP   2           HH2      TRP   2  66.458   9.961 -10.320
   16    H    GLY   3           HN       GLY   3  64.245  14.545  -3.946
   17    HA2  GLY   3           HA1      GLY   3  64.666  15.953  -1.466
   18    HA3  GLY   3           HA2      GLY   3  64.408  17.100  -2.794
   19    H    SER   4           HN       SER   4  62.879  14.150  -3.418
   20    HA   SER   4           HA       SER   4  60.620  13.636  -3.573
   21    HB2  SER   4           HB2      SER   4  59.378  13.704  -1.488
   22    HB3  SER   4           HB1      SER   4  61.061  13.254  -1.134
   23    HG   SER   4           HG       SER   4  61.440  15.395  -0.522
   24    H    ILE   5           HN       ILE   5  59.757  14.846  -5.185
   25    HA   ILE   5           HA       ILE   5  59.222  17.683  -4.882
   26    HB   ILE   5           HB       ILE   5  57.916  15.816  -6.905
   27   HG12  ILE   5          HG12      ILE   5  60.688  17.098  -6.961
   28   HG13  ILE   5          HG11      ILE   5  60.333  15.357  -6.892
   29   HG21  ILE   5          HG21      ILE   5  58.855  18.697  -7.217
   30   HG22  ILE   5          HG22      ILE   5  57.224  18.285  -6.634
   31   HG23  ILE   5          HG23      ILE   5  57.740  17.783  -8.260
   32   HD11  ILE   5           HD1      ILE   5  58.992  15.744  -9.092
   33   HD12  ILE   5           HD2      ILE   5  60.769  15.765  -9.190
   34   HD13  ILE   5           HD3      ILE   5  59.862  17.295  -9.181
   35    H    PHE   6           HN       PHE   6  58.093  17.438  -2.756
   36    HA   PHE   6           HA       PHE   6  56.138  17.402  -1.502
   37    HB2  PHE   6           HB2      PHE   6  55.044  18.131  -4.246
   38    HB3  PHE   6           HB1      PHE   6  54.055  18.143  -2.766
   39    HD1  PHE   6           HD1      PHE   6  56.918  19.722  -4.529
   40    HD2  PHE   6           HD2      PHE   6  54.404  19.811  -1.021
   41    HE1  PHE   6           HE1      PHE   6  57.803  21.978  -3.952
   42    HE2  PHE   6           HE2      PHE   6  55.290  22.068  -0.444
   43    HZ   PHE   6           HZ       PHE   6  57.048  23.114  -1.865
   44    H    LYS   7           HN       LYS   7  57.074  14.917  -3.007
   45    HA   LYS   7           HA       LYS   7  54.665  13.438  -3.671
   46    HB2  LYS   7           HB2      LYS   7  57.470  12.487  -2.964
   47    HB3  LYS   7           HB1      LYS   7  56.180  11.469  -3.647
   48    HG2  LYS   7           HG2      LYS   7  56.061  12.980  -5.627
   49    HG3  LYS   7           HG1      LYS   7  57.398  13.942  -4.953
   50    HD2  LYS   7           HD2      LYS   7  58.920  12.066  -5.093
   51    HD3  LYS   7           HD1      LYS   7  57.595  10.955  -5.515
   52    HE2  LYS   7           HE2      LYS   7  58.527  13.320  -7.199
   53    HE3  LYS   7           HE1      LYS   7  58.884  11.608  -7.529
   54    HZ1  LYS   7           HZ1      LYS   7  56.450  13.108  -7.967
   55    HZ2  LYS   7           HZ2      LYS   7  56.207  11.595  -7.234
   56    HZ3  LYS   7           HZ3      LYS   7  57.011  11.699  -8.726
   57    H    HIS   8           HN       HIS   8  56.968  13.221  -0.914
   58    HA   HIS   8           HA       HIS   8  55.185  11.482   0.589
   59    HB2  HIS   8           HB2      HIS   8  57.555  13.137   1.548
   60    HB3  HIS   8           HB1      HIS   8  56.801  11.770   2.405
   61    HD1  HIS   8           HD1      HIS   8  59.837  12.044   1.117
   62    HD2  HIS   8           HD2      HIS   8  56.596   9.831  -0.393
   63    HE1  HIS   8           HE1      HIS   8  60.801  10.171  -0.328
   64    H    GLY   9           HN       GLY   9  53.219  12.774   0.415
   65    HA2  GLY   9           HA1      GLY   9  52.539  14.077   2.791
   66    HA3  GLY   9           HA2      GLY   9  53.065  15.365   1.690
   67    H    ARG  10           HN       ARG  10  52.175  14.517  -0.745
   68    HA   ARG  10           HA       ARG  10  49.196  14.657  -0.369
   69    HB2  ARG  10           HB2      ARG  10  50.950  15.306  -2.776
   70    HB3  ARG  10           HB1      ARG  10  49.182  15.498  -2.693
   71    HG2  ARG  10           HG2      ARG  10  49.368  17.152  -0.935
   72    HG3  ARG  10           HG1      ARG  10  51.113  16.847  -0.763
   73    HD2  ARG  10           HD2      ARG  10  51.539  17.718  -3.003
   74    HD3  ARG  10           HD1      ARG  10  49.793  17.893  -3.303
   75    HE   ARG  10           HE       ARG  10  50.285  19.406  -1.003
   76   HH11  ARG  10          HH11      ARG  10  52.366  20.853  -1.194
   77   HH12  ARG  10          HH12      ARG  10  52.334  21.840  -2.618
   78   HH21  ARG  10          HH21      ARG  10  49.840  19.993  -4.163
   79   HH22  ARG  10          HH22      ARG  10  50.904  21.353  -4.298
   80    H    HIS  11           HN       HIS  11  51.553  12.409  -0.820
   81    HA   HIS  11           HA       HIS  11  49.624  10.485  -1.937
   82    HB2  HIS  11           HB2      HIS  11  52.245  11.077  -3.376
   83    HB3  HIS  11           HB1      HIS  11  51.163   9.708  -3.728
   84    HD1  HIS  11           HD1      HIS  11  51.729  13.288  -4.469
   85    HD2  HIS  11           HD2      HIS  11  48.538  10.561  -4.741
   86    HE1  HIS  11           HE1      HIS  11  49.943  14.351  -5.955
   87    H    ALA  12           HN       ALA  12  49.957   8.509  -1.496
   88    HA   ALA  12           HA       ALA  12  50.716   6.641  -0.416
   89    HB1  ALA  12           HB1      ALA  12  52.941   7.482  -1.296
   90    HB2  ALA  12           HB2      ALA  12  52.974   6.476   0.174
   91    HB3  ALA  12           HB3      ALA  12  53.050   8.234   0.285
   92    H    ALA  13           HN       ALA  13  51.297   9.870   0.877
   93    HA   ALA  13           HA       ALA  13  51.004   9.027   3.668
   94    HB1  ALA  13           HB1      ALA  13  50.312  11.619   2.158
   95    HB2  ALA  13           HB2      ALA  13  51.734  11.371   3.199
   96    HB3  ALA  13           HB3      ALA  13  50.103  11.397   3.911
   97    H    LYS  14           HN       LYS  14  50.069   8.499   0.675
   98    HA   LYS  14           HA       LYS  14  47.030   8.140   1.323
   99    HB2  LYS  14           HB2      LYS  14  47.978   9.643  -0.602
  100    HB3  LYS  14           HB1      LYS  14  48.534   8.084  -1.317
  101    HG2  LYS  14           HG2      LYS  14  46.379   7.531  -2.006
  102    HG3  LYS  14           HG1      LYS  14  45.618   8.144  -0.520
  103    HD2  LYS  14           HD2      LYS  14  45.703  10.427  -1.343
  104    HD3  LYS  14           HD1      LYS  14  46.682   9.935  -2.747
  105    HE2  LYS  14           HE2      LYS  14  44.829   8.562  -3.596
  106    HE3  LYS  14           HE1      LYS  14  43.851   8.959  -2.162
  107    HZ1  LYS  14           HZ1      LYS  14  43.332  10.954  -2.992
  108    HZ2  LYS  14           HZ2      LYS  14  43.855  10.346  -4.489
  109    HZ3  LYS  14           HZ3      LYS  14  44.910  11.269  -3.530
  110    H    HIS  15           HN       HIS  15  46.353   6.475  -0.615
  111    HA   HIS  15           HA       HIS  15  46.081   4.154  -0.799
  112    HB2  HIS  15           HB2      HIS  15  48.969   4.421  -1.702
  113    HB3  HIS  15           HB1      HIS  15  47.760   3.241  -2.263
  114    HD1  HIS  15           HD1      HIS  15  49.255   6.367  -3.223
  115    HD2  HIS  15           HD2      HIS  15  45.392   4.729  -3.484
  116    HE1  HIS  15           HE1      HIS  15  47.966   7.731  -4.955
  117    H    ILE  16           HN       ILE  16  47.370   5.120   1.800
  118    HA   ILE  16           HA       ILE  16  47.571   2.786   3.091
  119    HB   ILE  16           HB       ILE  16  49.502   1.973   1.963
  120   HG12  ILE  16          HG12      ILE  16  50.827   3.272   4.367
  121   HG13  ILE  16          HG11      ILE  16  49.523   2.092   4.617
  122   HG21  ILE  16          HG21      ILE  16  50.576   4.797   2.344
  123   HG22  ILE  16          HG22      ILE  16  50.264   3.990   0.797
  124   HG23  ILE  16          HG23      ILE  16  51.604   3.457   1.831
  125   HD11  ILE  16           HD1      ILE  16  51.633   0.902   4.687
  126   HD12  ILE  16           HD2      ILE  16  52.159   1.624   3.150
  127   HD13  ILE  16           HD3      ILE  16  50.814   0.460   3.172
  128    H    GLY  17           HN       GLY  17  48.972   5.766   2.738
  129    HA2  GLY  17           HA1      GLY  17  49.042   6.264   5.639
  130    HA3  GLY  17           HA2      GLY  17  49.348   7.453   4.357
  131    H    HIS  18           HN       HIS  18  46.875   6.025   3.016
  132    HA   HIS  18           HA       HIS  18  44.862   7.860   4.328
  133    HB2  HIS  18           HB2      HIS  18  45.219   6.656   1.599
  134    HB3  HIS  18           HB1      HIS  18  43.542   6.802   2.161
  135    HD1  HIS  18           HD1      HIS  18  46.134   9.320   3.267
  136    HD2  HIS  18           HD2      HIS  18  42.979   9.036   0.504
  137    HE1  HIS  18           HE1      HIS  18  45.726  11.663   2.334
  138    H    ALA  19           HN       ALA  19  45.363   4.404   3.381
  139    HA   ALA  19           HA       ALA  19  44.165   3.294   5.657
  140    HB1  ALA  19           HB1      ALA  19  42.121   4.166   3.610
  141    HB2  ALA  19           HB2      ALA  19  42.012   4.173   5.388
  142    HB3  ALA  19           HB3      ALA  19  41.847   2.647   4.496
  143    H    ALA  20           HN       ALA  20  45.729   3.106   2.852
  144    HA   ALA  20           HA       ALA  20  46.491   1.338   1.551
  145    HB1  ALA  20           HB1      ALA  20  46.814   0.371   3.912
  146    HB2  ALA  20           HB2      ALA  20  46.734  -0.793   2.568
  147    HB3  ALA  20           HB3      ALA  20  45.319  -0.547   3.619
  148    H    VAL  21           HN       VAL  21  43.500   2.237   1.933
  149    HA   VAL  21           HA       VAL  21  42.455   0.481  -0.226
  150    HB   VAL  21           HB       VAL  21  40.941   0.984   2.378
  151   HG11  VAL  21          HG11      VAL  21  39.394  -0.799   1.256
  152   HG12  VAL  21          HG12      VAL  21  40.251  -0.393  -0.248
  153   HG13  VAL  21          HG13      VAL  21  39.335   0.858   0.624
  154   HG21  VAL  21          HG21      VAL  21  42.670  -0.674   2.786
  155   HG22  VAL  21          HG22      VAL  21  42.300  -1.513   1.263
  156   HG23  VAL  21          HG23      VAL  21  41.135  -1.548   2.608
  157    H    ASN  22           HN       ASN  22  42.975   3.373   1.352
  158    HA   ASN  22           HA       ASN  22  42.620   5.519   0.401
  159    HB2  ASN  22           HB2      ASN  22  39.997   4.580  -0.810
  160    HB3  ASN  22           HB1      ASN  22  40.916   6.057  -1.167
  161   HD21  ASN  22          HD21      ASN  22  40.106   3.627  -2.928
  162   HD22  ASN  22          HD22      ASN  22  41.636   3.145  -3.669
  163    H    HIS  23           HN       HIS  23  40.039   3.526   1.732
  164    HA   HIS  23           HA       HIS  23  39.656   5.331   3.950
  165    HB2  HIS  23           HB2      HIS  23  38.474   6.506   1.945
  166    HB3  HIS  23           HB1      HIS  23  37.256   5.218   2.083
  167    HD1  HIS  23           HD1      HIS  23  39.087   6.868   5.008
  168    HD2  HIS  23           HD2      HIS  23  35.228   6.681   3.342
  169    HE1  HIS  23           HE1      HIS  23  37.501   8.056   6.622
  170    H    TYR  24           HN       TYR  24  36.980   4.676   4.597
  171    HA   TYR  24           HA       TYR  24  35.826   2.965   5.652
  172    HB2  TYR  24           HB2      TYR  24  35.509   2.306   3.241
  173    HB3  TYR  24           HB1      TYR  24  36.909   1.219   3.408
  174    HD1  TYR  24           HD1      TYR  24  36.660  -0.939   4.403
  175    HD2  TYR  24           HD2      TYR  24  33.527   1.999   4.840
  176    HE1  TYR  24           HE1      TYR  24  35.179  -2.667   5.416
  177    HE2  TYR  24           HE2      TYR  24  32.048   0.270   5.853
  178    HH   TYR  24           HH       TYR  24  32.551  -1.902   7.242
  179    H    LEU  25           HN       LEU  25  38.970   3.293   5.839
  180    HA   LEU  25           HA       LEU  25  40.626   2.339   7.137
  181    HB2  LEU  25           HB2      LEU  25  38.489   2.269   8.700
  182    HB3  LEU  25           HB1      LEU  25  38.588   0.514   8.448
  183    HG   LEU  25           HG       LEU  25  40.843   2.287   9.500
  184   HD11  LEU  25          HD11      LEU  25  39.107   0.218  10.919
  185   HD12  LEU  25          HD12      LEU  25  38.927   1.983  11.075
  186   HD13  LEU  25          HD13      LEU  25  40.410   1.185  11.651
  187   HD21  LEU  25          HD21      LEU  25  41.783  -0.071  10.090
  188   HD22  LEU  25          HD22      LEU  25  41.880   0.449   8.395
  189   HD23  LEU  25          HD23      LEU  25  40.610  -0.690   8.903
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1  68.272  19.568   0.985
    2    H2   GLY   1           HT2      GLY   1  66.800  20.106   0.329
    3    H3   GLY   1           HT3      GLY   1  67.271  18.483   0.153
    4    HA2  GLY   1           HA1      GLY   1  67.319  19.070   2.852
    5    HA3  GLY   1           HA2      GLY   1  65.791  19.678   2.183
    6    H    TRP   2           HN       TRP   2  64.243  18.261   2.616
    7    HA   TRP   2           HA       TRP   2  64.695  15.468   3.050
    8    HB2  TRP   2           HB2      TRP   2  62.060  16.658   2.123
    9    HB3  TRP   2           HB1      TRP   2  62.335  15.277   3.213
   10    HD1  TRP   2           HD1      TRP   2  63.480  15.899   5.638
   11    HE1  TRP   2           HE1      TRP   2  63.163  17.993   7.149
   12    HE3  TRP   2           HE3      TRP   2  61.584  19.132   2.150
   13    HZ2  TRP   2           HZ2      TRP   2  62.211  20.694   6.850
   14    HZ3  TRP   2           HZ3      TRP   2  60.979  21.463   2.784
   15    HH2  TRP   2           HH2      TRP   2  61.291  22.246   5.129
   16    H    GLY   3           HN       GLY   3  64.455  17.346   0.172
   17    HA2  GLY   3           HA1      GLY   3  64.810  16.647  -2.024
   18    HA3  GLY   3           HA2      GLY   3  64.869  14.961  -1.472
   19    H    SER   4           HN       SER   4  62.184  15.900  -0.035
   20    HA   SER   4           HA       SER   4  60.465  14.903  -2.258
   21    HB2  SER   4           HB2      SER   4  59.752  15.516   0.635
   22    HB3  SER   4           HB1      SER   4  58.777  14.606  -0.541
   23    HG   SER   4           HG       SER   4  59.856  12.942   0.153
   24    H    ILE   5           HN       ILE   5  60.014  16.521  -3.667
   25    HA   ILE   5           HA       ILE   5  59.610  19.261  -2.878
   26    HB   ILE   5           HB       ILE   5  58.441  17.941  -5.363
   27   HG12  ILE   5          HG12      ILE   5  61.280  18.946  -4.853
   28   HG13  ILE   5          HG11      ILE   5  60.800  17.257  -5.145
   29   HG21  ILE   5          HG21      ILE   5  57.900  20.372  -4.706
   30   HG22  ILE   5          HG22      ILE   5  58.598  20.132  -6.322
   31   HG23  ILE   5          HG23      ILE   5  59.621  20.724  -4.991
   32   HD11  ILE   5           HD1      ILE   5  60.771  19.597  -7.081
   33   HD12  ILE   5           HD2      ILE   5  59.786  18.142  -7.378
   34   HD13  ILE   5           HD3      ILE   5  61.558  18.013  -7.264
   35    H    PHE   6           HN       PHE   6  57.390  16.538  -3.524
   36    HA   PHE   6           HA       PHE   6  55.406  17.646  -1.716
   37    HB2  PHE   6           HB2      PHE   6  53.623  18.041  -3.351
   38    HB3  PHE   6           HB1      PHE   6  55.007  19.109  -3.683
   39    HD1  PHE   6           HD1      PHE   6  56.289  18.902  -5.720
   40    HD2  PHE   6           HD2      PHE   6  53.266  15.981  -4.742
   41    HE1  PHE   6           HE1      PHE   6  56.455  17.959  -8.021
   42    HE2  PHE   6           HE2      PHE   6  53.433  15.038  -7.042
   43    HZ   PHE   6           HZ       PHE   6  54.960  16.087  -8.708
   44    H    LYS   7           HN       LYS   7  56.824  15.240  -3.600
   45    HA   LYS   7           HA       LYS   7  54.764  13.359  -4.010
   46    HB2  LYS   7           HB2      LYS   7  57.626  12.806  -3.125
   47    HB3  LYS   7           HB1      LYS   7  56.531  11.656  -3.928
   48    HG2  LYS   7           HG2      LYS   7  56.394  13.169  -5.895
   49    HG3  LYS   7           HG1      LYS   7  57.515  14.297  -5.096
   50    HD2  LYS   7           HD2      LYS   7  59.297  12.663  -5.114
   51    HD3  LYS   7           HD1      LYS   7  58.189  11.381  -5.660
   52    HE2  LYS   7           HE2      LYS   7  58.789  13.908  -7.257
   53    HE3  LYS   7           HE1      LYS   7  59.614  12.351  -7.508
   54    HZ1  LYS   7           HZ1      LYS   7  57.030  13.189  -8.379
   55    HZ2  LYS   7           HZ2      LYS   7  56.927  11.757  -7.469
   56    HZ3  LYS   7           HZ3      LYS   7  57.931  11.827  -8.839
   57    H    HIS   8           HN       HIS   8  57.078  13.286  -1.257
   58    HA   HIS   8           HA       HIS   8  55.199  11.637   0.301
   59    HB2  HIS   8           HB2      HIS   8  57.906  12.862   0.957
   60    HB3  HIS   8           HB1      HIS   8  56.992  11.791   2.046
   61    HD1  HIS   8           HD1      HIS   8  59.189  11.811  -0.972
   62    HD2  HIS   8           HD2      HIS   8  56.665   9.084   1.001
   63    HE1  HIS   8           HE1      HIS   8  59.731   9.482  -1.873
   64    H    GLY   9           HN       GLY   9  53.554  13.496   0.027
   65    HA2  GLY   9           HA1      GLY   9  53.300  14.765   2.601
   66    HA3  GLY   9           HA2      GLY   9  53.792  15.949   1.374
   67    H    ARG  10           HN       ARG  10  52.335  14.205  -0.681
   68    HA   ARG  10           HA       ARG  10  49.497  14.846   0.079
   69    HB2  ARG  10           HB2      ARG  10  50.908  15.670  -2.494
   70    HB3  ARG  10           HB1      ARG  10  49.154  15.778  -2.213
   71    HG2  ARG  10           HG2      ARG  10  49.524  17.303  -0.319
   72    HG3  ARG  10           HG1      ARG  10  51.287  17.157  -0.523
   73    HD2  ARG  10           HD2      ARG  10  51.030  18.055  -2.864
   74    HD3  ARG  10           HD1      ARG  10  49.307  18.335  -2.521
   75    HE   ARG  10           HE       ARG  10  50.745  19.611  -0.455
   76   HH11  ARG  10          HH11      ARG  10  52.803  20.632  -1.984
   77   HH12  ARG  10          HH12      ARG  10  52.135  21.923  -2.928
   78   HH21  ARG  10          HH21      ARG  10  48.852  20.893  -2.493
   79   HH22  ARG  10          HH22      ARG  10  49.898  22.069  -3.215
   80    H    HIS  11           HN       HIS  11  51.632  12.544  -0.672
   81    HA   HIS  11           HA       HIS  11  49.528  10.803  -1.777
   82    HB2  HIS  11           HB2      HIS  11  52.151  10.999  -3.298
   83    HB3  HIS  11           HB1      HIS  11  50.668  10.131  -3.763
   84    HD1  HIS  11           HD1      HIS  11  52.232  13.567  -3.633
   85    HD2  HIS  11           HD2      HIS  11  48.641  11.777  -4.892
   86    HE1  HIS  11           HE1      HIS  11  50.938  15.316  -4.973
   87    H    ALA  12           HN       ALA  12  49.771   8.774  -1.533
   88    HA   ALA  12           HA       ALA  12  50.436   6.797  -0.619
   89    HB1  ALA  12           HB1      ALA  12  52.893   8.182   0.100
   90    HB2  ALA  12           HB2      ALA  12  52.662   7.559  -1.536
   91    HB3  ALA  12           HB3      ALA  12  52.708   6.455  -0.139
   92    H    ALA  13           HN       ALA  13  51.274   9.859   0.915
   93    HA   ALA  13           HA       ALA  13  51.055   8.798   3.635
   94    HB1  ALA  13           HB1      ALA  13  51.876  11.101   3.481
   95    HB2  ALA  13           HB2      ALA  13  50.187  11.222   4.030
   96    HB3  ALA  13           HB3      ALA  13  50.594  11.537   2.325
   97    H    LYS  14           HN       LYS  14  49.956   8.595   0.655
   98    HA   LYS  14           HA       LYS  14  46.931   8.351   1.421
   99    HB2  LYS  14           HB2      LYS  14  47.892   9.959  -0.419
  100    HB3  LYS  14           HB1      LYS  14  48.308   8.435  -1.289
  101    HG2  LYS  14           HG2      LYS  14  46.094   8.098  -1.925
  102    HG3  LYS  14           HG1      LYS  14  45.445   8.561  -0.339
  103    HD2  LYS  14           HD2      LYS  14  44.628  10.165  -1.931
  104    HD3  LYS  14           HD1      LYS  14  45.885  10.993  -0.987
  105    HE2  LYS  14           HE2      LYS  14  47.517  10.246  -2.870
  106    HE3  LYS  14           HE1      LYS  14  46.050   9.901  -3.817
  107    HZ1  LYS  14           HZ1      LYS  14  46.257  12.060  -4.364
  108    HZ2  LYS  14           HZ2      LYS  14  47.180  12.453  -2.992
  109    HZ3  LYS  14           HZ3      LYS  14  45.489  12.333  -2.877
  110    H    HIS  15           HN       HIS  15  46.069   6.896  -0.623
  111    HA   HIS  15           HA       HIS  15  45.651   4.623  -1.003
  112    HB2  HIS  15           HB2      HIS  15  47.068   5.462  -2.871
  113    HB3  HIS  15           HB1      HIS  15  48.511   4.892  -2.001
  114    HD1  HIS  15           HD1      HIS  15  45.126   3.426  -3.127
  115    HD2  HIS  15           HD2      HIS  15  49.139   2.280  -2.621
  116    HE1  HIS  15           HE1      HIS  15  45.346   1.026  -3.975
  117    H    ILE  16           HN       ILE  16  47.150   5.287   1.613
  118    HA   ILE  16           HA       ILE  16  47.223   2.824   2.680
  119    HB   ILE  16           HB       ILE  16  49.051   1.996   1.401
  120   HG12  ILE  16          HG12      ILE  16  50.463   3.061   3.876
  121   HG13  ILE  16          HG11      ILE  16  49.214   1.803   3.992
  122   HG21  ILE  16          HG21      ILE  16  51.222   3.358   1.254
  123   HG22  ILE  16          HG22      ILE  16  50.327   4.711   1.947
  124   HG23  ILE  16          HG23      ILE  16  49.863   4.070   0.363
  125   HD11  ILE  16           HD1      ILE  16  50.641   0.540   2.180
  126   HD12  ILE  16           HD2      ILE  16  51.220   0.561   3.859
  127   HD13  ILE  16           HD3      ILE  16  51.940   1.656   2.661
  128    H    GLY  17           HN       GLY  17  48.845   5.709   2.523
  129    HA2  GLY  17           HA1      GLY  17  49.068   5.961   5.442
  130    HA3  GLY  17           HA2      GLY  17  49.390   7.233   4.247
  131    H    HIS  18           HN       HIS  18  46.776   6.099   2.923
  132    HA   HIS  18           HA       HIS  18  44.955   7.962   4.435
  133    HB2  HIS  18           HB2      HIS  18  45.122   6.859   1.659
  134    HB3  HIS  18           HB1      HIS  18  43.472   6.953   2.305
  135    HD1  HIS  18           HD1      HIS  18  46.112   9.467   3.340
  136    HD2  HIS  18           HD2      HIS  18  42.745   9.247   0.835
  137    HE1  HIS  18           HE1      HIS  18  45.605  11.838   2.536
  138    H    ALA  19           HN       ALA  19  45.200   4.544   3.326
  139    HA   ALA  19           HA       ALA  19  44.237   3.279   5.580
  140    HB1  ALA  19           HB1      ALA  19  42.148   4.307   5.799
  141    HB2  ALA  19           HB2      ALA  19  41.709   2.926   4.772
  142    HB3  ALA  19           HB3      ALA  19  41.960   4.531   4.043
  143    H    ALA  20           HN       ALA  20  45.401   3.290   2.634
  144    HA   ALA  20           HA       ALA  20  45.779   1.667   1.014
  145    HB1  ALA  20           HB1      ALA  20  46.383   0.384   3.132
  146    HB2  ALA  20           HB2      ALA  20  45.909  -0.612   1.735
  147    HB3  ALA  20           HB3      ALA  20  44.755  -0.329   3.062
  148    H    VAL  21           HN       VAL  21  42.974   2.761   1.873
  149    HA   VAL  21           HA       VAL  21  41.466   1.237  -0.205
  150    HB   VAL  21           HB       VAL  21  40.470   1.774   2.632
  151   HG11  VAL  21          HG11      VAL  21  38.452   0.382   1.670
  152   HG12  VAL  21          HG12      VAL  21  39.081   0.875   0.079
  153   HG13  VAL  21          HG13      VAL  21  38.567   2.106   1.258
  154   HG21  VAL  21          HG21      VAL  21  40.247  -0.739   2.681
  155   HG22  VAL  21          HG22      VAL  21  41.929  -0.190   2.523
  156   HG23  VAL  21          HG23      VAL  21  41.057  -0.802   1.098
  157    H    ASN  22           HN       ASN  22  42.527   4.003   1.324
  158    HA   ASN  22           HA       ASN  22  42.297   6.194   0.406
  159    HB2  ASN  22           HB2      ASN  22  39.400   5.592  -0.279
  160    HB3  ASN  22           HB1      ASN  22  40.374   6.991  -0.767
  161   HD21  ASN  22          HD21      ASN  22  42.775   5.858  -1.626
  162   HD22  ASN  22          HD22      ASN  22  42.462   4.786  -2.996
  163    H    HIS  23           HN       HIS  23  39.787   4.510   2.223
  164    HA   HIS  23           HA       HIS  23  40.081   6.349   4.445
  165    HB2  HIS  23           HB2      HIS  23  38.624   7.647   2.768
  166    HB3  HIS  23           HB1      HIS  23  37.365   6.429   3.077
  167    HD1  HIS  23           HD1      HIS  23  35.706   7.450   4.639
  168    HD2  HIS  23           HD2      HIS  23  39.667   8.316   5.755
  169    HE1  HIS  23           HE1      HIS  23  35.609   8.751   6.835
  170    H    TYR  24           HN       TYR  24  37.029   5.762   4.946
  171    HA   TYR  24           HA       TYR  24  35.972   4.207   6.316
  172    HB2  TYR  24           HB2      TYR  24  37.139   2.388   4.174
  173    HB3  TYR  24           HB1      TYR  24  35.884   1.901   5.339
  174    HD1  TYR  24           HD1      TYR  24  33.608   2.782   5.194
  175    HD2  TYR  24           HD2      TYR  24  36.662   4.065   2.427
  176    HE1  TYR  24           HE1      TYR  24  31.861   3.797   3.736
  177    HE2  TYR  24           HE2      TYR  24  34.914   5.080   0.969
  178    HH   TYR  24           HH       TYR  24  32.332   4.538   0.594
  179    H    LEU  25           HN       LEU  25  38.731   4.900   7.056
  180    HA   LEU  25           HA       LEU  25  40.362   2.763   7.772
  181    HB2  LEU  25           HB2      LEU  25  41.312   4.169   9.442
  182    HB3  LEU  25           HB1      LEU  25  40.739   5.259   8.163
  183    HG   LEU  25           HG       LEU  25  39.398   4.679  10.842
  184   HD11  LEU  25          HD11      LEU  25  40.482   7.217   9.542
  185   HD12  LEU  25          HD12      LEU  25  41.248   6.312  10.870
  186   HD13  LEU  25          HD13      LEU  25  39.687   7.127  11.131
  187   HD21  LEU  25          HD21      LEU  25  37.719   6.443   9.977
  188   HD22  LEU  25          HD22      LEU  25  37.578   4.814   9.281
  189   HD23  LEU  25          HD23      LEU  25  38.371   6.112   8.356
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1  65.858  20.017  -1.941
    2    H2   GLY   1           HT2      GLY   1  67.113  20.081  -3.084
    3    H3   GLY   1           HT3      GLY   1  67.406  20.520  -1.469
    4    HA2  GLY   1           HA1      GLY   1  68.293  18.359  -1.981
    5    HA3  GLY   1           HA2      GLY   1  67.038  18.318  -0.726
    6    H    TRP   2           HN       TRP   2  65.520  16.827  -0.928
    7    HA   TRP   2           HA       TRP   2  65.424  14.979  -3.054
    8    HB2  TRP   2           HB2      TRP   2  63.076  14.489  -2.185
    9    HB3  TRP   2           HB1      TRP   2  64.376  14.428  -0.971
   10    HD1  TRP   2           HD1      TRP   2  61.448  16.609  -2.137
   11    HE1  TRP   2           HE1      TRP   2  60.816  18.291  -0.257
   12    HE3  TRP   2           HE3      TRP   2  65.293  15.670   1.111
   13    HZ2  TRP   2           HZ2      TRP   2  61.863  19.098   2.302
   14    HZ3  TRP   2           HZ3      TRP   2  65.455  16.908   3.266
   15    HH2  TRP   2           HH2      TRP   2  63.747  18.618   3.863
   16    H    GLY   3           HN       GLY   3  64.567  14.930  -5.037
   17    HA2  GLY   3           HA1      GLY   3  63.597  17.358  -6.229
   18    HA3  GLY   3           HA2      GLY   3  63.588  15.746  -6.969
   19    H    SER   4           HN       SER   4  62.033  14.730  -4.559
   20    HA   SER   4           HA       SER   4  59.458  14.788  -5.692
   21    HB2  SER   4           HB2      SER   4  60.324  14.427  -2.801
   22    HB3  SER   4           HB1      SER   4  58.669  14.139  -3.382
   23    HG   SER   4           HG       SER   4  59.465  12.226  -3.810
   24    H    ILE   5           HN       ILE   5  58.728  16.788  -6.332
   25    HA   ILE   5           HA       ILE   5  58.768  19.095  -4.584
   26    HB   ILE   5           HB       ILE   5  56.875  18.649  -6.930
   27   HG12  ILE   5          HG12      ILE   5  59.803  19.514  -6.924
   28   HG13  ILE   5          HG11      ILE   5  59.138  18.037  -7.657
   29   HG21  ILE   5          HG21      ILE   5  58.267  21.186  -5.979
   30   HG22  ILE   5          HG22      ILE   5  56.671  20.685  -5.375
   31   HG23  ILE   5          HG23      ILE   5  56.893  21.043  -7.101
   32   HD11  ILE   5           HD1      ILE   5  58.766  20.920  -8.533
   33   HD12  ILE   5           HD2      ILE   5  57.621  19.652  -9.039
   34   HD13  ILE   5           HD3      ILE   5  59.340  19.533  -9.487
   35    H    PHE   6           HN       PHE   6  56.609  16.375  -5.053
   36    HA   PHE   6           HA       PHE   6  55.077  17.166  -2.682
   37    HB2  PHE   6           HB2      PHE   6  52.860  17.048  -3.963
   38    HB3  PHE   6           HB1      PHE   6  53.824  18.526  -4.189
   39    HD1  PHE   6           HD1      PHE   6  54.581  19.161  -6.359
   40    HD2  PHE   6           HD2      PHE   6  53.099  15.162  -5.694
   41    HE1  PHE   6           HE1      PHE   6  54.662  18.724  -8.810
   42    HE2  PHE   6           HE2      PHE   6  53.180  14.726  -8.147
   43    HZ   PHE   6           HZ       PHE   6  54.047  16.476  -9.693
   44    H    LYS   7           HN       LYS   7  56.261  14.961  -4.965
   45    HA   LYS   7           HA       LYS   7  54.437  12.802  -4.783
   46    HB2  LYS   7           HB2      LYS   7  56.530  12.994  -6.236
   47    HB3  LYS   7           HB1      LYS   7  57.463  12.508  -4.801
   48    HG2  LYS   7           HG2      LYS   7  55.870  10.483  -4.643
   49    HG3  LYS   7           HG1      LYS   7  55.325  10.919  -6.278
   50    HD2  LYS   7           HD2      LYS   7  58.182  10.255  -5.438
   51    HD3  LYS   7           HD1      LYS   7  57.106   9.233  -6.420
   52    HE2  LYS   7           HE2      LYS   7  58.396  11.880  -7.160
   53    HE3  LYS   7           HE1      LYS   7  58.486  10.324  -8.014
   54    HZ1  LYS   7           HZ1      LYS   7  56.078  10.524  -8.446
   55    HZ2  LYS   7           HZ2      LYS   7  56.983  11.771  -9.163
   56    HZ3  LYS   7           HZ3      LYS   7  56.091  12.070  -7.749
   57    H    HIS   8           HN       HIS   8  56.810  14.037  -2.497
   58    HA   HIS   8           HA       HIS   8  55.952  11.914  -0.525
   59    HB2  HIS   8           HB2      HIS   8  58.335  11.678  -1.287
   60    HB3  HIS   8           HB1      HIS   8  58.651  13.315  -0.662
   61    HD1  HIS   8           HD1      HIS   8  59.836  13.107   1.522
   62    HD2  HIS   8           HD2      HIS   8  56.709  10.321   1.147
   63    HE1  HIS   8           HE1      HIS   8  59.713  11.802   3.714
   64    H    GLY   9           HN       GLY   9  54.395  14.113  -0.760
   65    HA2  GLY   9           HA1      GLY   9  54.913  15.468   1.830
   66    HA3  GLY   9           HA2      GLY   9  54.813  16.505   0.390
   67    H    ARG  10           HN       ARG  10  52.901  14.083  -0.490
   68    HA   ARG  10           HA       ARG  10  50.558  14.493   1.166
   69    HB2  ARG  10           HB2      ARG  10  49.195  15.653  -0.606
   70    HB3  ARG  10           HB1      ARG  10  50.451  16.674   0.130
   71    HG2  ARG  10           HG2      ARG  10  51.935  16.323  -1.771
   72    HG3  ARG  10           HG1      ARG  10  50.805  15.146  -2.485
   73    HD2  ARG  10           HD2      ARG  10  50.254  18.108  -2.008
   74    HD3  ARG  10           HD1      ARG  10  50.538  17.330  -3.583
   75    HE   ARG  10           HE       ARG  10  48.380  15.947  -2.430
   76   HH11  ARG  10          HH11      ARG  10  46.338  17.052  -1.934
   77   HH12  ARG  10          HH12      ARG  10  45.954  18.426  -2.919
   78   HH21  ARG  10          HH21      ARG  10  49.119  18.639  -4.318
   79   HH22  ARG  10          HH22      ARG  10  47.529  19.323  -4.267
   80    H    HIS  11           HN       HIS  11  52.282  12.469  -0.283
   81    HA   HIS  11           HA       HIS  11  49.997  10.888  -1.352
   82    HB2  HIS  11           HB2      HIS  11  52.548  11.470  -2.909
   83    HB3  HIS  11           HB1      HIS  11  51.410  10.161  -3.312
   84    HD1  HIS  11           HD1      HIS  11  48.743  11.706  -2.678
   85    HD2  HIS  11           HD2      HIS  11  51.884  13.151  -5.071
   86    HE1  HIS  11           HE1      HIS  11  47.771  13.507  -4.207
   87    H    ALA  12           HN       ALA  12  50.146   8.826  -1.277
   88    HA   ALA  12           HA       ALA  12  50.739   6.747  -0.532
   89    HB1  ALA  12           HB1      ALA  12  53.248   7.972   0.292
   90    HB2  ALA  12           HB2      ALA  12  53.000   7.495  -1.392
   91    HB3  ALA  12           HB3      ALA  12  52.995   6.279  -0.088
   92    H    ALA  13           HN       ALA  13  51.709   9.646   1.225
   93    HA   ALA  13           HA       ALA  13  51.428   8.388   3.857
   94    HB1  ALA  13           HB1      ALA  13  51.066  11.244   2.780
   95    HB2  ALA  13           HB2      ALA  13  52.376  10.663   3.835
   96    HB3  ALA  13           HB3      ALA  13  50.717  10.801   4.467
   97    H    LYS  14           HN       LYS  14  50.329   8.461   0.876
   98    HA   LYS  14           HA       LYS  14  47.294   8.318   1.619
   99    HB2  LYS  14           HB2      LYS  14  48.332  10.000  -0.095
  100    HB3  LYS  14           HB1      LYS  14  48.693   8.527  -1.071
  101    HG2  LYS  14           HG2      LYS  14  46.472   8.316  -1.733
  102    HG3  LYS  14           HG1      LYS  14  45.830   8.756  -0.135
  103    HD2  LYS  14           HD2      LYS  14  46.136  11.121  -0.592
  104    HD3  LYS  14           HD1      LYS  14  47.008  10.764  -2.103
  105    HE2  LYS  14           HE2      LYS  14  44.520  11.405  -2.331
  106    HE3  LYS  14           HE1      LYS  14  45.041   9.920  -3.164
  107    HZ1  LYS  14           HZ1      LYS  14  42.991   9.579  -1.922
  108    HZ2  LYS  14           HZ2      LYS  14  43.756  10.046  -0.479
  109    HZ3  LYS  14           HZ3      LYS  14  44.243   8.631  -1.283
  110    H    HIS  15           HN       HIS  15  46.371   7.063  -0.520
  111    HA   HIS  15           HA       HIS  15  45.831   4.845  -1.047
  112    HB2  HIS  15           HB2      HIS  15  48.675   5.155  -2.077
  113    HB3  HIS  15           HB1      HIS  15  47.503   3.937  -2.636
  114    HD1  HIS  15           HD1      HIS  15  44.931   5.607  -2.794
  115    HD2  HIS  15           HD2      HIS  15  48.660   7.029  -4.117
  116    HE1  HIS  15           HE1      HIS  15  44.480   7.431  -4.527
  117    H    ILE  16           HN       ILE  16  47.315   5.225   1.597
  118    HA   ILE  16           HA       ILE  16  47.303   2.688   2.467
  119    HB   ILE  16           HB       ILE  16  49.108   1.915   1.121
  120   HG12  ILE  16          HG12      ILE  16  50.920   1.407   2.708
  121   HG13  ILE  16          HG11      ILE  16  50.315   2.645   3.826
  122   HG21  ILE  16          HG21      ILE  16  51.344   3.169   1.152
  123   HG22  ILE  16          HG22      ILE  16  50.484   4.502   1.929
  124   HG23  ILE  16          HG23      ILE  16  50.039   4.010   0.284
  125   HD11  ILE  16           HD1      ILE  16  49.599   0.232   4.322
  126   HD12  ILE  16           HD2      ILE  16  48.601   0.322   2.851
  127   HD13  ILE  16           HD3      ILE  16  48.278   1.417   4.216
  128    H    GLY  17           HN       GLY  17  49.032   5.513   2.550
  129    HA2  GLY  17           HA1      GLY  17  49.183   5.550   5.486
  130    HA3  GLY  17           HA2      GLY  17  49.582   6.892   4.394
  131    H    HIS  18           HN       HIS  18  46.983   5.956   2.915
  132    HA   HIS  18           HA       HIS  18  45.157   7.736   4.527
  133    HB2  HIS  18           HB2      HIS  18  45.407   6.940   1.652
  134    HB3  HIS  18           HB1      HIS  18  43.739   7.069   2.238
  135    HD1  HIS  18           HD1      HIS  18  43.373   9.213   0.767
  136    HD2  HIS  18           HD2      HIS  18  46.363   9.604   3.698
  137    HE1  HIS  18           HE1      HIS  18  43.886  11.705   1.004
  138    H    ALA  19           HN       ALA  19  45.216   4.449   2.984
  139    HA   ALA  19           HA       ALA  19  43.972   3.122   5.141
  140    HB1  ALA  19           HB1      ALA  19  42.005   4.484   3.288
  141    HB2  ALA  19           HB2      ALA  19  41.940   4.297   5.058
  142    HB3  ALA  19           HB3      ALA  19  41.583   2.912   4.008
  143    H    ALA  20           HN       ALA  20  45.531   3.151   2.359
  144    HA   ALA  20           HA       ALA  20  46.063   1.530   0.780
  145    HB1  ALA  20           HB1      ALA  20  46.235   0.172   2.951
  146    HB2  ALA  20           HB2      ALA  20  45.995  -0.750   1.447
  147    HB3  ALA  20           HB3      ALA  20  44.626  -0.472   2.550
  148    H    VAL  21           HN       VAL  21  43.206   2.749   1.300
  149    HA   VAL  21           HA       VAL  21  41.962   1.455  -1.075
  150    HB   VAL  21           HB       VAL  21  40.549   1.794   1.613
  151   HG11  VAL  21          HG11      VAL  21  38.909   2.272  -0.036
  152   HG12  VAL  21          HG12      VAL  21  38.693   0.534   0.251
  153   HG13  VAL  21          HG13      VAL  21  39.582   1.092  -1.185
  154   HG21  VAL  21          HG21      VAL  21  41.967  -0.191   1.620
  155   HG22  VAL  21          HG22      VAL  21  41.376  -0.672   0.012
  156   HG23  VAL  21          HG23      VAL  21  40.284  -0.719   1.415
  157    H    ASN  22           HN       ASN  22  42.864   4.019   0.845
  158    HA   ASN  22           HA       ASN  22  42.843   6.296   0.162
  159    HB2  ASN  22           HB2      ASN  22  40.114   5.902  -1.113
  160    HB3  ASN  22           HB1      ASN  22  41.231   7.270  -1.295
  161   HD21  ASN  22          HD21      ASN  22  40.083   5.125  -3.288
  162   HD22  ASN  22          HD22      ASN  22  41.537   4.574  -4.129
  163    H    HIS  23           HN       HIS  23  39.992   4.559   1.286
  164    HA   HIS  23           HA       HIS  23  39.827   6.340   3.628
  165    HB2  HIS  23           HB2      HIS  23  37.454   6.138   1.728
  166    HB3  HIS  23           HB1      HIS  23  37.520   7.035   3.264
  167    HD1  HIS  23           HD1      HIS  23  38.627   7.153  -0.336
  168    HD2  HIS  23           HD2      HIS  23  39.070   9.445   3.163
  169    HE1  HIS  23           HE1      HIS  23  39.601   9.413  -1.024
  170    H    TYR  24           HN       TYR  24  37.191   5.633   4.383
  171    HA   TYR  24           HA       TYR  24  36.138   3.933   5.554
  172    HB2  TYR  24           HB2      TYR  24  37.173   2.182   3.290
  173    HB3  TYR  24           HB1      TYR  24  35.815   1.818   4.381
  174    HD1  TYR  24           HD1      TYR  24  36.864   3.593   1.370
  175    HD2  TYR  24           HD2      TYR  24  33.775   3.331   4.375
  176    HE1  TYR  24           HE1      TYR  24  35.309   4.852  -0.116
  177    HE2  TYR  24           HE2      TYR  24  32.222   4.590   2.888
  178    HH   TYR  24           HH       TYR  24  32.861   5.219  -0.395
  179    H    LEU  25           HN       LEU  25  39.113   4.483   5.910
  180    HA   LEU  25           HA       LEU  25  40.878   3.589   7.113
  181    HB2  LEU  25           HB2      LEU  25  39.302   3.598   8.935
  182    HB3  LEU  25           HB1      LEU  25  38.516   2.118   8.346
  183    HG   LEU  25           HG       LEU  25  40.455   0.772   8.897
  184   HD11  LEU  25          HD11      LEU  25  42.448   1.964  10.051
  185   HD12  LEU  25          HD12      LEU  25  41.797   3.467   9.353
  186   HD13  LEU  25          HD13      LEU  25  42.315   2.138   8.286
  187   HD21  LEU  25          HD21      LEU  25  39.891   2.787  11.120
  188   HD22  LEU  25          HD22      LEU  25  40.614   1.175  11.344
  189   HD23  LEU  25          HD23      LEU  25  38.937   1.326  10.767
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1  63.445  23.560  -0.273
    2    H2   GLY   1           HT2      GLY   1  63.041  22.136  -1.107
    3    H3   GLY   1           HT3      GLY   1  63.770  23.430  -1.932
    4    HA2  GLY   1           HA1      GLY   1  65.757  23.180  -0.653
    5    HA3  GLY   1           HA2      GLY   1  64.996  21.837   0.222
    6    H    TRP   2           HN       TRP   2  64.530  19.874  -0.879
    7    HA   TRP   2           HA       TRP   2  66.592  19.078  -2.696
    8    HB2  TRP   2           HB2      TRP   2  65.363  17.521  -1.203
    9    HB3  TRP   2           HB1      TRP   2  63.896  17.763  -2.181
   10    HD1  TRP   2           HD1      TRP   2  63.697  16.465  -4.406
   11    HE1  TRP   2           HE1      TRP   2  65.154  14.709  -5.654
   12    HE3  TRP   2           HE3      TRP   2  67.975  16.837  -1.619
   13    HZ2  TRP   2           HZ2      TRP   2  67.817  13.633  -5.443
   14    HZ3  TRP   2           HZ3      TRP   2  69.961  15.436  -2.160
   15    HH2  TRP   2           HH2      TRP   2  69.886  13.836  -4.067
   16    H    GLY   3           HN       GLY   3  63.068  19.026  -3.383
   17    HA2  GLY   3           HA1      GLY   3  63.036  20.697  -5.620
   18    HA3  GLY   3           HA2      GLY   3  63.541  19.113  -6.239
   19    H    SER   4           HN       SER   4  61.950  17.784  -4.029
   20    HA   SER   4           HA       SER   4  59.595  17.265  -5.542
   21    HB2  SER   4           HB2      SER   4  58.841  16.018  -3.640
   22    HB3  SER   4           HB1      SER   4  60.609  15.847  -3.685
   23    HG   SER   4           HG       SER   4  60.752  16.976  -1.899
   24    H    ILE   5           HN       ILE   5  57.843  18.446  -5.905
   25    HA   ILE   5           HA       ILE   5  57.440  20.971  -4.548
   26    HB   ILE   5           HB       ILE   5  55.307  19.507  -6.158
   27   HG12  ILE   5          HG12      ILE   5  57.738  21.052  -7.176
   28   HG13  ILE   5          HG11      ILE   5  57.395  19.325  -7.437
   29   HG21  ILE   5          HG21      ILE   5  54.508  21.698  -6.653
   30   HG22  ILE   5          HG22      ILE   5  56.029  22.466  -6.137
   31   HG23  ILE   5          HG23      ILE   5  54.931  21.764  -4.927
   32   HD11  ILE   5           HD1      ILE   5  56.685  20.394  -9.445
   33   HD12  ILE   5           HD2      ILE   5  55.913  21.730  -8.557
   34   HD13  ILE   5           HD3      ILE   5  55.184  20.106  -8.534
   35    H    PHE   6           HN       PHE   6  55.662  17.848  -4.516
   36    HA   PHE   6           HA       PHE   6  55.006  18.209  -1.684
   37    HB2  PHE   6           HB2      PHE   6  52.849  18.482  -3.815
   38    HB3  PHE   6           HB1      PHE   6  52.489  18.021  -2.136
   39    HD1  PHE   6           HD1      PHE   6  53.674  19.578  -0.289
   40    HD2  PHE   6           HD2      PHE   6  52.781  20.787  -4.339
   41    HE1  PHE   6           HE1      PHE   6  53.738  21.968   0.408
   42    HE2  PHE   6           HE2      PHE   6  52.847  23.176  -3.637
   43    HZ   PHE   6           HZ       PHE   6  53.338  23.767  -1.268
   44    H    LYS   7           HN       LYS   7  55.613  16.409  -4.420
   45    HA   LYS   7           HA       LYS   7  54.028  14.073  -4.062
   46    HB2  LYS   7           HB2      LYS   7  56.787  14.582  -5.215
   47    HB3  LYS   7           HB1      LYS   7  56.139  12.928  -5.118
   48    HG2  LYS   7           HG2      LYS   7  55.674  14.029  -7.321
   49    HG3  LYS   7           HG1      LYS   7  54.191  13.564  -6.455
   50    HD2  LYS   7           HD2      LYS   7  53.760  15.819  -5.771
   51    HD3  LYS   7           HD1      LYS   7  55.395  16.352  -6.237
   52    HE2  LYS   7           HE2      LYS   7  53.585  17.000  -7.884
   53    HE3  LYS   7           HE1      LYS   7  54.897  16.027  -8.592
   54    HZ1  LYS   7           HZ1      LYS   7  53.568  14.161  -8.692
   55    HZ2  LYS   7           HZ2      LYS   7  52.452  15.389  -9.056
   56    HZ3  LYS   7           HZ3      LYS   7  52.492  14.707  -7.501
   57    H    HIS   8           HN       HIS   8  57.404  14.648  -2.942
   58    HA   HIS   8           HA       HIS   8  57.283  12.319  -1.174
   59    HB2  HIS   8           HB2      HIS   8  59.378  13.177  -2.293
   60    HB3  HIS   8           HB1      HIS   8  59.319  14.580  -1.200
   61    HD1  HIS   8           HD1      HIS   8  59.909  14.229   1.285
   62    HD2  HIS   8           HD2      HIS   8  59.887  10.665  -0.945
   63    HE1  HIS   8           HE1      HIS   8  61.001  12.422   2.725
   64    H    GLY   9           HN       GLY   9  55.145  14.080  -0.643
   65    HA2  GLY   9           HA1      GLY   9  55.379  14.324   2.193
   66    HA3  GLY   9           HA2      GLY   9  55.621  15.922   1.461
   67    H    ARG  10           HN       ARG  10  53.632  13.666  -0.248
   68    HA   ARG  10           HA       ARG  10  51.127  14.372   1.037
   69    HB2  ARG  10           HB2      ARG  10  51.901  16.501  -0.282
   70    HB3  ARG  10           HB1      ARG  10  51.457  15.576  -1.733
   71    HG2  ARG  10           HG2      ARG  10  49.172  15.209  -0.727
   72    HG3  ARG  10           HG1      ARG  10  49.640  16.275   0.618
   73    HD2  ARG  10           HD2      ARG  10  50.180  18.055  -1.126
   74    HD3  ARG  10           HD1      ARG  10  49.405  16.996  -2.331
   75    HE   ARG  10           HE       ARG  10  48.015  18.660  -0.435
   76   HH11  ARG  10          HH11      ARG  10  46.736  16.670   0.879
   77   HH12  ARG  10          HH12      ARG  10  45.586  15.965  -0.207
   78   HH21  ARG  10          HH21      ARG  10  47.076  17.269  -3.053
   79   HH22  ARG  10          HH22      ARG  10  45.778  16.304  -2.432
   80    H    HIS  11           HN       HIS  11  52.587  12.032   0.170
   81    HA   HIS  11           HA       HIS  11  50.407  10.742  -1.304
   82    HB2  HIS  11           HB2      HIS  11  51.815  11.705  -3.154
   83    HB3  HIS  11           HB1      HIS  11  53.192  10.763  -2.535
   84    HD1  HIS  11           HD1      HIS  11  52.815   8.073  -2.431
   85    HD2  HIS  11           HD2      HIS  11  50.208  10.266  -4.891
   86    HE1  HIS  11           HE1      HIS  11  51.653   6.410  -3.986
   87    H    ALA  12           HN       ALA  12  50.292   8.688  -1.158
   88    HA   ALA  12           HA       ALA  12  50.556   6.574  -0.322
   89    HB1  ALA  12           HB1      ALA  12  52.976   7.031  -0.934
   90    HB2  ALA  12           HB2      ALA  12  52.674   5.855   0.370
   91    HB3  ALA  12           HB3      ALA  12  53.092   7.529   0.745
   92    H    ALA  13           HN       ALA  13  51.671   9.398   1.470
   93    HA   ALA  13           HA       ALA  13  50.969   8.276   4.083
   94    HB1  ALA  13           HB1      ALA  13  52.210  10.456   3.980
   95    HB2  ALA  13           HB2      ALA  13  50.578  10.720   4.642
   96    HB3  ALA  13           HB3      ALA  13  50.932  11.138   2.948
   97    H    LYS  14           HN       LYS  14  50.207   8.371   0.999
   98    HA   LYS  14           HA       LYS  14  47.116   8.593   1.413
   99    HB2  LYS  14           HB2      LYS  14  48.515  10.088  -0.222
  100    HB3  LYS  14           HB1      LYS  14  48.794   8.552  -1.121
  101    HG2  LYS  14           HG2      LYS  14  46.629   8.556  -1.984
  102    HG3  LYS  14           HG1      LYS  14  45.896   9.152  -0.478
  103    HD2  LYS  14           HD2      LYS  14  45.572  10.847  -2.157
  104    HD3  LYS  14           HD1      LYS  14  46.835  11.456  -1.065
  105    HE2  LYS  14           HE2      LYS  14  48.534  10.435  -2.715
  106    HE3  LYS  14           HE1      LYS  14  47.166  10.245  -3.836
  107    HZ1  LYS  14           HZ1      LYS  14  47.981  12.316  -4.379
  108    HZ2  LYS  14           HZ2      LYS  14  48.379  12.719  -2.777
  109    HZ3  LYS  14           HZ3      LYS  14  46.756  12.721  -3.277
  110    H    HIS  15           HN       HIS  15  46.271   7.387  -0.769
  111    HA   HIS  15           HA       HIS  15  45.537   5.231  -1.312
  112    HB2  HIS  15           HB2      HIS  15  47.291   5.942  -2.968
  113    HB3  HIS  15           HB1      HIS  15  48.482   5.010  -2.030
  114    HD1  HIS  15           HD1      HIS  15  45.031   3.602  -2.160
  115    HD2  HIS  15           HD2      HIS  15  48.584   3.242  -4.379
  116    HE1  HIS  15           HE1      HIS  15  44.822   1.499  -3.597
  117    H    ILE  16           HN       ILE  16  46.779   5.528   1.458
  118    HA   ILE  16           HA       ILE  16  46.384   3.053   2.389
  119    HB   ILE  16           HB       ILE  16  48.199   2.001   1.249
  120   HG12  ILE  16          HG12      ILE  16  49.402   2.711   3.953
  121   HG13  ILE  16          HG11      ILE  16  48.013   1.614   3.792
  122   HG21  ILE  16          HG21      ILE  16  49.456   3.950   0.449
  123   HG22  ILE  16          HG22      ILE  16  50.562   2.997   1.456
  124   HG23  ILE  16          HG23      ILE  16  49.799   4.444   2.118
  125   HD11  ILE  16           HD1      ILE  16  49.576   0.344   2.053
  126   HD12  ILE  16           HD2      ILE  16  49.815   0.105   3.797
  127   HD13  ILE  16           HD3      ILE  16  50.882   1.204   2.901
  128    H    GLY  17           HN       GLY  17  48.395   5.680   2.556
  129    HA2  GLY  17           HA1      GLY  17  48.326   5.761   5.500
  130    HA3  GLY  17           HA2      GLY  17  48.991   7.008   4.426
  131    H    HIS  18           HN       HIS  18  46.402   6.347   2.756
  132    HA   HIS  18           HA       HIS  18  44.715   8.415   4.172
  133    HB2  HIS  18           HB2      HIS  18  45.054   7.466   1.347
  134    HB3  HIS  18           HB1      HIS  18  43.384   7.848   1.810
  135    HD1  HIS  18           HD1      HIS  18  46.298   9.720   3.346
  136    HD2  HIS  18           HD2      HIS  18  43.297  10.329   0.466
  137    HE1  HIS  18           HE1      HIS  18  46.361  12.189   2.689
  138    H    ALA  19           HN       ALA  19  44.580   5.069   2.839
  139    HA   ALA  19           HA       ALA  19  43.113   3.869   4.844
  140    HB1  ALA  19           HB1      ALA  19  41.199   5.206   4.863
  141    HB2  ALA  19           HB2      ALA  19  40.703   3.990   3.667
  142    HB3  ALA  19           HB3      ALA  19  41.313   5.573   3.125
  143    H    ALA  20           HN       ALA  20  44.682   3.821   2.104
  144    HA   ALA  20           HA       ALA  20  45.041   2.229   0.453
  145    HB1  ALA  20           HB1      ALA  20  45.041   0.764   2.543
  146    HB2  ALA  20           HB2      ALA  20  44.677  -0.060   1.008
  147    HB3  ALA  20           HB3      ALA  20  43.361   0.344   2.134
  148    H    VAL  21           HN       VAL  21  42.309   3.738   0.978
  149    HA   VAL  21           HA       VAL  21  40.993   2.634  -1.464
  150    HB   VAL  21           HB       VAL  21  39.537   3.134   1.176
  151   HG11  VAL  21          HG11      VAL  21  38.615   2.485  -1.651
  152   HG12  VAL  21          HG12      VAL  21  38.032   3.759  -0.552
  153   HG13  VAL  21          HG13      VAL  21  37.616   2.062  -0.240
  154   HG21  VAL  21          HG21      VAL  21  40.139   0.574  -0.378
  155   HG22  VAL  21          HG22      VAL  21  39.033   0.669   1.012
  156   HG23  VAL  21          HG23      VAL  21  40.763   1.013   1.229
  157    H    ASN  22           HN       ASN  22  42.109   5.096   0.518
  158    HA   ASN  22           HA       ASN  22  42.365   7.349  -0.274
  159    HB2  ASN  22           HB2      ASN  22  40.942   6.853  -2.358
  160    HB3  ASN  22           HB1      ASN  22  39.526   7.280  -1.362
  161   HD21  ASN  22          HD21      ASN  22  38.944   9.441  -1.452
  162   HD22  ASN  22          HD22      ASN  22  40.056  10.760  -1.829
  163    H    HIS  23           HN       HIS  23  39.398   5.966   1.060
  164    HA   HIS  23           HA       HIS  23  39.642   7.558   3.458
  165    HB2  HIS  23           HB2      HIS  23  38.768   9.283   1.822
  166    HB3  HIS  23           HB1      HIS  23  37.298   8.293   1.662
  167    HD1  HIS  23           HD1      HIS  23  35.463   9.051   3.159
  168    HD2  HIS  23           HD2      HIS  23  39.248   9.656   4.892
  169    HE1  HIS  23           HE1      HIS  23  35.092  10.144   5.438
  170    H    TYR  24           HN       TYR  24  36.409   7.483   3.125
  171    HA   TYR  24           HA       TYR  24  34.791   6.068   3.998
  172    HB2  TYR  24           HB2      TYR  24  36.493   3.990   2.563
  173    HB3  TYR  24           HB1      TYR  24  34.843   3.718   3.171
  174    HD1  TYR  24           HD1      TYR  24  32.908   4.734   2.084
  175    HD2  TYR  24           HD2      TYR  24  36.910   5.538   0.682
  176    HE1  TYR  24           HE1      TYR  24  31.978   5.733  -0.001
  177    HE2  TYR  24           HE2      TYR  24  35.979   6.538  -1.403
  178    HH   TYR  24           HH       TYR  24  34.084   7.266  -2.417
  179    H    LEU  25           HN       LEU  25  37.665   6.354   5.302
  180    HA   LEU  25           HA       LEU  25  38.576   5.698   7.324
  181    HB2  LEU  25           HB2      LEU  25  35.999   5.852   7.893
  182    HB3  LEU  25           HB1      LEU  25  36.091   4.080   7.969
  183    HG   LEU  25           HG       LEU  25  37.813   6.036   9.565
  184   HD11  LEU  25          HD11      LEU  25  36.525   5.275  11.491
  185   HD12  LEU  25          HD12      LEU  25  35.634   4.108  10.483
  186   HD13  LEU  25          HD13      LEU  25  35.395   5.856  10.246
  187   HD21  LEU  25          HD21      LEU  25  38.368   3.800  10.802
  188   HD22  LEU  25          HD22      LEU  25  39.165   4.107   9.243
  189   HD23  LEU  25          HD23      LEU  25  37.770   3.000   9.328
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1  63.257  24.826  -5.939
    2    H2   GLY   1           HT2      GLY   1  64.407  23.576  -5.968
    3    H3   GLY   1           HT3      GLY   1  63.964  24.295  -4.494
    4    HA2  GLY   1           HA1      GLY   1  62.383  22.859  -4.209
    5    HA3  GLY   1           HA2      GLY   1  61.655  23.403  -5.733
    6    H    TRP   2           HN       TRP   2  60.971  21.402  -6.421
    7    HA   TRP   2           HA       TRP   2  63.088  19.727  -7.621
    8    HB2  TRP   2           HB2      TRP   2  61.137  18.482  -5.644
    9    HB3  TRP   2           HB1      TRP   2  62.450  17.667  -6.528
   10    HD1  TRP   2           HD1      TRP   2  64.965  18.244  -5.800
   11    HE1  TRP   2           HE1      TRP   2  65.978  19.115  -3.569
   12    HE3  TRP   2           HE3      TRP   2  60.686  19.993  -3.601
   13    HZ2  TRP   2           HZ2      TRP   2  65.028  20.396  -1.171
   14    HZ3  TRP   2           HZ3      TRP   2  60.762  21.036  -1.342
   15    HH2  TRP   2           HH2      TRP   2  62.927  21.239  -0.125
   16    H    GLY   3           HN       GLY   3  60.057  21.139  -7.549
   17    HA2  GLY   3           HA1      GLY   3  58.390  21.126  -9.166
   18    HA3  GLY   3           HA2      GLY   3  59.335  19.947 -10.096
   19    H    SER   4           HN       SER   4  59.064  18.767  -6.999
   20    HA   SER   4           HA       SER   4  57.258  16.666  -7.820
   21    HB2  SER   4           HB2      SER   4  58.350  17.489  -5.105
   22    HB3  SER   4           HB1      SER   4  57.353  16.041  -5.370
   23    HG   SER   4           HG       SER   4  59.989  16.514  -5.955
   24    H    ILE   5           HN       ILE   5  55.113  16.616  -7.850
   25    HA   ILE   5           HA       ILE   5  53.586  18.906  -6.913
   26    HB   ILE   5           HB       ILE   5  52.935  17.581  -8.909
   27   HG12  ILE   5          HG12      ILE   5  50.825  17.452  -6.703
   28   HG13  ILE   5          HG11      ILE   5  51.281  18.929  -7.581
   29   HG21  ILE   5          HG21      ILE   5  51.777  15.361  -7.218
   30   HG22  ILE   5          HG22      ILE   5  53.529  15.321  -7.524
   31   HG23  ILE   5          HG23      ILE   5  52.389  15.327  -8.885
   32   HD11  ILE   5           HD1      ILE   5  50.647  17.865  -9.720
   33   HD12  ILE   5           HD2      ILE   5  49.277  17.866  -8.585
   34   HD13  ILE   5           HD3      ILE   5  50.208  16.373  -8.856
   35    H    PHE   6           HN       PHE   6  54.499  18.747  -4.678
   36    HA   PHE   6           HA       PHE   6  54.200  18.261  -2.431
   37    HB2  PHE   6           HB2      PHE   6  51.434  17.314  -3.264
   38    HB3  PHE   6           HB1      PHE   6  51.940  17.900  -1.662
   39    HD1  PHE   6           HD1      PHE   6  53.007  20.310  -1.597
   40    HD2  PHE   6           HD2      PHE   6  50.501  18.862  -4.801
   41    HE1  PHE   6           HE1      PHE   6  52.509  22.655  -2.268
   42    HE2  PHE   6           HE2      PHE   6  50.003  21.209  -5.471
   43    HZ   PHE   6           HZ       PHE   6  50.923  23.102  -4.138
   44    H    LYS   7           HN       LYS   7  54.517  15.951  -4.702
   45    HA   LYS   7           HA       LYS   7  53.686  13.557  -3.351
   46    HB2  LYS   7           HB2      LYS   7  54.314  13.785  -5.795
   47    HB3  LYS   7           HB1      LYS   7  56.016  13.853  -5.282
   48    HG2  LYS   7           HG2      LYS   7  55.847  11.646  -4.250
   49    HG3  LYS   7           HG1      LYS   7  54.101  11.583  -4.590
   50    HD2  LYS   7           HD2      LYS   7  54.507  11.581  -6.990
   51    HD3  LYS   7           HD1      LYS   7  56.250  11.835  -6.736
   52    HE2  LYS   7           HE2      LYS   7  56.491   9.661  -5.699
   53    HE3  LYS   7           HE1      LYS   7  54.729   9.422  -5.668
   54    HZ1  LYS   7           HZ1      LYS   7  54.841   9.658  -8.166
   55    HZ2  LYS   7           HZ2      LYS   7  55.514   8.238  -7.522
   56    HZ3  LYS   7           HZ3      LYS   7  56.525   9.505  -8.030
   57    H    HIS   8           HN       HIS   8  56.343  15.739  -2.885
   58    HA   HIS   8           HA       HIS   8  58.089  13.801  -1.564
   59    HB2  HIS   8           HB2      HIS   8  58.908  15.887  -2.678
   60    HB3  HIS   8           HB1      HIS   8  58.108  16.839  -1.405
   61    HD1  HIS   8           HD1      HIS   8  59.776  17.571   0.290
   62    HD2  HIS   8           HD2      HIS   8  60.624  13.723  -1.182
   63    HE1  HIS   8           HE1      HIS   8  61.815  16.701   1.561
   64    H    GLY   9           HN       GLY   9  55.126  14.675  -0.684
   65    HA2  GLY   9           HA1      GLY   9  55.329  13.883   1.989
   66    HA3  GLY   9           HA2      GLY   9  55.528  15.646   2.013
   67    H    ARG  10           HN       ARG  10  53.478  13.520  -0.024
   68    HA   ARG  10           HA       ARG  10  51.049  14.166   1.381
   69    HB2  ARG  10           HB2      ARG  10  51.734  16.401   0.185
   70    HB3  ARG  10           HB1      ARG  10  51.206  15.583  -1.303
   71    HG2  ARG  10           HG2      ARG  10  48.980  15.178  -0.306
   72    HG3  ARG  10           HG1      ARG  10  49.505  15.954   1.206
   73    HD2  ARG  10           HD2      ARG  10  49.487  17.330  -1.514
   74    HD3  ARG  10           HD1      ARG  10  48.199  17.492  -0.298
   75    HE   ARG  10           HE       ARG  10  50.632  18.127   1.001
   76   HH11  ARG  10          HH11      ARG  10  50.385  20.368   1.656
   77   HH12  ARG  10          HH12      ARG  10  50.106  21.527   0.399
   78   HH21  ARG  10          HH21      ARG  10  49.536  19.134  -2.045
   79   HH22  ARG  10          HH22      ARG  10  49.627  20.828  -1.696
   80    H    HIS  11           HN       HIS  11  52.436  11.894   0.279
   81    HA   HIS  11           HA       HIS  11  50.177  10.731  -1.180
   82    HB2  HIS  11           HB2      HIS  11  51.465  11.815  -3.034
   83    HB3  HIS  11           HB1      HIS  11  52.891  10.864  -2.555
   84    HD1  HIS  11           HD1      HIS  11  49.177   9.964  -3.080
   85    HD2  HIS  11           HD2      HIS  11  53.017   8.624  -4.149
   86    HE1  HIS  11           HE1      HIS  11  48.880   7.888  -4.541
   87    H    ALA  12           HN       ALA  12  50.084   8.665  -1.249
   88    HA   ALA  12           HA       ALA  12  50.370   6.492  -0.615
   89    HB1  ALA  12           HB1      ALA  12  52.759   7.008  -1.289
   90    HB2  ALA  12           HB2      ALA  12  52.517   5.715  -0.088
   91    HB3  ALA  12           HB3      ALA  12  52.952   7.347   0.422
   92    H    ALA  13           HN       ALA  13  51.576   9.122   1.406
   93    HA   ALA  13           HA       ALA  13  50.982   7.733   3.917
   94    HB1  ALA  13           HB1      ALA  13  50.823  10.706   3.132
   95    HB2  ALA  13           HB2      ALA  13  52.234   9.944   3.906
   96    HB3  ALA  13           HB3      ALA  13  50.692  10.066   4.787
   97    H    LYS  14           HN       LYS  14  50.085   8.152   0.895
   98    HA   LYS  14           HA       LYS  14  47.016   8.334   1.466
   99    HB2  LYS  14           HB2      LYS  14  48.360   9.985  -0.055
  100    HB3  LYS  14           HB1      LYS  14  48.593   8.551  -1.123
  101    HG2  LYS  14           HG2      LYS  14  46.406   8.677  -1.910
  102    HG3  LYS  14           HG1      LYS  14  45.727   9.082  -0.316
  103    HD2  LYS  14           HD2      LYS  14  46.376  11.415  -0.573
  104    HD3  LYS  14           HD1      LYS  14  47.257  11.049  -2.076
  105    HE2  LYS  14           HE2      LYS  14  45.139  10.335  -3.147
  106    HE3  LYS  14           HE1      LYS  14  44.256  10.703  -1.645
  107    HZ1  LYS  14           HZ1      LYS  14  44.763  12.984  -1.853
  108    HZ2  LYS  14           HZ2      LYS  14  44.247  12.490  -3.394
  109    HZ3  LYS  14           HZ3      LYS  14  45.901  12.716  -3.081
  110    H    HIS  15           HN       HIS  15  46.079   7.361  -0.807
  111    HA   HIS  15           HA       HIS  15  45.308   5.270  -1.537
  112    HB2  HIS  15           HB2      HIS  15  46.981   6.123  -3.189
  113    HB3  HIS  15           HB1      HIS  15  48.228   5.147  -2.375
  114    HD1  HIS  15           HD1      HIS  15  48.489   2.791  -3.168
  115    HD2  HIS  15           HD2      HIS  15  44.717   4.381  -4.135
  116    HE1  HIS  15           HE1      HIS  15  47.269   1.050  -4.584
  117    H    ILE  16           HN       ILE  16  46.657   5.281   1.203
  118    HA   ILE  16           HA       ILE  16  46.287   2.721   1.893
  119    HB   ILE  16           HB       ILE  16  48.049   1.801   0.577
  120   HG12  ILE  16          HG12      ILE  16  49.684   0.955   2.204
  121   HG13  ILE  16          HG11      ILE  16  49.193   2.193   3.377
  122   HG21  ILE  16          HG21      ILE  16  49.287   3.808  -0.067
  123   HG22  ILE  16          HG22      ILE  16  50.422   2.743   0.791
  124   HG23  ILE  16          HG23      ILE  16  49.709   4.126   1.627
  125   HD11  ILE  16           HD1      ILE  16  47.228   0.200   2.173
  126   HD12  ILE  16           HD2      ILE  16  46.997   1.235   3.601
  127   HD13  ILE  16           HD3      ILE  16  48.134  -0.130   3.667
  128    H    GLY  17           HN       GLY  17  48.399   5.249   2.262
  129    HA2  GLY  17           HA1      GLY  17  48.410   5.071   5.186
  130    HA3  GLY  17           HA2      GLY  17  49.016   6.428   4.215
  131    H    HIS  18           HN       HIS  18  46.367   5.957   2.601
  132    HA   HIS  18           HA       HIS  18  44.741   7.836   4.315
  133    HB2  HIS  18           HB2      HIS  18  44.948   7.210   1.389
  134    HB3  HIS  18           HB1      HIS  18  43.306   7.547   1.971
  135    HD1  HIS  18           HD1      HIS  18  46.288   9.223   3.590
  136    HD2  HIS  18           HD2      HIS  18  43.344  10.129   0.727
  137    HE1  HIS  18           HE1      HIS  18  46.356  11.746   3.200
  138    H    ALA  19           HN       ALA  19  44.469   4.679   2.562
  139    HA   ALA  19           HA       ALA  19  43.052   3.305   4.534
  140    HB1  ALA  19           HB1      ALA  19  41.162   4.673   4.672
  141    HB2  ALA  19           HB2      ALA  19  40.636   3.545   3.405
  142    HB3  ALA  19           HB3      ALA  19  41.260   5.151   2.961
  143    H    ALA  20           HN       ALA  20  44.602   3.444   1.793
  144    HA   ALA  20           HA       ALA  20  44.965   1.956   0.055
  145    HB1  ALA  20           HB1      ALA  20  43.140  -0.005   1.476
  146    HB2  ALA  20           HB2      ALA  20  44.791   0.336   2.044
  147    HB3  ALA  20           HB3      ALA  20  44.531  -0.345   0.420
  148    H    VAL  21           HN       VAL  21  42.204   3.472   0.674
  149    HA   VAL  21           HA       VAL  21  40.999   2.685  -1.945
  150    HB   VAL  21           HB       VAL  21  39.385   2.920   0.638
  151   HG11  VAL  21          HG11      VAL  21  37.594   1.910  -0.964
  152   HG12  VAL  21          HG12      VAL  21  38.676   2.421  -2.281
  153   HG13  VAL  21          HG13      VAL  21  37.998   3.628  -1.162
  154   HG21  VAL  21          HG21      VAL  21  40.177   0.486  -1.030
  155   HG22  VAL  21          HG22      VAL  21  38.965   0.458   0.273
  156   HG23  VAL  21          HG23      VAL  21  40.662   0.831   0.647
  157    H    ASN  22           HN       ASN  22  42.029   4.875   0.361
  158    HA   ASN  22           HA       ASN  22  42.322   7.208  -0.151
  159    HB2  ASN  22           HB2      ASN  22  40.949   7.001  -2.307
  160    HB3  ASN  22           HB1      ASN  22  39.506   7.285  -1.299
  161   HD21  ASN  22          HD21      ASN  22  39.017   9.428  -0.715
  162   HD22  ASN  22          HD22      ASN  22  40.086  10.793  -1.055
  163    H    HIS  23           HN       HIS  23  39.332   5.672   0.933
  164    HA   HIS  23           HA       HIS  23  39.520   6.938   3.525
  165    HB2  HIS  23           HB2      HIS  23  37.473   8.307   3.420
  166    HB3  HIS  23           HB1      HIS  23  38.690   8.896   2.262
  167    HD1  HIS  23           HD1      HIS  23  38.255   6.735   0.026
  168    HD2  HIS  23           HD2      HIS  23  35.145   8.799   1.962
  169    HE1  HIS  23           HE1      HIS  23  36.238   6.718  -1.543
  170    H    TYR  24           HN       TYR  24  39.065   5.128   4.617
  171    HA   TYR  24           HA       TYR  24  37.333   3.057   3.702
  172    HB2  TYR  24           HB2      TYR  24  39.021   2.732   5.469
  173    HB3  TYR  24           HB1      TYR  24  38.105   3.807   6.551
  174    HD1  TYR  24           HD1      TYR  24  36.027   3.079   7.597
  175    HD2  TYR  24           HD2      TYR  24  38.116   0.516   4.823
  176    HE1  TYR  24           HE1      TYR  24  34.611   1.158   8.307
  177    HE2  TYR  24           HE2      TYR  24  36.699  -1.407   5.533
  178    HH   TYR  24           HH       TYR  24  34.443  -1.732   6.514
  179    H    LEU  25           HN       LEU  25  36.590   6.184   4.743
  180    HA   LEU  25           HA       LEU  25  34.105   5.621   6.129
  181    HB2  LEU  25           HB2      LEU  25  35.487   7.769   6.246
  182    HB3  LEU  25           HB1      LEU  25  34.851   8.158   4.634
  183    HG   LEU  25           HG       LEU  25  32.479   7.696   5.752
  184   HD11  LEU  25          HD11      LEU  25  33.263   6.854   7.912
  185   HD12  LEU  25          HD12      LEU  25  32.477   8.426   8.164
  186   HD13  LEU  25          HD13      LEU  25  34.251   8.311   8.166
  187   HD21  LEU  25          HD21      LEU  25  33.226   9.891   4.895
  188   HD22  LEU  25          HD22      LEU  25  34.131  10.182   6.400
  189   HD23  LEU  25          HD23      LEU  25  32.354  10.082   6.434
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1  71.694  15.234  -3.398
    2    H2   GLY   1           HT2      GLY   1  70.703  13.858  -3.509
    3    H3   GLY   1           HT3      GLY   1  71.242  14.405  -1.992
    4    HA2  GLY   1           HA1      GLY   1  69.277  15.351  -1.861
    5    HA3  GLY   1           HA2      GLY   1  70.054  16.584  -2.873
    6    H    TRP   2           HN       TRP   2  67.590  14.213  -2.627
    7    HA   TRP   2           HA       TRP   2  67.124  13.717  -5.416
    8    HB2  TRP   2           HB2      TRP   2  64.931  13.818  -3.320
    9    HB3  TRP   2           HB1      TRP   2  65.081  12.742  -4.730
   10    HD1  TRP   2           HD1      TRP   2  68.194  11.995  -4.180
   11    HE1  TRP   2           HE1      TRP   2  68.765  10.307  -2.288
   12    HE3  TRP   2           HE3      TRP   2  63.901  12.395  -1.420
   13    HZ2  TRP   2           HZ2      TRP   2  67.505   9.288   0.092
   14    HZ3  TRP   2           HZ3      TRP   2  63.607  11.055   0.658
   15    HH2  TRP   2           HH2      TRP   2  65.402   9.504   1.416
   16    H    GLY   3           HN       GLY   3  64.153  14.548  -4.973
   17    HA2  GLY   3           HA1      GLY   3  64.195  17.447  -5.105
   18    HA3  GLY   3           HA2      GLY   3  64.063  16.713  -6.716
   19    H    SER   4           HN       SER   4  62.755  15.136  -3.867
   20    HA   SER   4           HA       SER   4  60.153  14.879  -5.021
   21    HB2  SER   4           HB2      SER   4  60.879  14.773  -2.070
   22    HB3  SER   4           HB1      SER   4  59.472  14.025  -2.856
   23    HG   SER   4           HG       SER   4  62.110  13.221  -2.755
   24    H    ILE   5           HN       ILE   5  59.364  16.864  -5.713
   25    HA   ILE   5           HA       ILE   5  59.255  19.188  -4.012
   26    HB   ILE   5           HB       ILE   5  57.385  19.883  -5.700
   27   HG12  ILE   5          HG12      ILE   5  58.464  17.443  -7.188
   28   HG13  ILE   5          HG11      ILE   5  56.940  17.402  -6.278
   29   HG21  ILE   5          HG21      ILE   5  59.048  20.360  -7.436
   30   HG22  ILE   5          HG22      ILE   5  60.121  19.089  -6.804
   31   HG23  ILE   5          HG23      ILE   5  59.805  20.551  -5.840
   32   HD11  ILE   5           HD1      ILE   5  57.626  19.034  -8.746
   33   HD12  ILE   5           HD2      ILE   5  56.265  19.486  -7.691
   34   HD13  ILE   5           HD3      ILE   5  56.277  17.905  -8.500
   35    H    PHE   6           HN       PHE   6  58.531  18.137  -2.017
   36    HA   PHE   6           HA       PHE   6  56.886  17.649  -0.458
   37    HB2  PHE   6           HB2      PHE   6  55.204  19.342  -2.349
   38    HB3  PHE   6           HB1      PHE   6  54.755  18.904  -0.683
   39    HD1  PHE   6           HD1      PHE   6  55.858  19.921   1.234
   40    HD2  PHE   6           HD2      PHE   6  57.120  20.853  -2.786
   41    HE1  PHE   6           HE1      PHE   6  57.197  21.837   2.098
   42    HE2  PHE   6           HE2      PHE   6  58.458  22.768  -1.922
   43    HZ   PHE   6           HZ       PHE   6  58.561  23.209   0.528
   44    H    LYS   7           HN       LYS   7  57.229  15.910  -2.916
   45    HA   LYS   7           HA       LYS   7  54.561  14.871  -3.497
   46    HB2  LYS   7           HB2      LYS   7  56.455  14.706  -5.098
   47    HB3  LYS   7           HB1      LYS   7  57.304  13.630  -3.961
   48    HG2  LYS   7           HG2      LYS   7  55.663  11.911  -4.188
   49    HG3  LYS   7           HG1      LYS   7  54.495  13.010  -4.961
   50    HD2  LYS   7           HD2      LYS   7  55.544  11.521  -6.637
   51    HD3  LYS   7           HD1      LYS   7  55.990  13.217  -6.929
   52    HE2  LYS   7           HE2      LYS   7  58.179  12.909  -6.036
   53    HE3  LYS   7           HE1      LYS   7  57.740  11.361  -5.272
   54    HZ1  LYS   7           HZ1      LYS   7  58.434  10.368  -7.111
   55    HZ2  LYS   7           HZ2      LYS   7  58.695  11.853  -7.895
   56    HZ3  LYS   7           HZ3      LYS   7  57.172  11.104  -7.973
   57    H    HIS   8           HN       HIS   8  57.337  13.862  -1.474
   58    HA   HIS   8           HA       HIS   8  55.887  11.513  -0.461
   59    HB2  HIS   8           HB2      HIS   8  57.872  11.292   1.033
   60    HB3  HIS   8           HB1      HIS   8  58.319  11.431  -0.685
   61    HD1  HIS   8           HD1      HIS   8  57.464  14.702  -0.352
   62    HD2  HIS   8           HD2      HIS   8  60.544  12.497   1.477
   63    HE1  HIS   8           HE1      HIS   8  59.241  16.369   0.417
   64    H    GLY   9           HN       GLY   9  54.221  13.602  -0.052
   65    HA2  GLY   9           HA1      GLY   9  53.964  13.576   2.852
   66    HA3  GLY   9           HA2      GLY   9  54.408  15.174   2.220
   67    H    ARG  10           HN       ARG  10  52.916  14.319  -0.348
   68    HA   ARG  10           HA       ARG  10  50.130  14.881   0.683
   69    HB2  ARG  10           HB2      ARG  10  51.475  15.855  -1.872
   70    HB3  ARG  10           HB1      ARG  10  49.776  16.138  -1.422
   71    HG2  ARG  10           HG2      ARG  10  50.436  17.413   0.535
   72    HG3  ARG  10           HG1      ARG  10  52.148  16.987   0.293
   73    HD2  ARG  10           HD2      ARG  10  51.400  19.319  -0.528
   74    HD3  ARG  10           HD1      ARG  10  52.312  18.315  -1.680
   75    HE   ARG  10           HE       ARG  10  49.451  17.906  -1.950
   76   HH11  ARG  10          HH11      ARG  10  51.415  20.647  -2.160
   77   HH12  ARG  10          HH12      ARG  10  50.987  21.033  -3.794
   78   HH21  ARG  10          HH21      ARG  10  49.176  18.117  -4.289
   79   HH22  ARG  10          HH22      ARG  10  49.721  19.601  -4.999
   80    H    HIS  11           HN       HIS  11  51.960  12.472  -0.389
   81    HA   HIS  11           HA       HIS  11  49.670  11.072  -1.564
   82    HB2  HIS  11           HB2      HIS  11  50.657  12.274  -3.548
   83    HB3  HIS  11           HB1      HIS  11  52.183  11.408  -3.248
   84    HD1  HIS  11           HD1      HIS  11  52.415   9.120  -4.247
   85    HD2  HIS  11           HD2      HIS  11  48.398  10.330  -3.969
   86    HE1  HIS  11           HE1      HIS  11  51.004   7.352  -5.434
   87    H    ALA  12           HN       ALA  12  49.752   9.014  -1.559
   88    HA   ALA  12           HA       ALA  12  50.317   6.892  -0.936
   89    HB1  ALA  12           HB1      ALA  12  52.579   6.325  -0.688
   90    HB2  ALA  12           HB2      ALA  12  52.925   8.002  -0.268
   91    HB3  ALA  12           HB3      ALA  12  52.535   7.587  -1.940
   92    H    ALA  13           HN       ALA  13  51.537   9.680   0.848
   93    HA   ALA  13           HA       ALA  13  51.410   8.332   3.446
   94    HB1  ALA  13           HB1      ALA  13  50.694  10.824   4.068
   95    HB2  ALA  13           HB2      ALA  13  51.280  11.210   2.431
   96    HB3  ALA  13           HB3      ALA  13  52.392  10.515   3.635
   97    H    LYS  14           HN       LYS  14  50.084   8.569   0.564
   98    HA   LYS  14           HA       LYS  14  47.114   8.503   1.542
   99    HB2  LYS  14           HB2      LYS  14  48.084  10.215  -0.185
  100    HB3  LYS  14           HB1      LYS  14  48.308   8.770  -1.241
  101    HG2  LYS  14           HG2      LYS  14  46.034   8.663  -1.724
  102    HG3  LYS  14           HG1      LYS  14  45.538   9.079  -0.067
  103    HD2  LYS  14           HD2      LYS  14  45.879  11.438  -0.478
  104    HD3  LYS  14           HD1      LYS  14  46.664  11.110  -2.041
  105    HE2  LYS  14           HE2      LYS  14  44.316  11.826  -2.366
  106    HE3  LYS  14           HE1      LYS  14  44.549  10.146  -2.904
  107    HZ1  LYS  14           HZ1      LYS  14  43.232  11.139  -0.447
  108    HZ2  LYS  14           HZ2      LYS  14  43.831   9.552  -0.534
  109    HZ3  LYS  14           HZ3      LYS  14  42.631  10.070  -1.619
  110    H    HIS  15           HN       HIS  15  45.975   7.379  -0.551
  111    HA   HIS  15           HA       HIS  15  45.301   5.212  -1.122
  112    HB2  HIS  15           HB2      HIS  15  46.707   6.186  -2.988
  113    HB3  HIS  15           HB1      HIS  15  48.075   5.238  -2.361
  114    HD1  HIS  15           HD1      HIS  15  44.704   3.673  -2.029
  115    HD2  HIS  15           HD2      HIS  15  47.815   3.695  -4.856
  116    HE1  HIS  15           HE1      HIS  15  44.317   1.699  -3.604
  117    H    ILE  16           HN       ILE  16  47.026   5.421   1.400
  118    HA   ILE  16           HA       ILE  16  46.964   2.853   2.174
  119    HB   ILE  16           HB       ILE  16  48.609   2.054   0.653
  120   HG12  ILE  16          HG12      ILE  16  50.353   2.615   3.078
  121   HG13  ILE  16          HG11      ILE  16  48.926   1.568   3.236
  122   HG21  ILE  16          HG21      ILE  16  49.560   4.147  -0.184
  123   HG22  ILE  16          HG22      ILE  16  50.901   3.240   0.544
  124   HG23  ILE  16          HG23      ILE  16  50.147   4.561   1.439
  125   HD11  ILE  16           HD1      ILE  16  50.806   0.130   2.785
  126   HD12  ILE  16           HD2      ILE  16  51.343   1.137   1.424
  127   HD13  ILE  16           HD3      ILE  16  49.844   0.187   1.293
  128    H    GLY  17           HN       GLY  17  48.733   5.653   2.218
  129    HA2  GLY  17           HA1      GLY  17  49.171   5.513   5.135
  130    HA3  GLY  17           HA2      GLY  17  49.546   6.888   4.076
  131    H    HIS  18           HN       HIS  18  46.790   6.108   2.775
  132    HA   HIS  18           HA       HIS  18  45.179   7.890   4.603
  133    HB2  HIS  18           HB2      HIS  18  45.158   7.214   1.683
  134    HB3  HIS  18           HB1      HIS  18  43.556   7.413   2.419
  135    HD1  HIS  18           HD1      HIS  18  43.251   9.627   1.007
  136    HD2  HIS  18           HD2      HIS  18  46.410   9.735   3.780
  137    HE1  HIS  18           HE1      HIS  18  43.924  12.073   1.301
  138    H    ALA  19           HN       ALA  19  45.003   4.669   2.932
  139    HA   ALA  19           HA       ALA  19  43.867   3.297   5.111
  140    HB1  ALA  19           HB1      ALA  19  41.385   3.235   4.144
  141    HB2  ALA  19           HB2      ALA  19  41.823   4.837   3.505
  142    HB3  ALA  19           HB3      ALA  19  41.879   4.528   5.257
  143    H    ALA  20           HN       ALA  20  45.220   3.372   2.240
  144    HA   ALA  20           HA       ALA  20  45.588   1.787   0.580
  145    HB1  ALA  20           HB1      ALA  20  44.109  -0.214   2.315
  146    HB2  ALA  20           HB2      ALA  20  45.763   0.327   2.687
  147    HB3  ALA  20           HB3      ALA  20  45.424  -0.510   1.154
  148    H    VAL  21           HN       VAL  21  42.795   3.112   1.311
  149    HA   VAL  21           HA       VAL  21  41.438   2.042  -1.108
  150    HB   VAL  21           HB       VAL  21  40.022   2.234   1.593
  151   HG11  VAL  21          HG11      VAL  21  39.156   1.455  -1.222
  152   HG12  VAL  21          HG12      VAL  21  38.444   2.680  -0.147
  153   HG13  VAL  21          HG13      VAL  21  38.233   0.955   0.215
  154   HG21  VAL  21          HG21      VAL  21  41.493   0.302   1.647
  155   HG22  VAL  21          HG22      VAL  21  41.017  -0.174   0.000
  156   HG23  VAL  21          HG23      VAL  21  39.849  -0.294   1.339
  157    H    ASN  22           HN       ASN  22  42.415   4.436   1.024
  158    HA   ASN  22           HA       ASN  22  42.403   6.761   0.459
  159    HB2  ASN  22           HB2      ASN  22  40.997   6.266  -1.652
  160    HB3  ASN  22           HB1      ASN  22  39.569   6.509  -0.611
  161   HD21  ASN  22          HD21      ASN  22  39.904   8.300  -2.723
  162   HD22  ASN  22          HD22      ASN  22  40.429   9.863  -2.094
  163    H    HIS  23           HN       HIS  23  39.638   4.951   1.668
  164    HA   HIS  23           HA       HIS  23  39.593   6.674   4.092
  165    HB2  HIS  23           HB2      HIS  23  37.174   6.285   2.282
  166    HB3  HIS  23           HB1      HIS  23  37.119   6.964   3.926
  167    HD1  HIS  23           HD1      HIS  23  38.145   7.738   0.386
  168    HD2  HIS  23           HD2      HIS  23  38.202   9.594   4.158
  169    HE1  HIS  23           HE1      HIS  23  38.757  10.192   0.019
  170    H    TYR  24           HN       TYR  24  39.828   5.228   5.655
  171    HA   TYR  24           HA       TYR  24  39.298   2.466   5.458
  172    HB2  TYR  24           HB2      TYR  24  40.636   3.572   7.259
  173    HB3  TYR  24           HB1      TYR  24  39.120   4.171   7.974
  174    HD1  TYR  24           HD1      TYR  24  37.557   2.661   9.084
  175    HD2  TYR  24           HD2      TYR  24  41.162   1.158   7.248
  176    HE1  TYR  24           HE1      TYR  24  37.242   0.481  10.251
  177    HE2  TYR  24           HE2      TYR  24  40.847  -1.023   8.415
  178    HH   TYR  24           HH       TYR  24  38.399  -1.406  10.919
  179    H    LEU  25           HN       LEU  25  37.087   5.030   5.475
  180    HA   LEU  25           HA       LEU  25  34.928   3.732   6.929
  181    HB2  LEU  25           HB2      LEU  25  34.607   5.835   4.760
  182    HB3  LEU  25           HB1      LEU  25  33.568   5.532   6.172
  183    HG   LEU  25           HG       LEU  25  36.414   6.627   6.197
  184   HD11  LEU  25          HD11      LEU  25  35.365   8.648   7.067
  185   HD12  LEU  25          HD12      LEU  25  33.777   7.845   7.127
  186   HD13  LEU  25          HD13      LEU  25  34.542   8.190   5.556
  187   HD21  LEU  25          HD21      LEU  25  35.864   6.886   8.718
  188   HD22  LEU  25          HD22      LEU  25  36.256   5.249   8.146
  189   HD23  LEU  25          HD23      LEU  25  34.560   5.708   8.435
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1  68.932  20.718  -3.665
    2    H2   GLY   1           HT2      GLY   1  69.876  20.201  -2.350
    3    H3   GLY   1           HT3      GLY   1  68.244  20.612  -2.120
    4    HA2  GLY   1           HA1      GLY   1  69.329  18.327  -3.623
    5    HA3  GLY   1           HA2      GLY   1  68.435  18.281  -2.090
    6    H    TRP   2           HN       TRP   2  67.197  16.705  -3.518
    7    HA   TRP   2           HA       TRP   2  65.602  17.546  -5.693
    8    HB2  TRP   2           HB2      TRP   2  64.018  15.695  -4.868
    9    HB3  TRP   2           HB1      TRP   2  65.701  15.220  -5.196
   10    HD1  TRP   2           HD1      TRP   2  63.297  15.953  -2.298
   11    HE1  TRP   2           HE1      TRP   2  64.240  14.916  -0.108
   12    HE3  TRP   2           HE3      TRP   2  67.863  14.423  -4.033
   13    HZ2  TRP   2           HZ2      TRP   2  66.661  13.603   0.742
   14    HZ3  TRP   2           HZ3      TRP   2  69.474  13.281  -2.516
   15    HH2  TRP   2           HH2      TRP   2  68.877  12.870  -0.132
   16    H    GLY   3           HN       GLY   3  63.815  18.744  -5.940
   17    HA2  GLY   3           HA1      GLY   3  62.868  20.303  -3.664
   18    HA3  GLY   3           HA2      GLY   3  62.274  20.381  -5.334
   19    H    SER   4           HN       SER   4  62.073  17.253  -4.985
   20    HA   SER   4           HA       SER   4  60.342  15.783  -4.536
   21    HB2  SER   4           HB2      SER   4  59.434  15.787  -2.366
   22    HB3  SER   4           HB1      SER   4  60.968  16.660  -2.154
   23    HG   SER   4           HG       SER   4  58.595  17.517  -1.540
   24    H    ILE   5           HN       ILE   5  58.662  15.606  -5.844
   25    HA   ILE   5           HA       ILE   5  57.092  17.965  -6.593
   26    HB   ILE   5           HB       ILE   5  55.787  16.320  -7.983
   27   HG12  ILE   5          HG12      ILE   5  57.762  14.336  -6.754
   28   HG13  ILE   5          HG11      ILE   5  56.003  14.356  -6.503
   29   HG21  ILE   5          HG21      ILE   5  57.982  17.448  -8.706
   30   HG22  ILE   5          HG22      ILE   5  57.542  15.965  -9.581
   31   HG23  ILE   5          HG23      ILE   5  58.789  15.913  -8.311
   32   HD11  ILE   5           HD1      ILE   5  56.310  12.715  -8.185
   33   HD12  ILE   5           HD2      ILE   5  57.551  13.675  -9.024
   34   HD13  ILE   5           HD3      ILE   5  55.841  14.166  -9.104
   35    H    PHE   6           HN       PHE   6  56.887  17.633  -3.867
   36    HA   PHE   6           HA       PHE   6  55.213  17.759  -2.273
   37    HB2  PHE   6           HB2      PHE   6  53.093  16.831  -4.228
   38    HB3  PHE   6           HB1      PHE   6  52.961  17.981  -2.880
   39    HD1  PHE   6           HD1      PHE   6  53.007  17.815  -6.374
   40    HD2  PHE   6           HD2      PHE   6  54.786  20.027  -3.119
   41    HE1  PHE   6           HE1      PHE   6  53.451  19.722  -7.911
   42    HE2  PHE   6           HE2      PHE   6  55.229  21.933  -4.660
   43    HZ   PHE   6           HZ       PHE   6  54.499  21.806  -7.038
   44    H    LYS   7           HN       LYS   7  55.941  15.005  -4.134
   45    HA   LYS   7           HA       LYS   7  54.275  13.012  -3.001
   46    HB2  LYS   7           HB2      LYS   7  55.864  12.639  -4.877
   47    HB3  LYS   7           HB1      LYS   7  57.223  12.779  -3.737
   48    HG2  LYS   7           HG2      LYS   7  56.462  10.831  -2.493
   49    HG3  LYS   7           HG1      LYS   7  54.966  10.749  -3.456
   50    HD2  LYS   7           HD2      LYS   7  56.391  10.415  -5.514
   51    HD3  LYS   7           HD1      LYS   7  57.815  10.310  -4.450
   52    HE2  LYS   7           HE2      LYS   7  57.047   8.049  -4.908
   53    HE3  LYS   7           HE1      LYS   7  56.664   8.433  -3.212
   54    HZ1  LYS   7           HZ1      LYS   7  54.888   7.470  -4.960
   55    HZ2  LYS   7           HZ2      LYS   7  54.620   9.137  -5.154
   56    HZ3  LYS   7           HZ3      LYS   7  54.468   8.421  -3.621
   57    H    HIS   8           HN       HIS   8  57.225  14.566  -1.751
   58    HA   HIS   8           HA       HIS   8  57.438  12.788   0.545
   59    HB2  HIS   8           HB2      HIS   8  58.603  15.556   0.037
   60    HB3  HIS   8           HB1      HIS   8  59.073  14.466   1.364
   61    HD1  HIS   8           HD1      HIS   8  61.416  14.993  -0.266
   62    HD2  HIS   8           HD2      HIS   8  58.557  12.200  -1.575
   63    HE1  HIS   8           HE1      HIS   8  62.573  13.443  -1.937
   64    H    GLY   9           HN       GLY   9  54.958  14.605  -0.207
   65    HA2  GLY   9           HA1      GLY   9  54.215  15.082   2.609
   66    HA3  GLY   9           HA2      GLY   9  54.304  16.530   1.582
   67    H    ARG  10           HN       ARG  10  53.585  13.870  -0.297
   68    HA   ARG  10           HA       ARG  10  50.680  13.806   0.179
   69    HB2  ARG  10           HB2      ARG  10  51.854  15.066  -2.339
   70    HB3  ARG  10           HB1      ARG  10  50.167  14.521  -2.183
   71    HG2  ARG  10           HG2      ARG  10  50.040  16.051  -0.097
   72    HG3  ARG  10           HG1      ARG  10  51.574  16.754  -0.665
   73    HD2  ARG  10           HD2      ARG  10  50.461  17.195  -2.893
   74    HD3  ARG  10           HD1      ARG  10  48.922  16.676  -2.164
   75    HE   ARG  10           HE       ARG  10  50.060  19.265  -1.856
   76   HH11  ARG  10          HH11      ARG  10  50.631  17.938   0.850
   77   HH12  ARG  10          HH12      ARG  10  49.225  18.411   1.746
   78   HH21  ARG  10          HH21      ARG  10  47.423  19.344  -1.065
   79   HH22  ARG  10          HH22      ARG  10  47.408  19.206   0.661
   80    H    HIS  11           HN       HIS  11  49.613  12.317  -1.333
   81    HA   HIS  11           HA       HIS  11  49.506  10.205  -2.254
   82    HB2  HIS  11           HB2      HIS  11  52.240  10.853  -3.431
   83    HB3  HIS  11           HB1      HIS  11  51.092   9.624  -4.013
   84    HD1  HIS  11           HD1      HIS  11  51.313  13.424  -3.500
   85    HD2  HIS  11           HD2      HIS  11  49.185  10.606  -5.784
   86    HE1  HIS  11           HE1      HIS  11  49.913  14.721  -5.199
   87    H    ALA  12           HN       ALA  12  49.751   8.285  -1.720
   88    HA   ALA  12           HA       ALA  12  50.427   6.396  -0.637
   89    HB1  ALA  12           HB1      ALA  12  52.677   7.144  -1.533
   90    HB2  ALA  12           HB2      ALA  12  52.689   6.144  -0.058
   91    HB3  ALA  12           HB3      ALA  12  52.828   7.901   0.043
   92    H    ALA  13           HN       ALA  13  51.193   9.588   0.676
   93    HA   ALA  13           HA       ALA  13  50.851   8.746   3.459
   94    HB1  ALA  13           HB1      ALA  13  50.179  11.387   2.029
   95    HB2  ALA  13           HB2      ALA  13  51.715  11.068   2.869
   96    HB3  ALA  13           HB3      ALA  13  50.194  11.136   3.790
   97    H    LYS  14           HN       LYS  14  49.873   8.322   0.445
   98    HA   LYS  14           HA       LYS  14  46.824   8.135   1.100
   99    HB2  LYS  14           HB2      LYS  14  47.872   9.558  -0.830
  100    HB3  LYS  14           HB1      LYS  14  48.326   7.959  -1.533
  101    HG2  LYS  14           HG2      LYS  14  46.142   7.537  -2.216
  102    HG3  LYS  14           HG1      LYS  14  45.418   8.232  -0.749
  103    HD2  LYS  14           HD2      LYS  14  45.749  10.503  -1.629
  104    HD3  LYS  14           HD1      LYS  14  46.579   9.848  -3.062
  105    HE2  LYS  14           HE2      LYS  14  44.553   8.698  -3.778
  106    HE3  LYS  14           HE1      LYS  14  43.714   9.158  -2.277
  107    HZ1  LYS  14           HZ1      LYS  14  43.024  10.901  -3.475
  108    HZ2  LYS  14           HZ2      LYS  14  44.224  10.708  -4.664
  109    HZ3  LYS  14           HZ3      LYS  14  44.577  11.533  -3.222
  110    H    HIS  15           HN       HIS  15  46.035   6.511  -0.826
  111    HA   HIS  15           HA       HIS  15  45.607   4.211  -1.009
  112    HB2  HIS  15           HB2      HIS  15  48.504   4.312  -1.917
  113    HB3  HIS  15           HB1      HIS  15  47.241   3.182  -2.460
  114    HD1  HIS  15           HD1      HIS  15  44.893   4.822  -3.169
  115    HD2  HIS  15           HD2      HIS  15  48.807   6.138  -3.961
  116    HE1  HIS  15           HE1      HIS  15  44.742   6.610  -4.989
  117    H    ILE  16           HN       ILE  16  46.951   5.088   1.590
  118    HA   ILE  16           HA       ILE  16  47.010   2.738   2.864
  119    HB   ILE  16           HB       ILE  16  48.895   1.799   1.772
  120   HG12  ILE  16          HG12      ILE  16  50.260   3.128   4.144
  121   HG13  ILE  16          HG11      ILE  16  48.978   1.930   4.393
  122   HG21  ILE  16          HG21      ILE  16  51.068   3.142   1.555
  123   HG22  ILE  16          HG22      ILE  16  50.158   4.558   2.076
  124   HG23  ILE  16          HG23      ILE  16  49.746   3.762   0.549
  125   HD11  ILE  16           HD1      ILE  16  50.379   0.394   2.806
  126   HD12  ILE  16           HD2      ILE  16  50.969   0.650   4.462
  127   HD13  ILE  16           HD3      ILE  16  51.704   1.540   3.113
  128    H    GLY  17           HN       GLY  17  48.687   5.577   2.541
  129    HA2  GLY  17           HA1      GLY  17  48.741   6.094   5.427
  130    HA3  GLY  17           HA2      GLY  17  49.137   7.255   4.145
  131    H    HIS  18           HN       HIS  18  46.576   6.022   2.784
  132    HA   HIS  18           HA       HIS  18  44.709   8.021   4.046
  133    HB2  HIS  18           HB2      HIS  18  44.989   6.715   1.368
  134    HB3  HIS  18           HB1      HIS  18  43.315   6.902   1.920
  135    HD1  HIS  18           HD1      HIS  18  45.937   9.416   2.964
  136    HD2  HIS  18           HD2      HIS  18  42.920   9.054   0.057
  137    HE1  HIS  18           HE1      HIS  18  45.559  11.737   1.964
  138    H    ALA  19           HN       ALA  19  44.948   4.473   3.295
  139    HA   ALA  19           HA       ALA  19  43.316   3.887   5.644
  140    HB1  ALA  19           HB1      ALA  19  41.280   3.179   4.637
  141    HB2  ALA  19           HB2      ALA  19  41.944   3.356   2.994
  142    HB3  ALA  19           HB3      ALA  19  41.607   4.799   3.982
  143    H    ALA  20           HN       ALA  20  45.813   2.941   4.640
  144    HA   ALA  20           HA       ALA  20  46.884   0.898   4.431
  145    HB1  ALA  20           HB1      ALA  20  44.268  -0.596   4.657
  146    HB2  ALA  20           HB2      ALA  20  44.941   0.251   6.070
  147    HB3  ALA  20           HB3      ALA  20  45.878  -1.035   5.273
  148    H    VAL  21           HN       VAL  21  44.192   1.800   2.433
  149    HA   VAL  21           HA       VAL  21  45.468   0.390   0.145
  150    HB   VAL  21           HB       VAL  21  42.492   0.061   0.735
  151   HG11  VAL  21          HG11      VAL  21  44.374  -1.067  -1.386
  152   HG12  VAL  21          HG12      VAL  21  43.026   0.065  -1.649
  153   HG13  VAL  21          HG13      VAL  21  42.696  -1.609  -1.142
  154   HG21  VAL  21          HG21      VAL  21  44.841  -1.853   1.089
  155   HG22  VAL  21          HG22      VAL  21  43.142  -2.376   1.054
  156   HG23  VAL  21          HG23      VAL  21  43.711  -1.288   2.342
  157    H    ASN  22           HN       ASN  22  43.107   2.667   1.471
  158    HA   ASN  22           HA       ASN  22  43.568   4.879  -0.030
  159    HB2  ASN  22           HB2      ASN  22  43.348   4.007  -2.208
  160    HB3  ASN  22           HB1      ASN  22  42.050   2.887  -1.739
  161   HD21  ASN  22          HD21      ASN  22  40.121   3.497  -2.713
  162   HD22  ASN  22          HD22      ASN  22  39.597   5.170  -2.937
  163    H    HIS  23           HN       HIS  23  40.806   2.680   0.610
  164    HA   HIS  23           HA       HIS  23  39.700   4.546   2.549
  165    HB2  HIS  23           HB2      HIS  23  39.069   5.621   0.339
  166    HB3  HIS  23           HB1      HIS  23  38.101   4.171  -0.012
  167    HD1  HIS  23           HD1      HIS  23  35.728   4.277   0.739
  168    HD2  HIS  23           HD2      HIS  23  38.199   6.861   2.950
  169    HE1  HIS  23           HE1      HIS  23  34.236   5.525   2.397
  170    H    TYR  24           HN       TYR  24  40.231   2.273   3.401
  171    HA   TYR  24           HA       TYR  24  38.639   0.024   2.706
  172    HB2  TYR  24           HB2      TYR  24  40.629  -0.097   4.163
  173    HB3  TYR  24           HB1      TYR  24  39.757   0.797   5.432
  174    HD1  TYR  24           HD1      TYR  24  37.956  -0.251   6.711
  175    HD2  TYR  24           HD2      TYR  24  39.988  -2.406   3.573
  176    HE1  TYR  24           HE1      TYR  24  36.949  -2.381   7.522
  177    HE2  TYR  24           HE2      TYR  24  38.981  -4.536   4.384
  178    HH   TYR  24           HH       TYR  24  37.830  -5.502   6.163
  179    H    LEU  25           HN       LEU  25  37.842   2.953   4.392
  180    HA   LEU  25           HA       LEU  25  35.597   1.924   5.898
  181    HB2  LEU  25           HB2      LEU  25  35.864   4.764   4.856
  182    HB3  LEU  25           HB1      LEU  25  35.070   4.198   6.345
  183    HG   LEU  25           HG       LEU  25  38.062   4.154   5.746
  184   HD11  LEU  25          HD11      LEU  25  36.380   5.685   7.781
  185   HD12  LEU  25          HD12      LEU  25  37.147   6.376   6.331
  186   HD13  LEU  25          HD13      LEU  25  38.154   5.742   7.654
  187   HD21  LEU  25          HD21      LEU  25  36.406   3.021   8.041
  188   HD22  LEU  25          HD22      LEU  25  38.129   3.426   8.233
  189   HD23  LEU  25          HD23      LEU  25  37.633   2.194   7.051
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1  66.187  25.045   1.436
    2    H2   GLY   1           HT2      GLY   1  65.319  25.143   2.893
    3    H3   GLY   1           HT3      GLY   1  65.851  26.559   2.120
    4    HA2  GLY   1           HA1      GLY   1  63.537  26.287   1.769
    5    HA3  GLY   1           HA2      GLY   1  64.436  26.098   0.251
    6    H    TRP   2           HN       TRP   2  62.291  25.056  -0.285
    7    HA   TRP   2           HA       TRP   2  61.690  22.467   0.868
    8    HB2  TRP   2           HB2      TRP   2  60.133  22.247  -1.027
    9    HB3  TRP   2           HB1      TRP   2  60.002  23.862  -0.289
   10    HD1  TRP   2           HD1      TRP   2  61.069  22.078  -3.459
   11    HE1  TRP   2           HE1      TRP   2  61.614  23.810  -5.320
   12    HE3  TRP   2           HE3      TRP   2  60.907  26.354  -0.650
   13    HZ2  TRP   2           HZ2      TRP   2  61.931  26.666  -5.527
   14    HZ3  TRP   2           HZ3      TRP   2  61.335  28.572  -1.700
   15    HH2  TRP   2           HH2      TRP   2  61.845  28.731  -4.133
   16    H    GLY   3           HN       GLY   3  61.254  20.847  -1.368
   17    HA2  GLY   3           HA1      GLY   3  63.535  20.560  -3.057
   18    HA3  GLY   3           HA2      GLY   3  63.774  19.558  -1.612
   19    H    SER   4           HN       SER   4  60.518  20.149  -2.671
   20    HA   SER   4           HA       SER   4  60.329  17.889  -4.478
   21    HB2  SER   4           HB2      SER   4  59.134  16.330  -3.060
   22    HB3  SER   4           HB1      SER   4  60.693  16.704  -2.291
   23    HG   SER   4           HG       SER   4  58.091  17.617  -1.641
   24    H    ILE   5           HN       ILE   5  58.290  17.696  -5.418
   25    HA   ILE   5           HA       ILE   5  56.617  20.094  -5.127
   26    HB   ILE   5           HB       ILE   5  55.943  17.621  -6.779
   27   HG12  ILE   5          HG12      ILE   5  58.346  18.460  -7.204
   28   HG13  ILE   5          HG11      ILE   5  57.266  18.394  -8.606
   29   HG21  ILE   5          HG21      ILE   5  54.940  19.431  -8.272
   30   HG22  ILE   5          HG22      ILE   5  55.239  20.579  -6.947
   31   HG23  ILE   5          HG23      ILE   5  54.145  19.198  -6.700
   32   HD11  ILE   5           HD1      ILE   5  56.927  20.773  -8.583
   33   HD12  ILE   5           HD2      ILE   5  58.675  20.514  -8.393
   34   HD13  ILE   5           HD3      ILE   5  57.685  20.939  -6.983
   35    H    PHE   6           HN       PHE   6  56.451  19.208  -2.710
   36    HA   PHE   6           HA       PHE   6  55.030  18.391  -1.069
   37    HB2  PHE   6           HB2      PHE   6  52.953  18.708  -3.273
   38    HB3  PHE   6           HB1      PHE   6  52.612  18.545  -1.533
   39    HD1  PHE   6           HD1      PHE   6  53.492  20.297   0.077
   40    HD2  PHE   6           HD2      PHE   6  53.616  20.820  -4.207
   41    HE1  PHE   6           HE1      PHE   6  53.826  22.747   0.384
   42    HE2  PHE   6           HE2      PHE   6  53.950  23.270  -3.898
   43    HZ   PHE   6           HZ       PHE   6  54.148  24.217  -1.601
   44    H    LYS   7           HN       LYS   7  56.024  16.594  -3.538
   45    HA   LYS   7           HA       LYS   7  54.185  14.375  -3.572
   46    HB2  LYS   7           HB2      LYS   7  55.944  14.793  -5.297
   47    HB3  LYS   7           HB1      LYS   7  57.186  14.376  -4.092
   48    HG2  LYS   7           HG2      LYS   7  56.276  12.122  -3.858
   49    HG3  LYS   7           HG1      LYS   7  54.911  12.525  -4.927
   50    HD2  LYS   7           HD2      LYS   7  56.597  13.032  -6.751
   51    HD3  LYS   7           HD1      LYS   7  57.861  12.383  -5.677
   52    HE2  LYS   7           HE2      LYS   7  55.387  10.857  -6.602
   53    HE3  LYS   7           HE1      LYS   7  57.025  10.658  -7.267
   54    HZ1  LYS   7           HZ1      LYS   7  56.497   8.999  -5.561
   55    HZ2  LYS   7           HZ2      LYS   7  56.270  10.235  -4.417
   56    HZ3  LYS   7           HZ3      LYS   7  57.804   9.977  -5.101
   57    H    HIS   8           HN       HIS   8  57.367  14.789  -1.949
   58    HA   HIS   8           HA       HIS   8  56.892  12.419  -0.276
   59    HB2  HIS   8           HB2      HIS   8  59.066  14.550  -0.280
   60    HB3  HIS   8           HB1      HIS   8  59.058  13.122   0.783
   61    HD1  HIS   8           HD1      HIS   8  60.278  14.241  -2.433
   62    HD2  HIS   8           HD2      HIS   8  58.864  10.595  -0.886
   63    HE1  HIS   8           HE1      HIS   8  61.032  12.392  -4.028
   64    H    GLY   9           HN       GLY   9  54.877  14.484  -0.059
   65    HA2  GLY   9           HA1      GLY   9  54.829  14.692   2.838
   66    HA3  GLY   9           HA2      GLY   9  55.127  16.261   2.063
   67    H    ARG  10           HN       ARG  10  53.295  14.041   0.185
   68    HA   ARG  10           HA       ARG  10  50.690  14.698   1.292
   69    HB2  ARG  10           HB2      ARG  10  51.571  16.858   0.070
   70    HB3  ARG  10           HB1      ARG  10  51.203  15.963  -1.421
   71    HG2  ARG  10           HG2      ARG  10  48.863  15.588  -0.539
   72    HG3  ARG  10           HG1      ARG  10  49.264  16.646   0.834
   73    HD2  ARG  10           HD2      ARG  10  49.927  18.417  -0.911
   74    HD3  ARG  10           HD1      ARG  10  49.132  17.373  -2.116
   75    HE   ARG  10           HE       ARG  10  47.374  17.849   0.127
   76   HH11  ARG  10          HH11      ARG  10  45.487  18.965  -0.497
   77   HH12  ARG  10          HH12      ARG  10  45.604  20.196  -1.711
   78   HH21  ARG  10          HH21      ARG  10  48.949  19.580  -2.388
   79   HH22  ARG  10          HH22      ARG  10  47.563  20.543  -2.781
   80    H    HIS  11           HN       HIS  11  52.314  12.421   0.391
   81    HA   HIS  11           HA       HIS  11  50.211  11.094  -1.142
   82    HB2  HIS  11           HB2      HIS  11  51.593  12.261  -2.936
   83    HB3  HIS  11           HB1      HIS  11  52.968  11.255  -2.418
   84    HD1  HIS  11           HD1      HIS  11  53.067   8.859  -3.234
   85    HD2  HIS  11           HD2      HIS  11  49.351  10.684  -3.982
   86    HE1  HIS  11           HE1      HIS  11  51.714   7.260  -4.699
   87    H    ALA  12           HN       ALA  12  50.242   9.022  -1.141
   88    HA   ALA  12           HA       ALA  12  50.645   6.889  -0.429
   89    HB1  ALA  12           HB1      ALA  12  53.117   7.938   0.692
   90    HB2  ALA  12           HB2      ALA  12  53.016   7.541  -1.028
   91    HB3  ALA  12           HB3      ALA  12  52.819   6.277   0.214
   92    H    ALA  13           HN       ALA  13  51.603   9.652   1.549
   93    HA   ALA  13           HA       ALA  13  50.996   8.313   4.082
   94    HB1  ALA  13           HB1      ALA  13  50.664  11.243   3.199
   95    HB2  ALA  13           HB2      ALA  13  52.111  10.603   4.013
   96    HB3  ALA  13           HB3      ALA  13  50.551  10.642   4.869
   97    H    LYS  14           HN       LYS  14  50.193   8.584   1.017
   98    HA   LYS  14           HA       LYS  14  47.097   8.592   1.464
   99    HB2  LYS  14           HB2      LYS  14  48.403  10.264  -0.072
  100    HB3  LYS  14           HB1      LYS  14  48.755   8.806  -1.072
  101    HG2  LYS  14           HG2      LYS  14  46.588   8.745  -1.918
  102    HG3  LYS  14           HG1      LYS  14  45.839   9.240  -0.382
  103    HD2  LYS  14           HD2      LYS  14  46.308  11.560  -0.797
  104    HD3  LYS  14           HD1      LYS  14  47.400  11.170  -2.147
  105    HE2  LYS  14           HE2      LYS  14  45.232  11.939  -3.019
  106    HE3  LYS  14           HE1      LYS  14  45.464  10.217  -3.405
  107    HZ1  LYS  14           HZ1      LYS  14  44.250   9.905  -1.133
  108    HZ2  LYS  14           HZ2      LYS  14  43.357  10.208  -2.546
  109    HZ3  LYS  14           HZ3      LYS  14  43.661  11.465  -1.442
  110    H    HIS  15           HN       HIS  15  46.302   7.487  -0.772
  111    HA   HIS  15           HA       HIS  15  45.674   5.332  -1.453
  112    HB2  HIS  15           HB2      HIS  15  47.348   6.226  -3.084
  113    HB3  HIS  15           HB1      HIS  15  48.617   5.339  -2.209
  114    HD1  HIS  15           HD1      HIS  15  45.455   3.496  -2.130
  115    HD2  HIS  15           HD2      HIS  15  48.699   3.821  -4.788
  116    HE1  HIS  15           HE1      HIS  15  45.330   1.509  -3.731
  117    H    ILE  16           HN       ILE  16  46.999   5.510   1.322
  118    HA   ILE  16           HA       ILE  16  46.727   2.946   2.072
  119    HB   ILE  16           HB       ILE  16  48.571   2.085   0.843
  120   HG12  ILE  16          HG12      ILE  16  49.906   2.650   3.516
  121   HG13  ILE  16          HG11      ILE  16  48.472   1.607   3.433
  122   HG21  ILE  16          HG21      ILE  16  49.682   4.154   0.152
  123   HG22  ILE  16          HG22      ILE  16  50.876   3.211   1.063
  124   HG23  ILE  16          HG23      ILE  16  50.044   4.559   1.840
  125   HD11  ILE  16           HD1      ILE  16  51.183   1.163   2.117
  126   HD12  ILE  16           HD2      ILE  16  49.733   0.251   1.637
  127   HD13  ILE  16           HD3      ILE  16  50.350   0.134   3.299
  128    H    GLY  17           HN       GLY  17  48.601   5.657   2.413
  129    HA2  GLY  17           HA1      GLY  17  48.559   5.532   5.354
  130    HA3  GLY  17           HA2      GLY  17  49.112   6.900   4.364
  131    H    HIS  18           HN       HIS  18  46.595   6.206   2.654
  132    HA   HIS  18           HA       HIS  18  44.764   8.038   4.183
  133    HB2  HIS  18           HB2      HIS  18  45.170   7.253   1.329
  134    HB3  HIS  18           HB1      HIS  18  43.464   7.410   1.792
  135    HD1  HIS  18           HD1      HIS  18  43.242   9.572   0.320
  136    HD2  HIS  18           HD2      HIS  18  46.065   9.879   3.422
  137    HE1  HIS  18           HE1      HIS  18  43.791  12.050   0.610
  138    H    ALA  19           HN       ALA  19  44.741   4.777   2.610
  139    HA   ALA  19           HA       ALA  19  43.398   3.416   4.653
  140    HB1  ALA  19           HB1      ALA  19  41.490   4.934   2.861
  141    HB2  ALA  19           HB2      ALA  19  41.425   4.704   4.627
  142    HB3  ALA  19           HB3      ALA  19  41.008   3.363   3.542
  143    H    ALA  20           HN       ALA  20  44.992   3.519   1.925
  144    HA   ALA  20           HA       ALA  20  45.498   1.966   0.280
  145    HB1  ALA  20           HB1      ALA  20  45.251  -0.341   0.779
  146    HB2  ALA  20           HB2      ALA  20  43.833  -0.053   1.816
  147    HB3  ALA  20           HB3      ALA  20  45.451   0.454   2.358
  148    H    VAL  21           HN       VAL  21  42.668   3.325   0.766
  149    HA   VAL  21           HA       VAL  21  41.485   2.221  -1.751
  150    HB   VAL  21           HB       VAL  21  39.916   2.687   0.829
  151   HG11  VAL  21          HG11      VAL  21  38.471   3.250  -0.975
  152   HG12  VAL  21          HG12      VAL  21  38.090   1.546  -0.644
  153   HG13  VAL  21          HG13      VAL  21  39.132   1.974  -2.024
  154   HG21  VAL  21          HG21      VAL  21  41.236   0.606   0.913
  155   HG22  VAL  21          HG22      VAL  21  40.618   0.129  -0.686
  156   HG23  VAL  21          HG23      VAL  21  39.513   0.222   0.706
  157    H    ASN  22           HN       ASN  22  42.460   4.715   0.271
  158    HA   ASN  22           HA       ASN  22  42.693   6.972  -0.532
  159    HB2  ASN  22           HB2      ASN  22  41.352   6.444  -2.651
  160    HB3  ASN  22           HB1      ASN  22  39.890   6.813  -1.695
  161   HD21  ASN  22          HD21      ASN  22  40.310   8.473  -3.851
  162   HD22  ASN  22          HD22      ASN  22  40.917  10.041  -3.307
  163    H    HIS  23           HN       HIS  23  39.755   5.517   0.737
  164    HA   HIS  23           HA       HIS  23  38.718   5.959   2.786
  165    HB2  HIS  23           HB2      HIS  23  41.019   7.182   3.370
  166    HB3  HIS  23           HB1      HIS  23  40.067   8.658   3.114
  167    HD1  HIS  23           HD1      HIS  23  37.323   7.540   4.247
  168    HD2  HIS  23           HD2      HIS  23  41.050   7.333   6.183
  169    HE1  HIS  23           HE1      HIS  23  36.868   7.262   6.746
  170    H    TYR  24           HN       TYR  24  38.050   6.835   0.025
  171    HA   TYR  24           HA       TYR  24  36.747   9.404   0.160
  172    HB2  TYR  24           HB2      TYR  24  37.388   8.168  -1.945
  173    HB3  TYR  24           HB1      TYR  24  36.042   7.046  -1.630
  174    HD1  TYR  24           HD1      TYR  24  36.954  10.553  -2.460
  175    HD2  TYR  24           HD2      TYR  24  33.723   7.745  -1.900
  176    HE1  TYR  24           HE1      TYR  24  35.369  12.169  -3.500
  177    HE2  TYR  24           HE2      TYR  24  32.139   9.363  -2.940
  178    HH   TYR  24           HH       TYR  24  32.325  12.242  -3.152
  179    H    LEU  25           HN       LEU  25  36.013   6.373   1.556
  180    HA   LEU  25           HA       LEU  25  33.530   7.413   2.659
  181    HB2  LEU  25           HB2      LEU  25  32.223   5.321   1.675
  182    HB3  LEU  25           HB1      LEU  25  32.374   6.810   0.714
  183    HG   LEU  25           HG       LEU  25  34.263   5.881  -0.528
  184   HD11  LEU  25          HD11      LEU  25  35.420   4.540   1.075
  185   HD12  LEU  25          HD12      LEU  25  34.795   3.382  -0.121
  186   HD13  LEU  25          HD13      LEU  25  33.967   3.580   1.443
  187   HD21  LEU  25          HD21      LEU  25  33.086   4.023  -1.671
  188   HD22  LEU  25          HD22      LEU  25  31.965   5.355  -1.301
  189   HD23  LEU  25          HD23      LEU  25  31.964   3.885  -0.296
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1  66.248   9.589  -4.793
    2    H2   GLY   1           HT2      GLY   1  65.012   9.595  -3.627
    3    H3   GLY   1           HT3      GLY   1  66.518   8.890  -3.273
    4    HA2  GLY   1           HA1      GLY   1  67.532  11.105  -3.640
    5    HA3  GLY   1           HA2      GLY   1  65.871  11.730  -3.651
    6    H    TRP   2           HN       TRP   2  65.713  12.848  -1.803
    7    HA   TRP   2           HA       TRP   2  66.961  11.938   0.667
    8    HB2  TRP   2           HB2      TRP   2  64.777  14.023   0.297
    9    HB3  TRP   2           HB1      TRP   2  65.891  13.861   1.676
   10    HD1  TRP   2           HD1      TRP   2  65.927  14.659  -2.100
   11    HE1  TRP   2           HE1      TRP   2  68.007  16.121  -2.644
   12    HE3  TRP   2           HE3      TRP   2  68.169  14.615   2.501
   13    HZ2  TRP   2           HZ2      TRP   2  70.318  17.119  -1.244
   14    HZ3  TRP   2           HZ3      TRP   2  70.311  15.827   2.875
   15    HH2  TRP   2           HH2      TRP   2  71.386  17.079   1.008
   16    H    GLY   3           HN       GLY   3  65.534  11.878   2.721
   17    HA2  GLY   3           HA1      GLY   3  63.778   9.594   2.422
   18    HA3  GLY   3           HA2      GLY   3  64.095  10.502   3.914
   19    H    SER   4           HN       SER   4  63.323  12.970   2.132
   20    HA   SER   4           HA       SER   4  61.413  14.255   1.878
   21    HB2  SER   4           HB2      SER   4  59.890  11.648   1.556
   22    HB3  SER   4           HB1      SER   4  59.490  13.244   0.884
   23    HG   SER   4           HG       SER   4  61.133  11.314  -0.079
   24    H    ILE   5           HN       ILE   5  59.686  15.125   3.024
   25    HA   ILE   5           HA       ILE   5  59.341  13.958   5.764
   26    HB   ILE   5           HB       ILE   5  58.422  16.694   4.770
   27   HG12  ILE   5          HG12      ILE   5  60.610  17.301   6.285
   28   HG13  ILE   5          HG11      ILE   5  61.151  15.722   5.677
   29   HG21  ILE   5          HG21      ILE   5  57.352  15.837   6.823
   30   HG22  ILE   5          HG22      ILE   5  58.434  17.196   7.205
   31   HG23  ILE   5          HG23      ILE   5  58.950  15.527   7.540
   32   HD11  ILE   5           HD1      ILE   5  60.853  16.483   3.357
   33   HD12  ILE   5           HD2      ILE   5  61.879  17.636   4.234
   34   HD13  ILE   5           HD3      ILE   5  60.172  18.025   3.923
   35    H    PHE   6           HN       PHE   6  57.685  14.669   2.761
   36    HA   PHE   6           HA       PHE   6  55.245  13.312   3.829
   37    HB2  PHE   6           HB2      PHE   6  55.171  15.983   2.365
   38    HB3  PHE   6           HB1      PHE   6  53.769  15.031   2.909
   39    HD1  PHE   6           HD1      PHE   6  56.172  17.557   3.841
   40    HD2  PHE   6           HD2      PHE   6  53.615  14.468   5.440
   41    HE1  PHE   6           HE1      PHE   6  56.294  18.620   6.091
   42    HE2  PHE   6           HE2      PHE   6  53.741  15.531   7.690
   43    HZ   PHE   6           HZ       PHE   6  55.120  17.578   8.026
   44    H    LYS   7           HN       LYS   7  56.882  11.927   2.337
   45    HA   LYS   7           HA       LYS   7  57.127  10.809   0.321
   46    HB2  LYS   7           HB2      LYS   7  54.340  11.752  -0.424
   47    HB3  LYS   7           HB1      LYS   7  55.131  10.199  -0.787
   48    HG2  LYS   7           HG2      LYS   7  54.208  11.179   1.951
   49    HG3  LYS   7           HG1      LYS   7  53.484   9.870   0.989
   50    HD2  LYS   7           HD2      LYS   7  55.778   8.717   1.080
   51    HD3  LYS   7           HD1      LYS   7  56.224   9.922   2.315
   52    HE2  LYS   7           HE2      LYS   7  54.135   9.221   3.597
   53    HE3  LYS   7           HE1      LYS   7  53.978   7.870   2.449
   54    HZ1  LYS   7           HZ1      LYS   7  56.360   8.429   4.148
   55    HZ2  LYS   7           HZ2      LYS   7  56.186   7.127   3.071
   56    HZ3  LYS   7           HZ3      LYS   7  55.197   7.231   4.448
   57    H    HIS   8           HN       HIS   8  57.235  14.000   0.529
   58    HA   HIS   8           HA       HIS   8  57.704  15.742  -0.940
   59    HB2  HIS   8           HB2      HIS   8  59.667  14.206  -1.279
   60    HB3  HIS   8           HB1      HIS   8  58.818  13.505  -2.677
   61    HD1  HIS   8           HD1      HIS   8  60.019  14.423  -4.682
   62    HD2  HIS   8           HD2      HIS   8  59.279  17.377  -1.783
   63    HE1  HIS   8           HE1      HIS   8  60.704  16.669  -5.690
   64    H    GLY   9           HN       GLY   9  55.160  14.037  -1.332
   65    HA2  GLY   9           HA1      GLY   9  54.244  15.506  -3.675
   66    HA3  GLY   9           HA2      GLY   9  54.418  13.768  -3.988
   67    H    ARG  10           HN       ARG  10  53.800  13.425  -0.955
   68    HA   ARG  10           HA       ARG  10  51.936  13.049   0.345
   69    HB2  ARG  10           HB2      ARG  10  51.423  15.514  -0.379
   70    HB3  ARG  10           HB1      ARG  10  50.241  14.783  -1.484
   71    HG2  ARG  10           HG2      ARG  10  48.889  15.102   0.398
   72    HG3  ARG  10           HG1      ARG  10  49.475  13.455   0.715
   73    HD2  ARG  10           HD2      ARG  10  49.690  14.807   2.748
   74    HD3  ARG  10           HD1      ARG  10  51.313  14.432   2.129
   75    HE   ARG  10           HE       ARG  10  51.623  16.743   1.795
   76   HH11  ARG  10          HH11      ARG  10  48.470  16.165   2.888
   77   HH12  ARG  10          HH12      ARG  10  47.842  17.701   2.390
   78   HH21  ARG  10          HH21      ARG  10  50.737  18.647   0.733
   79   HH22  ARG  10          HH22      ARG  10  49.125  19.104   1.171
   80    H    HIS  11           HN       HIS  11  52.646  11.234  -1.625
   81    HA   HIS  11           HA       HIS  11  49.966  10.055  -2.230
   82    HB2  HIS  11           HB2      HIS  11  52.288  10.256  -4.191
   83    HB3  HIS  11           HB1      HIS  11  50.823   9.278  -4.443
   84    HD1  HIS  11           HD1      HIS  11  48.486  10.644  -4.482
   85    HD2  HIS  11           HD2      HIS  11  51.995  12.913  -4.944
   86    HE1  HIS  11           HE1      HIS  11  47.798  12.931  -5.387
   87    H    ALA  12           HN       ALA  12  50.086   8.810  -0.606
   88    HA   ALA  12           HA       ALA  12  50.583   6.248  -0.521
   89    HB1  ALA  12           HB1      ALA  12  53.051   7.759  -0.019
   90    HB2  ALA  12           HB2      ALA  12  52.884   6.453  -1.227
   91    HB3  ALA  12           HB3      ALA  12  52.910   6.082   0.508
   92    H    ALA  13           HN       ALA  13  51.571   9.310   0.809
   93    HA   ALA  13           HA       ALA  13  50.996   8.585   3.608
   94    HB1  ALA  13           HB1      ALA  13  50.361  11.122   3.641
   95    HB2  ALA  13           HB2      ALA  13  50.994  11.186   1.978
   96    HB3  ALA  13           HB3      ALA  13  52.073  10.757   3.327
   97    H    LYS  14           HN       LYS  14  50.139   8.251   0.542
   98    HA   LYS  14           HA       LYS  14  47.060   8.361   1.011
   99    HB2  LYS  14           HB2      LYS  14  48.341   9.675  -0.824
  100    HB3  LYS  14           HB1      LYS  14  48.735   8.049  -1.513
  101    HG2  LYS  14           HG2      LYS  14  46.578   7.805  -2.363
  102    HG3  LYS  14           HG1      LYS  14  45.805   8.574  -0.961
  103    HD2  LYS  14           HD2      LYS  14  46.472  10.803  -1.814
  104    HD3  LYS  14           HD1      LYS  14  47.257  10.029  -3.214
  105    HE2  LYS  14           HE2      LYS  14  45.032   8.991  -3.802
  106    HE3  LYS  14           HE1      LYS  14  44.294   9.954  -2.499
  107    HZ1  LYS  14           HZ1      LYS  14  44.258  11.717  -3.821
  108    HZ2  LYS  14           HZ2      LYS  14  44.806  10.750  -5.105
  109    HZ3  LYS  14           HZ3      LYS  14  45.919  11.597  -4.140
  110    H    HIS  15           HN       HIS  15  46.254   6.848  -0.965
  111    HA   HIS  15           HA       HIS  15  45.589   4.614  -1.197
  112    HB2  HIS  15           HB2      HIS  15  48.518   4.557  -1.995
  113    HB3  HIS  15           HB1      HIS  15  47.276   3.387  -2.503
  114    HD1  HIS  15           HD1      HIS  15  44.940   4.938  -3.384
  115    HD2  HIS  15           HD2      HIS  15  48.854   6.286  -4.113
  116    HE1  HIS  15           HE1      HIS  15  44.819   6.624  -5.300
  117    H    ILE  16           HN       ILE  16  46.805   5.288   1.514
  118    HA   ILE  16           HA       ILE  16  46.588   2.940   2.757
  119    HB   ILE  16           HB       ILE  16  48.392   1.835   1.637
  120   HG12  ILE  16          HG12      ILE  16  49.614   2.850   4.237
  121   HG13  ILE  16          HG11      ILE  16  48.351   1.607   4.156
  122   HG21  ILE  16          HG21      ILE  16  50.740   2.922   1.670
  123   HG22  ILE  16          HG22      ILE  16  49.932   4.409   2.170
  124   HG23  ILE  16          HG23      ILE  16  49.576   3.704   0.584
  125   HD11  ILE  16           HD1      ILE  16  51.258   1.428   3.372
  126   HD12  ILE  16           HD2      ILE  16  50.093   0.467   2.430
  127   HD13  ILE  16           HD3      ILE  16  50.229   0.230   4.185
  128    H    GLY  17           HN       GLY  17  48.402   5.692   2.449
  129    HA2  GLY  17           HA1      GLY  17  48.463   6.134   5.381
  130    HA3  GLY  17           HA2      GLY  17  49.095   7.228   4.133
  131    H    HIS  18           HN       HIS  18  46.491   6.251   2.621
  132    HA   HIS  18           HA       HIS  18  44.797   8.502   3.684
  133    HB2  HIS  18           HB2      HIS  18  45.123   7.107   1.073
  134    HB3  HIS  18           HB1      HIS  18  43.428   7.387   1.500
  135    HD1  HIS  18           HD1      HIS  18  43.199   9.183  -0.384
  136    HD2  HIS  18           HD2      HIS  18  46.099  10.111   2.514
  137    HE1  HIS  18           HE1      HIS  18  43.780  11.655  -0.651
  138    H    ALA  19           HN       ALA  19  44.790   4.900   3.274
  139    HA   ALA  19           HA       ALA  19  42.588   4.885   5.318
  140    HB1  ALA  19           HB1      ALA  19  42.179   3.807   2.516
  141    HB2  ALA  19           HB2      ALA  19  41.279   5.116   3.314
  142    HB3  ALA  19           HB3      ALA  19  41.125   3.443   3.899
  143    H    ALA  20           HN       ALA  20  45.405   3.891   4.992
  144    HA   ALA  20           HA       ALA  20  46.581   1.982   5.585
  145    HB1  ALA  20           HB1      ALA  20  43.962   0.993   6.735
  146    HB2  ALA  20           HB2      ALA  20  44.975   2.226   7.523
  147    HB3  ALA  20           HB3      ALA  20  45.614   0.586   7.257
  148    H    VAL  21           HN       VAL  21  44.184   1.927   3.284
  149    HA   VAL  21           HA       VAL  21  45.096  -0.715   2.289
  150    HB   VAL  21           HB       VAL  21  42.123  -0.122   2.665
  151   HG11  VAL  21          HG11      VAL  21  42.539  -1.458   0.679
  152   HG12  VAL  21          HG12      VAL  21  41.948  -2.550   1.952
  153   HG13  VAL  21          HG13      VAL  21  43.683  -2.497   1.559
  154   HG21  VAL  21          HG21      VAL  21  42.260  -2.117   4.241
  155   HG22  VAL  21          HG22      VAL  21  43.064  -0.650   4.839
  156   HG23  VAL  21          HG23      VAL  21  44.031  -1.980   4.156
  157    H    ASN  22           HN       ASN  22  43.419   2.373   1.888
  158    HA   ASN  22           HA       ASN  22  44.329   2.675  -0.800
  159    HB2  ASN  22           HB2      ASN  22  41.948   2.530  -1.873
  160    HB3  ASN  22           HB1      ASN  22  42.854   1.024  -1.610
  161   HD21  ASN  22          HD21      ASN  22  41.762   2.486   1.340
  162   HD22  ASN  22          HD22      ASN  22  40.361   1.439   1.588
  163    H    HIS  23           HN       HIS  23  40.963   3.400  -0.009
  164    HA   HIS  23           HA       HIS  23  41.531   6.007   1.151
  165    HB2  HIS  23           HB2      HIS  23  42.151   6.367  -1.268
  166    HB3  HIS  23           HB1      HIS  23  40.465   5.991  -1.697
  167    HD1  HIS  23           HD1      HIS  23  40.738   7.716   1.547
  168    HD2  HIS  23           HD2      HIS  23  40.523   8.883  -2.487
  169    HE1  HIS  23           HE1      HIS  23  40.055  10.178   1.502
  170    H    TYR  24           HN       TYR  24  39.985   4.020   2.147
  171    HA   TYR  24           HA       TYR  24  37.210   4.254   1.277
  172    HB2  TYR  24           HB2      TYR  24  38.230   2.246   2.443
  173    HB3  TYR  24           HB1      TYR  24  38.251   3.212   3.938
  174    HD1  TYR  24           HD1      TYR  24  36.084   1.610   1.378
  175    HD2  TYR  24           HD2      TYR  24  36.188   3.779   5.108
  176    HE1  TYR  24           HE1      TYR  24  33.684   1.060   1.764
  177    HE2  TYR  24           HE2      TYR  24  33.789   3.229   5.495
  178    HH   TYR  24           HH       TYR  24  32.068   1.048   4.151
  179    H    LEU  25           HN       LEU  25  39.313   6.156   3.214
  180    HA   LEU  25           HA       LEU  25  37.167   8.042   3.778
  181    HB2  LEU  25           HB2      LEU  25  37.690   7.930   6.352
  182    HB3  LEU  25           HB1      LEU  25  36.549   6.763   5.651
  183    HG   LEU  25           HG       LEU  25  38.338   5.070   5.492
  184   HD11  LEU  25          HD11      LEU  25  40.346   6.294   5.148
  185   HD12  LEU  25          HD12      LEU  25  40.519   5.663   6.799
  186   HD13  LEU  25          HD13      LEU  25  40.045   7.360   6.541
  187   HD21  LEU  25          HD21      LEU  25  38.206   6.380   8.246
  188   HD22  LEU  25          HD22      LEU  25  38.615   4.681   7.907
  189   HD23  LEU  25          HD23      LEU  25  36.975   5.285   7.570
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1  69.428  14.874  -2.738
    2    H2   GLY   1           HT2      GLY   1  69.447  16.196  -3.806
    3    H3   GLY   1           HT3      GLY   1  70.155  14.720  -4.261
    4    HA2  GLY   1           HA1      GLY   1  68.196  13.685  -4.609
    5    HA3  GLY   1           HA2      GLY   1  67.337  14.802  -3.530
    6    H    TRP   2           HN       TRP   2  66.390  14.122  -6.072
    7    HA   TRP   2           HA       TRP   2  67.164  16.100  -8.043
    8    HB2  TRP   2           HB2      TRP   2  66.064  13.956  -8.625
    9    HB3  TRP   2           HB1      TRP   2  64.587  14.497  -7.791
   10    HD1  TRP   2           HD1      TRP   2  63.152  16.401  -8.926
   11    HE1  TRP   2           HE1      TRP   2  63.068  17.379 -11.334
   12    HE3  TRP   2           HE3      TRP   2  67.562  14.515 -10.715
   13    HZ2  TRP   2           HZ2      TRP   2  64.714  17.328 -13.697
   14    HZ3  TRP   2           HZ3      TRP   2  68.285  14.992 -13.050
   15    HH2  TRP   2           HH2      TRP   2  66.866  16.395 -14.540
   16    H    GLY   3           HN       GLY   3  64.008  15.733  -6.359
   17    HA2  GLY   3           HA1      GLY   3  63.850  18.268  -5.201
   18    HA3  GLY   3           HA2      GLY   3  63.309  18.494  -6.876
   19    H    SER   4           HN       SER   4  62.432  15.492  -6.626
   20    HA   SER   4           HA       SER   4  60.362  14.480  -6.340
   21    HB2  SER   4           HB2      SER   4  60.589  16.031  -3.738
   22    HB3  SER   4           HB1      SER   4  59.314  14.834  -4.059
   23    HG   SER   4           HG       SER   4  62.129  14.471  -3.924
   24    H    ILE   5           HN       ILE   5  57.955  15.007  -5.517
   25    HA   ILE   5           HA       ILE   5  57.127  17.758  -6.222
   26    HB   ILE   5           HB       ILE   5  55.432  16.723  -7.941
   27   HG12  ILE   5          HG12      ILE   5  57.652  14.623  -8.026
   28   HG13  ILE   5          HG11      ILE   5  56.045  14.348  -7.319
   29   HG21  ILE   5          HG21      ILE   5  57.406  18.237  -8.483
   30   HG22  ILE   5          HG22      ILE   5  56.966  17.106  -9.779
   31   HG23  ILE   5          HG23      ILE   5  58.375  16.769  -8.746
   32   HD11  ILE   5           HD1      ILE   5  56.790  14.807 -10.226
   33   HD12  ILE   5           HD2      ILE   5  55.135  15.135  -9.654
   34   HD13  ILE   5           HD3      ILE   5  55.819  13.499  -9.514
   35    H    PHE   6           HN       PHE   6  56.618  17.469  -3.930
   36    HA   PHE   6           HA       PHE   6  54.932  17.360  -2.346
   37    HB2  PHE   6           HB2      PHE   6  53.065  15.929  -4.259
   38    HB3  PHE   6           HB1      PHE   6  52.681  17.055  -2.941
   39    HD1  PHE   6           HD1      PHE   6  54.120  19.415  -3.240
   40    HD2  PHE   6           HD2      PHE   6  52.700  16.845  -6.409
   41    HE1  PHE   6           HE1      PHE   6  54.161  21.339  -4.822
   42    HE2  PHE   6           HE2      PHE   6  52.743  18.771  -7.987
   43    HZ   PHE   6           HZ       PHE   6  53.528  21.003  -7.207
   44    H    LYS   7           HN       LYS   7  55.335  14.489  -4.423
   45    HA   LYS   7           HA       LYS   7  54.407  12.500  -2.679
   46    HB2  LYS   7           HB2      LYS   7  56.792  12.484  -4.564
   47    HB3  LYS   7           HB1      LYS   7  56.153  11.028  -3.763
   48    HG2  LYS   7           HG2      LYS   7  53.949  11.398  -4.805
   49    HG3  LYS   7           HG1      LYS   7  54.552  12.884  -5.579
   50    HD2  LYS   7           HD2      LYS   7  56.178  11.621  -6.878
   51    HD3  LYS   7           HD1      LYS   7  55.769  10.122  -6.011
   52    HE2  LYS   7           HE2      LYS   7  54.613  10.079  -8.141
   53    HE3  LYS   7           HE1      LYS   7  53.399  10.370  -6.873
   54    HZ1  LYS   7           HZ1      LYS   7  54.718  12.569  -8.370
   55    HZ2  LYS   7           HZ2      LYS   7  53.329  12.650  -7.396
   56    HZ3  LYS   7           HZ3      LYS   7  53.275  11.847  -8.892
   57    H    HIS   8           HN       HIS   8  57.208  14.554  -2.393
   58    HA   HIS   8           HA       HIS   8  58.796  12.918  -0.674
   59    HB2  HIS   8           HB2      HIS   8  59.776  15.114   0.078
   60    HB3  HIS   8           HB1      HIS   8  59.737  14.896  -1.689
   61    HD1  HIS   8           HD1      HIS   8  58.780  16.808  -2.965
   62    HD2  HIS   8           HD2      HIS   8  57.215  16.583   0.932
   63    HE1  HIS   8           HE1      HIS   8  57.239  18.820  -2.646
   64    H    GLY   9           HN       GLY   9  55.682  13.872  -0.139
   65    HA2  GLY   9           HA1      GLY   9  55.529  12.998   2.495
   66    HA3  GLY   9           HA2      GLY   9  55.896  14.727   2.636
   67    H    ARG  10           HN       ARG  10  53.960  13.262   0.043
   68    HA   ARG  10           HA       ARG  10  51.428  14.070   1.340
   69    HB2  ARG  10           HB2      ARG  10  52.451  15.462  -1.171
   70    HB3  ARG  10           HB1      ARG  10  50.771  15.535  -0.592
   71    HG2  ARG  10           HG2      ARG  10  51.741  16.384   1.645
   72    HG3  ARG  10           HG1      ARG  10  53.274  16.607   0.769
   73    HD2  ARG  10           HD2      ARG  10  51.970  18.701   0.784
   74    HD3  ARG  10           HD1      ARG  10  52.117  18.067  -0.871
   75    HE   ARG  10           HE       ARG  10  49.710  17.039   0.259
   76   HH11  ARG  10          HH11      ARG  10  48.092  17.801  -1.297
   77   HH12  ARG  10          HH12      ARG  10  47.939  19.519  -1.466
   78   HH21  ARG  10          HH21      ARG  10  50.845  20.216   0.296
   79   HH22  ARG  10          HH22      ARG  10  49.497  20.886  -0.564
   80    H    HIS  11           HN       HIS  11  52.790  11.650   0.262
   81    HA   HIS  11           HA       HIS  11  50.470  10.638  -1.209
   82    HB2  HIS  11           HB2      HIS  11  51.955  11.723  -3.001
   83    HB3  HIS  11           HB1      HIS  11  53.168  10.482  -2.602
   84    HD1  HIS  11           HD1      HIS  11  49.386  10.520  -3.365
   85    HD2  HIS  11           HD2      HIS  11  52.853   8.324  -4.278
   86    HE1  HIS  11           HE1      HIS  11  48.691   8.606  -4.908
   87    H    ALA  12           HN       ALA  12  50.247   8.580  -1.269
   88    HA   ALA  12           HA       ALA  12  50.427   6.387  -0.646
   89    HB1  ALA  12           HB1      ALA  12  53.057   7.093   0.378
   90    HB2  ALA  12           HB2      ALA  12  52.828   6.776  -1.346
   91    HB3  ALA  12           HB3      ALA  12  52.538   5.499  -0.137
   92    H    ALA  13           HN       ALA  13  51.792   8.951   1.356
   93    HA   ALA  13           HA       ALA  13  51.152   7.605   3.877
   94    HB1  ALA  13           HB1      ALA  13  52.455   9.658   4.115
   95    HB2  ALA  13           HB2      ALA  13  50.793  10.095   4.581
   96    HB3  ALA  13           HB3      ALA  13  51.409  10.525   2.967
   97    H    LYS  14           HN       LYS  14  50.245   8.064   0.862
   98    HA   LYS  14           HA       LYS  14  47.196   8.415   1.465
   99    HB2  LYS  14           HB2      LYS  14  48.605   9.980  -0.090
  100    HB3  LYS  14           HB1      LYS  14  48.746   8.527  -1.146
  101    HG2  LYS  14           HG2      LYS  14  46.555   8.748  -1.897
  102    HG3  LYS  14           HG1      LYS  14  45.929   9.233  -0.305
  103    HD2  LYS  14           HD2      LYS  14  46.742  11.517  -0.637
  104    HD3  LYS  14           HD1      LYS  14  47.526  11.048  -2.165
  105    HE2  LYS  14           HE2      LYS  14  45.349  10.501  -3.156
  106    HE3  LYS  14           HE1      LYS  14  44.532  10.856  -1.615
  107    HZ1  LYS  14           HZ1      LYS  14  45.186  12.638  -3.661
  108    HZ2  LYS  14           HZ2      LYS  14  46.165  13.040  -2.333
  109    HZ3  LYS  14           HZ3      LYS  14  44.476  12.989  -2.162
  110    H    HIS  15           HN       HIS  15  46.172   7.484  -0.775
  111    HA   HIS  15           HA       HIS  15  45.269   5.434  -1.477
  112    HB2  HIS  15           HB2      HIS  15  46.995   6.213  -3.146
  113    HB3  HIS  15           HB1      HIS  15  48.150   5.096  -2.382
  114    HD1  HIS  15           HD1      HIS  15  44.707   5.059  -4.080
  115    HD2  HIS  15           HD2      HIS  15  47.967   2.507  -3.350
  116    HE1  HIS  15           HE1      HIS  15  44.233   2.856  -5.284
  117    H    ILE  16           HN       ILE  16  46.660   5.375   1.238
  118    HA   ILE  16           HA       ILE  16  46.179   2.838   1.927
  119    HB   ILE  16           HB       ILE  16  47.869   1.796   0.621
  120   HG12  ILE  16          HG12      ILE  16  49.508   2.132   3.148
  121   HG13  ILE  16          HG11      ILE  16  47.897   1.408   3.290
  122   HG21  ILE  16          HG21      ILE  16  50.287   2.660   0.728
  123   HG22  ILE  16          HG22      ILE  16  49.657   4.083   1.555
  124   HG23  ILE  16          HG23      ILE  16  49.167   3.748  -0.114
  125   HD11  ILE  16           HD1      ILE  16  49.917   0.409   1.249
  126   HD12  ILE  16           HD2      ILE  16  48.454  -0.405   1.847
  127   HD13  ILE  16           HD3      ILE  16  49.864  -0.211   2.915
  128    H    GLY  17           HN       GLY  17  48.412   5.264   2.253
  129    HA2  GLY  17           HA1      GLY  17  48.458   5.083   5.183
  130    HA3  GLY  17           HA2      GLY  17  49.139   6.395   4.198
  131    H    HIS  18           HN       HIS  18  46.450   6.070   2.606
  132    HA   HIS  18           HA       HIS  18  44.976   8.089   4.278
  133    HB2  HIS  18           HB2      HIS  18  45.118   7.355   1.387
  134    HB3  HIS  18           HB1      HIS  18  43.476   7.713   1.950
  135    HD1  HIS  18           HD1      HIS  18  43.453   9.930   0.551
  136    HD2  HIS  18           HD2      HIS  18  46.441   9.785   3.508
  137    HE1  HIS  18           HE1      HIS  18  44.325  12.310   0.873
  138    H    ALA  19           HN       ALA  19  44.516   4.814   2.783
  139    HA   ALA  19           HA       ALA  19  42.720   4.084   4.965
  140    HB1  ALA  19           HB1      ALA  19  41.292   5.661   3.554
  141    HB2  ALA  19           HB2      ALA  19  40.619   4.042   3.853
  142    HB3  ALA  19           HB3      ALA  19  41.362   4.421   2.278
  143    H    ALA  20           HN       ALA  20  45.013   2.888   3.747
  144    HA   ALA  20           HA       ALA  20  45.659   0.765   3.085
  145    HB1  ALA  20           HB1      ALA  20  44.261  -1.060   3.505
  146    HB2  ALA  20           HB2      ALA  20  42.789  -0.183   3.023
  147    HB3  ALA  20           HB3      ALA  20  43.579   0.187   4.575
  148    H    VAL  21           HN       VAL  21  43.287   2.616   1.372
  149    HA   VAL  21           HA       VAL  21  44.300   1.488  -1.189
  150    HB   VAL  21           HB       VAL  21  41.306   1.708  -0.647
  151   HG11  VAL  21          HG11      VAL  21  41.942   2.079  -2.983
  152   HG12  VAL  21          HG12      VAL  21  41.200   0.469  -2.829
  153   HG13  VAL  21          HG13      VAL  21  42.968   0.625  -2.967
  154   HG21  VAL  21          HG21      VAL  21  41.392  -0.823  -0.844
  155   HG22  VAL  21          HG22      VAL  21  42.136  -0.177   0.637
  156   HG23  VAL  21          HG23      VAL  21  43.163  -0.711  -0.715
  157    H    ASN  22           HN       ASN  22  42.419   3.859   0.636
  158    HA   ASN  22           HA       ASN  22  43.390   6.209  -0.275
  159    HB2  ASN  22           HB2      ASN  22  43.157   5.920  -2.608
  160    HB3  ASN  22           HB1      ASN  22  41.605   5.066  -2.448
  161   HD21  ASN  22          HD21      ASN  22  40.535   6.549  -3.949
  162   HD22  ASN  22          HD22      ASN  22  40.175   8.211  -3.469
  163    H    HIS  23           HN       HIS  23  40.244   4.501  -0.195
  164    HA   HIS  23           HA       HIS  23  39.382   6.140   2.066
  165    HB2  HIS  23           HB2      HIS  23  38.961   7.699   0.168
  166    HB3  HIS  23           HB1      HIS  23  37.922   6.467  -0.588
  167    HD1  HIS  23           HD1      HIS  23  38.120   7.471   3.113
  168    HD2  HIS  23           HD2      HIS  23  35.369   7.410  -0.067
  169    HE1  HIS  23           HE1      HIS  23  35.861   8.218   4.045
  170    H    TYR  24           HN       TYR  24  36.653   5.435   0.285
  171    HA   TYR  24           HA       TYR  24  35.031   3.798   0.551
  172    HB2  TYR  24           HB2      TYR  24  36.749   2.560  -0.828
  173    HB3  TYR  24           HB1      TYR  24  37.384   1.872   0.687
  174    HD1  TYR  24           HD1      TYR  24  34.257   2.214  -1.369
  175    HD2  TYR  24           HD2      TYR  24  36.329  -0.019   1.691
  176    HE1  TYR  24           HE1      TYR  24  32.471   0.478  -1.422
  177    HE2  TYR  24           HE2      TYR  24  34.541  -1.753   1.636
  178    HH   TYR  24           HH       TYR  24  32.200  -1.928   1.029
  179    H    LEU  25           HN       LEU  25  36.599   4.957   2.959
  180    HA   LEU  25           HA       LEU  25  35.125   3.431   4.960
  181    HB2  LEU  25           HB2      LEU  25  37.229   2.037   4.538
  182    HB3  LEU  25           HB1      LEU  25  38.157   3.410   5.177
  183    HG   LEU  25           HG       LEU  25  36.496   3.236   7.244
  184   HD11  LEU  25          HD11      LEU  25  35.868   0.827   7.674
  185   HD12  LEU  25          HD12      LEU  25  36.286   0.459   5.987
  186   HD13  LEU  25          HD13      LEU  25  34.948   1.574   6.351
  187   HD21  LEU  25          HD21      LEU  25  38.928   2.796   7.348
  188   HD22  LEU  25          HD22      LEU  25  38.663   1.148   6.732
  189   HD23  LEU  25          HD23      LEU  25  38.029   1.615   8.329
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1  67.519  18.790   2.156
    2    H2   GLY   1           HT2      GLY   1  66.153  19.148   3.102
    3    H3   GLY   1           HT3      GLY   1  66.108  19.370   1.418
    4    HA2  GLY   1           HA1      GLY   1  66.670  16.741   2.562
    5    HA3  GLY   1           HA2      GLY   1  65.003  17.337   2.438
    6    H    TRP   2           HN       TRP   2  64.686  15.488   1.016
    7    HA   TRP   2           HA       TRP   2  66.081  15.302  -1.503
    8    HB2  TRP   2           HB2      TRP   2  63.310  14.293  -0.745
    9    HB3  TRP   2           HB1      TRP   2  64.284  13.753  -2.133
   10    HD1  TRP   2           HD1      TRP   2  66.361  12.204  -1.659
   11    HE1  TRP   2           HE1      TRP   2  67.121  10.804   0.396
   12    HE3  TRP   2           HE3      TRP   2  63.315  14.272   1.896
   13    HZ2  TRP   2           HZ2      TRP   2  66.473  10.632   3.196
   14    HZ3  TRP   2           HZ3      TRP   2  63.401  13.475   4.253
   15    HH2  TRP   2           HH2      TRP   2  64.977  11.658   4.907
   16    H    GLY   3           HN       GLY   3  64.744  15.356  -3.623
   17    HA2  GLY   3           HA1      GLY   3  63.921  18.127  -3.981
   18    HA3  GLY   3           HA2      GLY   3  63.961  16.855  -5.219
   19    H    SER   4           HN       SER   4  62.302  15.563  -2.676
   20    HA   SER   4           HA       SER   4  59.821  15.441  -3.998
   21    HB2  SER   4           HB2      SER   4  58.920  14.612  -1.947
   22    HB3  SER   4           HB1      SER   4  60.623  14.100  -1.975
   23    HG   SER   4           HG       SER   4  61.002  15.361  -0.327
   24    H    ILE   5           HN       ILE   5  58.993  17.315  -4.822
   25    HA   ILE   5           HA       ILE   5  58.823  19.741  -3.204
   26    HB   ILE   5           HB       ILE   5  57.243  19.166  -5.745
   27   HG12  ILE   5          HG12      ILE   5  60.154  20.040  -5.446
   28   HG13  ILE   5          HG11      ILE   5  59.576  18.520  -6.169
   29   HG21  ILE   5          HG21      ILE   5  58.534  21.756  -4.800
   30   HG22  ILE   5          HG22      ILE   5  56.901  21.277  -4.283
   31   HG23  ILE   5          HG23      ILE   5  57.246  21.538  -6.009
   32   HD11  ILE   5           HD1      ILE   5  58.235  20.020  -7.808
   33   HD12  ILE   5           HD2      ILE   5  59.998  19.941  -8.029
   34   HD13  ILE   5           HD3      ILE   5  59.266  21.351  -7.228
   35    H    PHE   6           HN       PHE   6  56.592  17.149  -4.224
   36    HA   PHE   6           HA       PHE   6  54.760  17.925  -1.999
   37    HB2  PHE   6           HB2      PHE   6  53.810  17.587  -4.873
   38    HB3  PHE   6           HB1      PHE   6  52.789  17.889  -3.449
   39    HD1  PHE   6           HD1      PHE   6  53.514  20.002  -1.984
   40    HD2  PHE   6           HD2      PHE   6  54.487  19.458  -6.157
   41    HE1  PHE   6           HE1      PHE   6  53.851  22.458  -2.228
   42    HE2  PHE   6           HE2      PHE   6  54.824  21.913  -6.397
   43    HZ   PHE   6           HZ       PHE   6  54.482  23.416  -4.440
   44    H    LYS   7           HN       LYS   7  56.261  15.663  -4.091
   45    HA   LYS   7           HA       LYS   7  54.538  13.458  -4.074
   46    HB2  LYS   7           HB2      LYS   7  56.761  13.558  -5.202
   47    HB3  LYS   7           HB1      LYS   7  57.546  13.384  -3.616
   48    HG2  LYS   7           HG2      LYS   7  56.556  11.203  -3.278
   49    HG3  LYS   7           HG1      LYS   7  55.520  11.392  -4.714
   50    HD2  LYS   7           HD2      LYS   7  57.553  11.499  -6.148
   51    HD3  LYS   7           HD1      LYS   7  58.566  11.244  -4.706
   52    HE2  LYS   7           HE2      LYS   7  58.191   9.112  -5.906
   53    HE3  LYS   7           HE1      LYS   7  57.436   9.077  -4.294
   54    HZ1  LYS   7           HZ1      LYS   7  56.218   8.759  -6.815
   55    HZ2  LYS   7           HZ2      LYS   7  55.576  10.150  -6.078
   56    HZ3  LYS   7           HZ3      LYS   7  55.512   8.653  -5.276
   57    H    HIS   8           HN       HIS   8  57.312  13.545  -1.813
   58    HA   HIS   8           HA       HIS   8  55.839  11.872   0.085
   59    HB2  HIS   8           HB2      HIS   8  58.541  13.262   0.237
   60    HB3  HIS   8           HB1      HIS   8  57.906  12.152   1.475
   61    HD1  HIS   8           HD1      HIS   8  56.775   9.841   0.016
   62    HD2  HIS   8           HD2      HIS   8  60.263  11.776  -1.321
   63    HE1  HIS   8           HE1      HIS   8  58.030   8.197  -1.486
   64    H    GLY   9           HN       GLY   9  54.071  13.651   0.086
   65    HA2  GLY   9           HA1      GLY   9  54.098  14.857   2.672
   66    HA3  GLY   9           HA2      GLY   9  54.483  16.100   1.465
   67    H    ARG  10           HN       ARG  10  52.771  14.223  -0.405
   68    HA   ARG  10           HA       ARG  10  50.050  14.860   0.626
   69    HB2  ARG  10           HB2      ARG  10  51.173  15.986  -1.973
   70    HB3  ARG  10           HB1      ARG  10  49.452  16.004  -1.517
   71    HG2  ARG  10           HG2      ARG  10  50.135  17.231   0.609
   72    HG3  ARG  10           HG1      ARG  10  51.762  17.393  -0.098
   73    HD2  ARG  10           HD2      ARG  10  50.522  19.415  -0.614
   74    HD3  ARG  10           HD1      ARG  10  50.695  18.478  -2.118
   75    HE   ARG  10           HE       ARG  10  48.234  17.751  -0.835
   76   HH11  ARG  10          HH11      ARG  10  48.955  20.908  -1.002
   77   HH12  ARG  10          HH12      ARG  10  47.868  21.328  -2.283
   78   HH21  ARG  10          HH21      ARG  10  47.181  18.039  -3.137
   79   HH22  ARG  10          HH22      ARG  10  46.864  19.704  -3.491
   80    H    HIS  11           HN       HIS  11  52.003  12.605  -0.336
   81    HA   HIS  11           HA       HIS  11  49.850  11.031  -1.586
   82    HB2  HIS  11           HB2      HIS  11  52.476  11.526  -3.048
   83    HB3  HIS  11           HB1      HIS  11  51.253  10.318  -3.510
   84    HD1  HIS  11           HD1      HIS  11  48.987  11.168  -4.484
   85    HD2  HIS  11           HD2      HIS  11  51.708  14.236  -3.556
   86    HE1  HIS  11           HE1      HIS  11  48.133  13.305  -5.594
   87    H    ALA  12           HN       ALA  12  50.000   8.979  -1.429
   88    HA   ALA  12           HA       ALA  12  50.594   6.923  -0.618
   89    HB1  ALA  12           HB1      ALA  12  52.838   6.480  -0.114
   90    HB2  ALA  12           HB2      ALA  12  53.071   8.193   0.236
   91    HB3  ALA  12           HB3      ALA  12  52.875   7.666  -1.438
   92    H    ALA  13           HN       ALA  13  51.495   9.882   1.070
   93    HA   ALA  13           HA       ALA  13  51.163   8.713   3.735
   94    HB1  ALA  13           HB1      ALA  13  52.033  10.961   3.823
   95    HB2  ALA  13           HB2      ALA  13  50.294  11.189   4.122
   96    HB3  ALA  13           HB3      ALA  13  50.969  11.508   2.506
   97    H    LYS  14           HN       LYS  14  50.136   8.678   0.726
   98    HA   LYS  14           HA       LYS  14  47.087   8.521   1.401
   99    HB2  LYS  14           HB2      LYS  14  48.144  10.157  -0.356
  100    HB3  LYS  14           HB1      LYS  14  48.536   8.654  -1.269
  101    HG2  LYS  14           HG2      LYS  14  46.330   8.393  -1.961
  102    HG3  LYS  14           HG1      LYS  14  45.654   8.863  -0.390
  103    HD2  LYS  14           HD2      LYS  14  44.953  10.515  -1.992
  104    HD3  LYS  14           HD1      LYS  14  46.207  11.282  -0.992
  105    HE2  LYS  14           HE2      LYS  14  47.884  10.541  -2.801
  106    HE3  LYS  14           HE1      LYS  14  46.470  10.166  -3.810
  107    HZ1  LYS  14           HZ1      LYS  14  47.656  12.672  -3.304
  108    HZ2  LYS  14           HZ2      LYS  14  46.068  12.693  -2.699
  109    HZ3  LYS  14           HZ3      LYS  14  46.355  12.302  -4.328
  110    H    HIS  15           HN       HIS  15  46.224   7.181  -0.701
  111    HA   HIS  15           HA       HIS  15  45.724   4.941  -1.170
  112    HB2  HIS  15           HB2      HIS  15  47.209   5.810  -2.979
  113    HB3  HIS  15           HB1      HIS  15  48.604   5.110  -2.124
  114    HD1  HIS  15           HD1      HIS  15  49.258   3.054  -3.386
  115    HD2  HIS  15           HD2      HIS  15  45.086   3.395  -2.973
  116    HE1  HIS  15           HE1      HIS  15  48.222   0.924  -4.341
  117    H    ILE  16           HN       ILE  16  47.194   5.440   1.490
  118    HA   ILE  16           HA       ILE  16  47.166   2.936   2.454
  119    HB   ILE  16           HB       ILE  16  48.982   2.108   1.163
  120   HG12  ILE  16          HG12      ILE  16  50.359   2.990   3.730
  121   HG13  ILE  16          HG11      ILE  16  49.083   1.754   3.728
  122   HG21  ILE  16          HG21      ILE  16  50.336   4.743   1.874
  123   HG22  ILE  16          HG22      ILE  16  49.901   4.189   0.248
  124   HG23  ILE  16          HG23      ILE  16  51.210   3.394   1.143
  125   HD11  ILE  16           HD1      ILE  16  50.561   0.597   1.862
  126   HD12  ILE  16           HD2      ILE  16  51.045   0.458   3.565
  127   HD13  ILE  16           HD3      ILE  16  51.859   1.628   2.508
  128    H    GLY  17           HN       GLY  17  48.842   5.793   2.449
  129    HA2  GLY  17           HA1      GLY  17  49.007   5.902   5.389
  130    HA3  GLY  17           HA2      GLY  17  49.405   7.214   4.262
  131    H    HIS  18           HN       HIS  18  46.823   6.213   2.802
  132    HA   HIS  18           HA       HIS  18  44.986   8.061   4.311
  133    HB2  HIS  18           HB2      HIS  18  45.241   7.074   1.502
  134    HB3  HIS  18           HB1      HIS  18  43.566   7.178   2.080
  135    HD1  HIS  18           HD1      HIS  18  46.223   9.577   3.333
  136    HD2  HIS  18           HD2      HIS  18  43.029   9.540   0.595
  137    HE1  HIS  18           HE1      HIS  18  45.805  11.995   2.618
  138    H    ALA  19           HN       ALA  19  45.120   4.678   3.039
  139    HA   ALA  19           HA       ALA  19  43.974   3.418   5.254
  140    HB1  ALA  19           HB1      ALA  19  41.868   4.634   3.446
  141    HB2  ALA  19           HB2      ALA  19  41.912   4.567   5.226
  142    HB3  ALA  19           HB3      ALA  19  41.540   3.105   4.295
  143    H    ALA  20           HN       ALA  20  45.360   3.436   2.383
  144    HA   ALA  20           HA       ALA  20  45.853   1.803   0.808
  145    HB1  ALA  20           HB1      ALA  20  44.581  -0.215   2.685
  146    HB2  ALA  20           HB2      ALA  20  46.189   0.486   2.987
  147    HB3  ALA  20           HB3      ALA  20  45.895  -0.467   1.513
  148    H    VAL  21           HN       VAL  21  43.015   2.976   1.465
  149    HA   VAL  21           HA       VAL  21  41.644   1.536  -0.766
  150    HB   VAL  21           HB       VAL  21  40.389   2.118   1.959
  151   HG11  VAL  21          HG11      VAL  21  39.251   1.213  -0.714
  152   HG12  VAL  21          HG12      VAL  21  38.677   2.512   0.359
  153   HG13  VAL  21          HG13      VAL  21  38.436   0.814   0.818
  154   HG21  VAL  21          HG21      VAL  21  40.095  -0.368   2.017
  155   HG22  VAL  21          HG22      VAL  21  41.808   0.106   1.973
  156   HG23  VAL  21          HG23      VAL  21  41.014  -0.490   0.498
  157    H    ASN  22           HN       ASN  22  42.639   4.285   0.891
  158    HA   ASN  22           HA       ASN  22  42.598   6.469  -0.085
  159    HB2  ASN  22           HB2      ASN  22  41.169   5.587  -2.044
  160    HB3  ASN  22           HB1      ASN  22  39.752   6.003  -1.043
  161   HD21  ASN  22          HD21      ASN  22  41.441   7.228  -3.564
  162   HD22  ASN  22          HD22      ASN  22  41.350   8.952  -3.191
  163    H    HIS  23           HN       HIS  23  39.866   4.917   1.496
  164    HA   HIS  23           HA       HIS  23  38.858   5.476   3.521
  165    HB2  HIS  23           HB2      HIS  23  41.114   6.800   3.959
  166    HB3  HIS  23           HB1      HIS  23  40.134   8.233   3.585
  167    HD1  HIS  23           HD1      HIS  23  38.977   5.095   5.456
  168    HD2  HIS  23           HD2      HIS  23  39.741   9.165   6.190
  169    HE1  HIS  23           HE1      HIS  23  38.132   5.616   7.810
  170    H    TYR  24           HN       TYR  24  37.808   7.957   4.353
  171    HA   TYR  24           HA       TYR  24  35.870   9.181   3.966
  172    HB2  TYR  24           HB2      TYR  24  37.204   9.523   1.250
  173    HB3  TYR  24           HB1      TYR  24  35.865  10.515   1.871
  174    HD1  TYR  24           HD1      TYR  24  39.465   9.969   1.908
  175    HD2  TYR  24           HD2      TYR  24  36.199  11.819   4.039
  176    HE1  TYR  24           HE1      TYR  24  41.083  11.412   3.135
  177    HE2  TYR  24           HE2      TYR  24  37.818  13.263   5.265
  178    HH   TYR  24           HH       TYR  24  39.962  13.771   5.582
  179    H    LEU  25           HN       LEU  25  35.773   6.297   3.413
  180    HA   LEU  25           HA       LEU  25  34.386   5.702   1.016
  181    HB2  LEU  25           HB2      LEU  25  35.223   3.925   2.419
  182    HB3  LEU  25           HB1      LEU  25  34.237   4.467   3.793
  183    HG   LEU  25           HG       LEU  25  32.185   3.810   2.680
  184   HD11  LEU  25          HD11      LEU  25  33.999   3.443   0.262
  185   HD12  LEU  25          HD12      LEU  25  32.514   4.417   0.398
  186   HD13  LEU  25          HD13      LEU  25  32.412   2.642   0.368
  187   HD21  LEU  25          HD21      LEU  25  34.306   1.665   2.228
  188   HD22  LEU  25          HD22      LEU  25  32.559   1.394   2.432
  189   HD23  LEU  25          HD23      LEU  25  33.527   2.021   3.786
  Start of MODEL   21
    1    H1   GLY   1           HT1      GLY   1  70.733  16.489  -8.546
    2    H2   GLY   1           HT2      GLY   1  70.709  15.360  -7.276
    3    H3   GLY   1           HT3      GLY   1  69.718  16.739  -7.212
    4    HA2  GLY   1           HA1      GLY   1  69.160  15.443  -9.583
    5    HA3  GLY   1           HA2      GLY   1  69.186  14.226  -8.291
    6    H    TRP   2           HN       TRP   2  66.990  13.847  -8.278
    7    HA   TRP   2           HA       TRP   2  65.025  15.950  -8.188
    8    HB2  TRP   2           HB2      TRP   2  64.820  13.085  -7.177
    9    HB3  TRP   2           HB1      TRP   2  63.462  14.173  -7.549
   10    HD1  TRP   2           HD1      TRP   2  65.536  11.570  -9.081
   11    HE1  TRP   2           HE1      TRP   2  65.288  11.526 -11.669
   12    HE3  TRP   2           HE3      TRP   2  63.192  16.073  -9.743
   13    HZ2  TRP   2           HZ2      TRP   2  64.209  13.233 -13.721
   14    HZ3  TRP   2           HZ3      TRP   2  62.562  16.844 -12.025
   15    HH2  TRP   2           HH2      TRP   2  63.068  15.431 -14.013
   16    H    GLY   3           HN       GLY   3  63.355  15.254  -6.074
   17    HA2  GLY   3           HA1      GLY   3  64.669  15.233  -3.532
   18    HA3  GLY   3           HA2      GLY   3  64.333  16.911  -4.000
   19    H    SER   4           HN       SER   4  62.241  14.373  -5.150
   20    HA   SER   4           HA       SER   4  59.990  13.987  -4.741
   21    HB2  SER   4           HB2      SER   4  60.675  14.653  -1.856
   22    HB3  SER   4           HB1      SER   4  59.330  13.650  -2.442
   23    HG   SER   4           HG       SER   4  60.985  12.283  -1.860
   24    H    ILE   5           HN       ILE   5  59.424  15.878  -5.974
   25    HA   ILE   5           HA       ILE   5  59.022  18.426  -4.640
   26    HB   ILE   5           HB       ILE   5  57.572  18.867  -6.784
   27   HG12  ILE   5          HG12      ILE   5  59.003  16.315  -7.667
   28   HG13  ILE   5          HG11      ILE   5  57.294  16.342  -7.189
   29   HG21  ILE   5          HG21      ILE   5  59.589  19.223  -8.128
   30   HG22  ILE   5          HG22      ILE   5  60.501  18.071  -7.124
   31   HG23  ILE   5          HG23      ILE   5  59.948  19.613  -6.433
   32   HD11  ILE   5           HD1      ILE   5  58.621  17.657  -9.581
   33   HD12  ILE   5           HD2      ILE   5  57.063  18.262  -8.968
   34   HD13  ILE   5           HD3      ILE   5  57.204  16.585  -9.540
   35    H    PHE   6           HN       PHE   6  57.818  17.955  -2.782
   36    HA   PHE   6           HA       PHE   6  55.863  17.731  -1.562
   37    HB2  PHE   6           HB2      PHE   6  54.468  18.437  -4.172
   38    HB3  PHE   6           HB1      PHE   6  53.827  18.629  -2.523
   39    HD1  PHE   6           HD1      PHE   6  54.747  20.347  -0.996
   40    HD2  PHE   6           HD2      PHE   6  56.145  19.970  -5.062
   41    HE1  PHE   6           HE1      PHE   6  55.812  22.594  -0.838
   42    HE2  PHE   6           HE2      PHE   6  57.209  22.217  -4.904
   43    HZ   PHE   6           HZ       PHE   6  56.957  23.568  -2.826
   44    H    LYS   7           HN       LYS   7  56.871  15.536  -3.616
   45    HA   LYS   7           HA       LYS   7  54.476  13.967  -4.125
   46    HB2  LYS   7           HB2      LYS   7  56.593  13.772  -5.447
   47    HB3  LYS   7           HB1      LYS   7  57.380  13.058  -4.019
   48    HG2  LYS   7           HG2      LYS   7  55.822  11.190  -4.017
   49    HG3  LYS   7           HG1      LYS   7  54.856  11.939  -5.311
   50    HD2  LYS   7           HD2      LYS   7  56.685  11.712  -6.895
   51    HD3  LYS   7           HD1      LYS   7  57.787  11.159  -5.612
   52    HE2  LYS   7           HE2      LYS   7  56.951   9.236  -6.913
   53    HE3  LYS   7           HE1      LYS   7  56.340   9.168  -5.242
   54    HZ1  LYS   7           HZ1      LYS   7  54.235   9.737  -5.897
   55    HZ2  LYS   7           HZ2      LYS   7  54.736   8.850  -7.257
   56    HZ3  LYS   7           HZ3      LYS   7  54.746  10.548  -7.297
   57    H    HIS   8           HN       HIS   8  57.252  13.519  -1.880
   58    HA   HIS   8           HA       HIS   8  55.775  11.479  -0.365
   59    HB2  HIS   8           HB2      HIS   8  58.248  11.401  -0.673
   60    HB3  HIS   8           HB1      HIS   8  58.392  12.898   0.281
   61    HD1  HIS   8           HD1      HIS   8  55.642  10.860   1.553
   62    HD2  HIS   8           HD2      HIS   8  59.800  11.037   2.155
   63    HE1  HIS   8           HE1      HIS   8  56.157   9.565   3.694
   64    H    GLY   9           HN       GLY   9  54.309  13.864  -0.482
   65    HA2  GLY   9           HA1      GLY   9  54.013  14.385   2.394
   66    HA3  GLY   9           HA2      GLY   9  54.552  15.789   1.450
   67    H    ARG  10           HN       ARG  10  52.863  14.066  -0.723
   68    HA   ARG  10           HA       ARG  10  50.148  14.965   0.143
   69    HB2  ARG  10           HB2      ARG  10  51.328  15.753  -2.549
   70    HB3  ARG  10           HB1      ARG  10  49.748  16.220  -1.872
   71    HG2  ARG  10           HG2      ARG  10  51.046  17.304   0.060
   72    HG3  ARG  10           HG1      ARG  10  52.514  17.065  -0.918
   73    HD2  ARG  10           HD2      ARG  10  51.604  19.324  -1.289
   74    HD3  ARG  10           HD1      ARG  10  51.464  18.355  -2.775
   75    HE   ARG  10           HE       ARG  10  49.054  18.107  -1.220
   76   HH11  ARG  10          HH11      ARG  10  47.363  19.623  -1.510
   77   HH12  ARG  10          HH12      ARG  10  47.505  20.791  -2.782
   78   HH21  ARG  10          HH21      ARG  10  50.756  19.901  -3.593
   79   HH22  ARG  10          HH22      ARG  10  49.426  20.947  -3.961
   80    H    HIS  11           HN       HIS  11  52.061  12.561  -0.833
   81    HA   HIS  11           HA       HIS  11  49.805  11.028  -1.910
   82    HB2  HIS  11           HB2      HIS  11  52.265  11.540  -3.632
   83    HB3  HIS  11           HB1      HIS  11  51.014  10.321  -3.974
   84    HD1  HIS  11           HD1      HIS  11  48.407  11.567  -3.747
   85    HD2  HIS  11           HD2      HIS  11  51.705  13.777  -5.136
   86    HE1  HIS  11           HE1      HIS  11  47.491  13.585  -5.018
   87    H    ALA  12           HN       ALA  12  49.948   8.977  -1.776
   88    HA   ALA  12           HA       ALA  12  50.602   6.906  -1.051
   89    HB1  ALA  12           HB1      ALA  12  53.182   8.140  -0.500
   90    HB2  ALA  12           HB2      ALA  12  52.771   7.630  -2.140
   91    HB3  ALA  12           HB3      ALA  12  52.893   6.439  -0.819
   92    H    ALA  13           HN       ALA  13  51.769   9.829   0.546
   93    HA   ALA  13           HA       ALA  13  51.734   8.632   3.217
   94    HB1  ALA  13           HB1      ALA  13  52.688  10.964   2.797
   95    HB2  ALA  13           HB2      ALA  13  51.332  10.982   3.951
   96    HB3  ALA  13           HB3      ALA  13  51.072  11.482   2.262
   97    H    LYS  14           HN       LYS  14  50.343   8.672   0.354
   98    HA   LYS  14           HA       LYS  14  47.396   8.576   1.401
   99    HB2  LYS  14           HB2      LYS  14  48.279  10.189  -0.463
  100    HB3  LYS  14           HB1      LYS  14  48.515   8.682  -1.423
  101    HG2  LYS  14           HG2      LYS  14  46.230   8.474  -1.825
  102    HG3  LYS  14           HG1      LYS  14  45.768   9.023  -0.199
  103    HD2  LYS  14           HD2      LYS  14  46.082  11.348  -0.829
  104    HD3  LYS  14           HD1      LYS  14  46.785  10.876  -2.394
  105    HE2  LYS  14           HE2      LYS  14  43.951  10.183  -1.512
  106    HE3  LYS  14           HE1      LYS  14  44.367  11.567  -2.550
  107    HZ1  LYS  14           HZ1      LYS  14  43.861   9.891  -4.046
  108    HZ2  LYS  14           HZ2      LYS  14  44.609   8.676  -3.125
  109    HZ3  LYS  14           HZ3      LYS  14  45.552   9.809  -3.970
  110    H    HIS  15           HN       HIS  15  46.238   7.292  -0.560
  111    HA   HIS  15           HA       HIS  15  45.601   5.076  -0.971
  112    HB2  HIS  15           HB2      HIS  15  46.891   5.938  -2.952
  113    HB3  HIS  15           HB1      HIS  15  48.333   5.119  -2.303
  114    HD1  HIS  15           HD1      HIS  15  45.140   3.349  -1.647
  115    HD2  HIS  15           HD2      HIS  15  48.032   3.403  -4.699
  116    HE1  HIS  15           HE1      HIS  15  44.797   1.247  -3.058
  117    H    ILE  16           HN       ILE  16  47.423   5.491   1.465
  118    HA   ILE  16           HA       ILE  16  47.448   2.971   2.397
  119    HB   ILE  16           HB       ILE  16  49.062   2.133   0.857
  120   HG12  ILE  16          HG12      ILE  16  51.037   1.609   2.227
  121   HG13  ILE  16          HG11      ILE  16  50.599   2.879   3.385
  122   HG21  ILE  16          HG21      ILE  16  51.311   3.342   0.599
  123   HG22  ILE  16          HG22      ILE  16  50.569   4.708   1.440
  124   HG23  ILE  16          HG23      ILE  16  49.924   4.187  -0.128
  125   HD11  ILE  16           HD1      ILE  16  49.892   0.487   4.001
  126   HD12  ILE  16           HD2      ILE  16  48.719   0.591   2.667
  127   HD13  ILE  16           HD3      ILE  16  48.602   1.709   4.045
  128    H    GLY  17           HN       GLY  17  49.208   5.772   2.204
  129    HA2  GLY  17           HA1      GLY  17  49.712   5.860   5.103
  130    HA3  GLY  17           HA2      GLY  17  50.006   7.171   3.942
  131    H    HIS  18           HN       HIS  18  47.229   6.254   2.794
  132    HA   HIS  18           HA       HIS  18  45.644   8.118   4.554
  133    HB2  HIS  18           HB2      HIS  18  45.520   7.195   1.709
  134    HB3  HIS  18           HB1      HIS  18  43.939   7.363   2.496
  135    HD1  HIS  18           HD1      HIS  18  43.439   9.423   0.923
  136    HD2  HIS  18           HD2      HIS  18  46.712   9.953   3.508
  137    HE1  HIS  18           HE1      HIS  18  43.972  11.921   0.976
  138    H    ALA  19           HN       ALA  19  45.495   4.767   3.175
  139    HA   ALA  19           HA       ALA  19  44.558   3.516   5.504
  140    HB1  ALA  19           HB1      ALA  19  42.547   4.689   5.737
  141    HB2  ALA  19           HB2      ALA  19  42.010   3.325   4.735
  142    HB3  ALA  19           HB3      ALA  19  42.351   4.903   3.982
  143    H    ALA  20           HN       ALA  20  45.696   3.448   2.552
  144    HA   ALA  20           HA       ALA  20  45.992   1.784   0.957
  145    HB1  ALA  20           HB1      ALA  20  44.727  -0.148   2.926
  146    HB2  ALA  20           HB2      ALA  20  46.389   0.460   3.118
  147    HB3  ALA  20           HB3      ALA  20  45.946  -0.481   1.674
  148    H    VAL  21           HN       VAL  21  43.217   3.059   1.817
  149    HA   VAL  21           HA       VAL  21  41.706   1.761  -0.400
  150    HB   VAL  21           HB       VAL  21  40.540   2.180   2.395
  151   HG11  VAL  21          HG11      VAL  21  38.782   2.521   0.828
  152   HG12  VAL  21          HG12      VAL  21  38.624   0.808   1.268
  153   HG13  VAL  21          HG13      VAL  21  39.391   1.262  -0.271
  154   HG21  VAL  21          HG21      VAL  21  41.319  -0.353   0.878
  155   HG22  VAL  21          HG22      VAL  21  40.341  -0.343   2.365
  156   HG23  VAL  21          HG23      VAL  21  42.020   0.240   2.402
  157    H    ASN  22           HN       ASN  22  42.823   4.346   1.397
  158    HA   ASN  22           HA       ASN  22  42.735   6.602   0.613
  159    HB2  ASN  22           HB2      ASN  22  41.136   5.918  -1.296
  160    HB3  ASN  22           HB1      ASN  22  39.813   6.253  -0.150
  161   HD21  ASN  22          HD21      ASN  22  42.149   7.692  -2.318
  162   HD22  ASN  22          HD22      ASN  22  41.762   9.373  -1.937
  163    H    HIS  23           HN       HIS  23  40.089   4.927   2.255
  164    HA   HIS  23           HA       HIS  23  40.429   6.474   4.655
  165    HB2  HIS  23           HB2      HIS  23  39.331   8.253   3.316
  166    HB3  HIS  23           HB1      HIS  23  37.961   7.162   3.003
  167    HD1  HIS  23           HD1      HIS  23  39.837   7.609   6.312
  168    HD2  HIS  23           HD2      HIS  23  36.010   8.209   4.680
  169    HE1  HIS  23           HE1      HIS  23  38.306   8.355   8.216
  170    H    TYR  24           HN       TYR  24  40.274   4.689   5.869
  171    HA   TYR  24           HA       TYR  24  37.661   3.586   6.389
  172    HB2  TYR  24           HB2      TYR  24  38.219   2.439   4.195
  173    HB3  TYR  24           HB1      TYR  24  39.590   1.666   5.027
  174    HD1  TYR  24           HD1      TYR  24  39.234  -0.045   6.736
  175    HD2  TYR  24           HD2      TYR  24  35.892   1.897   4.818
  176    HE1  TYR  24           HE1      TYR  24  37.698  -1.777   7.659
  177    HE2  TYR  24           HE2      TYR  24  34.357   0.166   5.739
  178    HH   TYR  24           HH       TYR  24  35.397  -2.661   7.346
  179    H    LEU  25           HN       LEU  25  40.877   4.197   7.002
  180    HA   LEU  25           HA       LEU  25  41.408   2.074   8.924
  181    HB2  LEU  25           HB2      LEU  25  43.280   3.186   7.891
  182    HB3  LEU  25           HB1      LEU  25  42.685   4.784   8.388
  183    HG   LEU  25           HG       LEU  25  43.143   4.318  10.722
  184   HD11  LEU  25          HD11      LEU  25  43.605   1.477   9.733
  185   HD12  LEU  25          HD12      LEU  25  42.500   2.040  11.010
  186   HD13  LEU  25          HD13      LEU  25  44.256   2.043  11.289
  187   HD21  LEU  25          HD21      LEU  25  45.076   5.004   9.335
  188   HD22  LEU  25          HD22      LEU  25  45.429   3.298   8.974
  189   HD23  LEU  25          HD23      LEU  25  45.590   3.907  10.638
  Start of MODEL   22
    1    H1   GLY   1           HT1      GLY   1  66.787  21.146  -6.455
    2    H2   GLY   1           HT2      GLY   1  66.410  20.812  -8.078
    3    H3   GLY   1           HT3      GLY   1  66.852  19.551  -7.027
    4    HA2  GLY   1           HA1      GLY   1  64.493  21.249  -6.599
    5    HA3  GLY   1           HA2      GLY   1  64.447  19.750  -7.549
    6    H    TRP   2           HN       TRP   2  66.143  20.681  -4.527
    7    HA   TRP   2           HA       TRP   2  66.225  19.592  -2.478
    8    HB2  TRP   2           HB2      TRP   2  63.318  19.064  -3.210
    9    HB3  TRP   2           HB1      TRP   2  64.020  18.773  -1.600
   10    HD1  TRP   2           HD1      TRP   2  62.670  21.480  -3.822
   11    HE1  TRP   2           HE1      TRP   2  62.775  23.786  -2.624
   12    HE3  TRP   2           HE3      TRP   2  65.566  20.173   0.193
   13    HZ2  TRP   2           HZ2      TRP   2  63.965  24.881  -0.242
   14    HZ3  TRP   2           HZ3      TRP   2  66.172  21.865   1.917
   15    HH2  TRP   2           HH2      TRP   2  65.376  24.216   1.702
   16    H    GLY   3           HN       GLY   3  63.769  17.372  -3.739
   17    HA2  GLY   3           HA1      GLY   3  65.420  15.322  -4.726
   18    HA3  GLY   3           HA2      GLY   3  65.319  15.069  -2.973
   19    H    SER   4           HN       SER   4  62.559  16.652  -4.035
   20    HA   SER   4           HA       SER   4  61.068  14.403  -5.083
   21    HB2  SER   4           HB2      SER   4  59.744  13.796  -3.195
   22    HB3  SER   4           HB1      SER   4  61.430  13.755  -2.633
   23    HG   SER   4           HG       SER   4  61.036  15.413  -1.376
   24    H    ILE   5           HN       ILE   5  59.629  15.354  -6.350
   25    HA   ILE   5           HA       ILE   5  58.923  18.156  -5.976
   26    HB   ILE   5           HB       ILE   5  57.263  17.610  -7.897
   27   HG12  ILE   5          HG12      ILE   5  58.893  15.027  -7.974
   28   HG13  ILE   5          HG11      ILE   5  57.261  15.114  -7.280
   29   HG21  ILE   5          HG21      ILE   5  59.060  17.584  -9.556
   30   HG22  ILE   5          HG22      ILE   5  60.211  16.957  -8.353
   31   HG23  ILE   5          HG23      ILE   5  59.559  18.603  -8.190
   32   HD11  ILE   5           HD1      ILE   5  58.117  15.523 -10.164
   33   HD12  ILE   5           HD2      ILE   5  56.563  16.159  -9.572
   34   HD13  ILE   5           HD3      ILE   5  56.892  14.413  -9.514
   35    H    PHE   6           HN       PHE   6  58.170  17.712  -3.690
   36    HA   PHE   6           HA       PHE   6  56.426  17.557  -2.173
   37    HB2  PHE   6           HB2      PHE   6  54.748  18.138  -4.646
   38    HB3  PHE   6           HB1      PHE   6  54.207  18.301  -2.958
   39    HD1  PHE   6           HD1      PHE   6  54.983  20.133  -1.552
   40    HD2  PHE   6           HD2      PHE   6  56.482  19.649  -5.571
   41    HE1  PHE   6           HE1      PHE   6  55.973  22.418  -1.458
   42    HE2  PHE   6           HE2      PHE   6  57.472  21.935  -5.476
   43    HZ   PHE   6           HZ       PHE   6  57.165  23.341  -3.442
   44    H    LYS   7           HN       LYS   7  57.092  15.230  -4.271
   45    HA   LYS   7           HA       LYS   7  54.789  13.607  -4.506
   46    HB2  LYS   7           HB2      LYS   7  57.020  13.172  -5.569
   47    HB3  LYS   7           HB1      LYS   7  57.627  12.645  -3.980
   48    HG2  LYS   7           HG2      LYS   7  55.958  10.863  -3.880
   49    HG3  LYS   7           HG1      LYS   7  55.214  11.432  -5.395
   50    HD2  LYS   7           HD2      LYS   7  57.394  11.012  -6.569
   51    HD3  LYS   7           HD1      LYS   7  58.034  10.321  -5.058
   52    HE2  LYS   7           HE2      LYS   7  57.222   8.503  -6.475
   53    HE3  LYS   7           HE1      LYS   7  56.142   8.668  -5.071
   54    HZ1  LYS   7           HZ1      LYS   7  55.104  10.378  -6.934
   55    HZ2  LYS   7           HZ2      LYS   7  54.509   8.833  -6.551
   56    HZ3  LYS   7           HZ3      LYS   7  55.578   9.035  -7.856
   57    H    HIS   8           HN       HIS   8  57.404  13.088  -2.096
   58    HA   HIS   8           HA       HIS   8  55.522  11.626  -0.358
   59    HB2  HIS   8           HB2      HIS   8  57.935  10.971  -0.678
   60    HB3  HIS   8           HB1      HIS   8  58.400  12.457   0.185
   61    HD1  HIS   8           HD1      HIS   8  59.139  11.696   2.458
   62    HD2  HIS   8           HD2      HIS   8  55.607   9.785   1.215
   63    HE1  HIS   8           HE1      HIS   8  58.290  10.311   4.429
   64    H    GLY   9           HN       GLY   9  54.145  13.691  -0.290
   65    HA2  GLY   9           HA1      GLY   9  54.601  14.915   2.322
   66    HA3  GLY   9           HA2      GLY   9  54.809  16.054   0.975
   67    H    ARG  10           HN       ARG  10  52.754  14.208  -0.482
   68    HA   ARG  10           HA       ARG  10  50.265  14.897   0.981
   69    HB2  ARG  10           HB2      ARG  10  49.332  16.190  -0.889
   70    HB3  ARG  10           HB1      ARG  10  50.802  16.978  -0.266
   71    HG2  ARG  10           HG2      ARG  10  52.098  15.730  -2.083
   72    HG3  ARG  10           HG1      ARG  10  50.522  15.276  -2.776
   73    HD2  ARG  10           HD2      ARG  10  51.591  18.099  -2.344
   74    HD3  ARG  10           HD1      ARG  10  51.296  17.290  -3.902
   75    HE   ARG  10           HE       ARG  10  48.843  17.283  -2.483
   76   HH11  ARG  10          HH11      ARG  10  48.159  18.333  -4.837
   77   HH12  ARG  10          HH12      ARG  10  48.276  20.058  -4.737
   78   HH21  ARG  10          HH21      ARG  10  50.273  20.022  -1.902
   79   HH22  ARG  10          HH22      ARG  10  49.473  21.014  -3.075
   80    H    HIS  11           HN       HIS  11  52.123  12.874  -0.845
   81    HA   HIS  11           HA       HIS  11  49.717  11.276  -1.649
   82    HB2  HIS  11           HB2      HIS  11  52.158  11.786  -3.405
   83    HB3  HIS  11           HB1      HIS  11  50.840  10.645  -3.768
   84    HD1  HIS  11           HD1      HIS  11  51.748  13.490  -5.255
   85    HD2  HIS  11           HD2      HIS  11  48.278  12.618  -3.053
   86    HE1  HIS  11           HE1      HIS  11  49.971  15.197  -5.927
   87    H    ALA  12           HN       ALA  12  49.871   9.208  -1.636
   88    HA   ALA  12           HA       ALA  12  50.539   7.111  -1.007
   89    HB1  ALA  12           HB1      ALA  12  52.826   6.640  -0.797
   90    HB2  ALA  12           HB2      ALA  12  53.107   8.333  -0.388
   91    HB3  ALA  12           HB3      ALA  12  52.710   7.895  -2.052
   92    H    ALA  13           HN       ALA  13  51.669   9.969   0.726
   93    HA   ALA  13           HA       ALA  13  51.644   8.645   3.340
   94    HB1  ALA  13           HB1      ALA  13  52.582  10.951   3.202
   95    HB2  ALA  13           HB2      ALA  13  51.056  11.008   4.117
   96    HB3  ALA  13           HB3      ALA  13  51.093  11.529   2.416
   97    H    LYS  14           HN       LYS  14  50.261   8.799   0.480
   98    HA   LYS  14           HA       LYS  14  47.313   8.615   1.507
   99    HB2  LYS  14           HB2      LYS  14  48.174  10.341  -0.263
  100    HB3  LYS  14           HB1      LYS  14  48.444   8.891  -1.300
  101    HG2  LYS  14           HG2      LYS  14  46.168   8.665  -1.733
  102    HG3  LYS  14           HG1      LYS  14  45.683   9.101  -0.078
  103    HD2  LYS  14           HD2      LYS  14  45.916  11.461  -0.555
  104    HD3  LYS  14           HD1      LYS  14  46.684  11.124  -2.126
  105    HE2  LYS  14           HE2      LYS  14  44.182  11.747  -2.176
  106    HE3  LYS  14           HE1      LYS  14  44.656  10.276  -3.057
  107    HZ1  LYS  14           HZ1      LYS  14  43.537   8.978  -1.636
  108    HZ2  LYS  14           HZ2      LYS  14  42.704  10.396  -1.208
  109    HZ3  LYS  14           HZ3      LYS  14  44.011   9.858  -0.266
  110    H    HIS  15           HN       HIS  15  46.190   7.408  -0.549
  111    HA   HIS  15           HA       HIS  15  45.601   5.198  -1.067
  112    HB2  HIS  15           HB2      HIS  15  46.873   6.180  -2.996
  113    HB3  HIS  15           HB1      HIS  15  48.338   5.378  -2.378
  114    HD1  HIS  15           HD1      HIS  15  44.712   4.388  -3.241
  115    HD2  HIS  15           HD2      HIS  15  48.605   2.804  -3.337
  116    HE1  HIS  15           HE1      HIS  15  44.574   2.097  -4.361
  117    H    ILE  16           HN       ILE  16  47.334   5.524   1.413
  118    HA   ILE  16           HA       ILE  16  47.431   2.979   2.229
  119    HB   ILE  16           HB       ILE  16  49.085   2.215   0.703
  120   HG12  ILE  16          HG12      ILE  16  50.704   2.980   3.166
  121   HG13  ILE  16          HG11      ILE  16  49.476   1.697   3.186
  122   HG21  ILE  16          HG21      ILE  16  49.911   4.343  -0.208
  123   HG22  ILE  16          HG22      ILE  16  51.302   3.487   0.481
  124   HG23  ILE  16          HG23      ILE  16  50.547   4.801   1.383
  125   HD11  ILE  16           HD1      ILE  16  52.158   1.756   1.778
  126   HD12  ILE  16           HD2      ILE  16  50.845   0.775   1.083
  127   HD13  ILE  16           HD3      ILE  16  51.415   0.457   2.735
  128    H    GLY  17           HN       GLY  17  49.178   5.795   2.187
  129    HA2  GLY  17           HA1      GLY  17  49.665   5.755   5.085
  130    HA3  GLY  17           HA2      GLY  17  49.935   7.129   3.992
  131    H    HIS  18           HN       HIS  18  47.184   6.235   2.800
  132    HA   HIS  18           HA       HIS  18  45.560   7.981   4.639
  133    HB2  HIS  18           HB2      HIS  18  45.466   7.177   1.757
  134    HB3  HIS  18           HB1      HIS  18  43.877   7.278   2.542
  135    HD1  HIS  18           HD1      HIS  18  43.341   9.396   1.058
  136    HD2  HIS  18           HD2      HIS  18  46.598   9.878   3.673
  137    HE1  HIS  18           HE1      HIS  18  43.827  11.899   1.218
  138    H    ALA  19           HN       ALA  19  45.468   4.719   3.083
  139    HA   ALA  19           HA       ALA  19  44.625   3.251   5.295
  140    HB1  ALA  19           HB1      ALA  19  42.618   4.416   5.715
  141    HB2  ALA  19           HB2      ALA  19  42.064   3.073   4.698
  142    HB3  ALA  19           HB3      ALA  19  42.302   4.685   3.984
  143    H    ALA  20           HN       ALA  20  45.647   3.496   2.329
  144    HA   ALA  20           HA       ALA  20  45.856   2.030   0.541
  145    HB1  ALA  20           HB1      ALA  20  46.368   0.473   2.508
  146    HB2  ALA  20           HB2      ALA  20  45.837  -0.305   0.999
  147    HB3  ALA  20           HB3      ALA  20  44.696  -0.110   2.351
  148    H    VAL  21           HN       VAL  21  43.143   3.230   1.634
  149    HA   VAL  21           HA       VAL  21  41.511   2.101  -0.596
  150    HB   VAL  21           HB       VAL  21  40.539   2.305   2.295
  151   HG11  VAL  21          HG11      VAL  21  38.689   2.921   0.934
  152   HG12  VAL  21          HG12      VAL  21  38.464   1.178   1.184
  153   HG13  VAL  21          HG13      VAL  21  39.134   1.775  -0.352
  154   HG21  VAL  21          HG21      VAL  21  40.198  -0.176   2.007
  155   HG22  VAL  21          HG22      VAL  21  41.906   0.306   1.930
  156   HG23  VAL  21          HG23      VAL  21  41.020  -0.069   0.432
  157    H    ASN  22           HN       ASN  22  42.691   4.611   1.323
  158    HA   ASN  22           HA       ASN  22  42.571   6.903   0.599
  159    HB2  ASN  22           HB2      ASN  22  40.884   6.325  -1.237
  160    HB3  ASN  22           HB1      ASN  22  39.615   6.531   0.000
  161   HD21  ASN  22          HD21      ASN  22  40.457   8.208  -2.501
  162   HD22  ASN  22          HD22      ASN  22  40.603   9.841  -1.843
  163    H    HIS  23           HN       HIS  23  40.064   5.167   2.355
  164    HA   HIS  23           HA       HIS  23  39.408   5.460   4.577
  165    HB2  HIS  23           HB2      HIS  23  41.685   6.795   4.816
  166    HB3  HIS  23           HB1      HIS  23  40.643   8.232   4.752
  167    HD1  HIS  23           HD1      HIS  23  42.150   7.618   7.361
  168    HD2  HIS  23           HD2      HIS  23  38.242   6.308   6.537
  169    HE1  HIS  23           HE1      HIS  23  41.027   7.116   9.601
  170    H    TYR  24           HN       TYR  24  38.107   6.362   2.071
  171    HA   TYR  24           HA       TYR  24  36.758   8.837   2.420
  172    HB2  TYR  24           HB2      TYR  24  36.711   7.505   0.331
  173    HB3  TYR  24           HB1      TYR  24  35.704   6.281   1.143
  174    HD1  TYR  24           HD1      TYR  24  33.368   6.735   1.713
  175    HD2  TYR  24           HD2      TYR  24  35.815   9.742  -0.185
  176    HE1  TYR  24           HE1      TYR  24  31.328   8.074   1.204
  177    HE2  TYR  24           HE2      TYR  24  33.774  11.080  -0.694
  178    HH   TYR  24           HH       TYR  24  30.620  10.185   0.607
  179    H    LEU  25           HN       LEU  25  36.475   5.850   4.131
  180    HA   LEU  25           HA       LEU  25  33.725   6.161   4.996
  181    HB2  LEU  25           HB2      LEU  25  36.107   4.554   5.979
  182    HB3  LEU  25           HB1      LEU  25  34.566   4.553   6.865
  183    HG   LEU  25           HG       LEU  25  33.375   3.694   4.928
  184   HD11  LEU  25          HD11      LEU  25  36.023   4.171   3.504
  185   HD12  LEU  25          HD12      LEU  25  34.409   4.790   3.075
  186   HD13  LEU  25          HD13      LEU  25  34.788   3.066   2.853
  187   HD21  LEU  25          HD21      LEU  25  36.017   2.222   5.343
  188   HD22  LEU  25          HD22      LEU  25  34.543   1.515   4.639
  189   HD23  LEU  25          HD23      LEU  25  34.553   2.042   6.339
  Start of MODEL   23
    1    H1   GLY   1           HT1      GLY   1  66.937  20.580   2.049
    2    H2   GLY   1           HT2      GLY   1  67.872  21.489   0.958
    3    H3   GLY   1           HT3      GLY   1  68.149  19.822   1.139
    4    HA2  GLY   1           HA1      GLY   1  65.841  21.177  -0.073
    5    HA3  GLY   1           HA2      GLY   1  67.000  20.076  -0.846
    6    H    TRP   2           HN       TRP   2  63.967  20.088  -0.377
    7    HA   TRP   2           HA       TRP   2  63.242  18.042   1.433
    8    HB2  TRP   2           HB2      TRP   2  62.042  18.642  -1.301
    9    HB3  TRP   2           HB1      TRP   2  61.253  17.734   0.012
   10    HD1  TRP   2           HD1      TRP   2  60.614  19.102   2.237
   11    HE1  TRP   2           HE1      TRP   2  60.090  21.618   2.636
   12    HE3  TRP   2           HE3      TRP   2  62.613  21.034  -2.062
   13    HZ2  TRP   2           HZ2      TRP   2  60.499  24.110   1.253
   14    HZ3  TRP   2           HZ3      TRP   2  62.534  23.484  -2.503
   15    HH2  TRP   2           HH2      TRP   2  61.480  25.022  -0.851
   16    H    GLY   3           HN       GLY   3  62.581  15.817   0.991
   17    HA2  GLY   3           HA1      GLY   3  64.722  14.386  -0.376
   18    HA3  GLY   3           HA2      GLY   3  63.325  13.676   0.457
   19    H    SER   4           HN       SER   4  61.629  15.618  -1.271
   20    HA   SER   4           HA       SER   4  61.958  14.602  -3.986
   21    HB2  SER   4           HB2      SER   4  61.015  12.576  -3.000
   22    HB3  SER   4           HB1      SER   4  59.695  13.512  -2.264
   23    HG   SER   4           HG       SER   4  59.794  12.447  -4.683
   24    H    ILE   5           HN       ILE   5  59.895  15.151  -5.307
   25    HA   ILE   5           HA       ILE   5  59.348  17.970  -4.800
   26    HB   ILE   5           HB       ILE   5  57.932  16.179  -6.820
   27   HG12  ILE   5          HG12      ILE   5  60.613  17.624  -7.079
   28   HG13  ILE   5          HG11      ILE   5  60.391  15.861  -7.003
   29   HG21  ILE   5          HG21      ILE   5  57.566  18.219  -8.026
   30   HG22  ILE   5          HG22      ILE   5  58.723  19.115  -7.013
   31   HG23  ILE   5          HG23      ILE   5  57.165  18.591  -6.335
   32   HD11  ILE   5           HD1      ILE   5  58.812  16.172  -9.054
   33   HD12  ILE   5           HD2      ILE   5  60.565  16.315  -9.325
   34   HD13  ILE   5           HD3      ILE   5  59.563  17.780  -9.205
   35    H    PHE   6           HN       PHE   6  58.436  17.457  -2.583
   36    HA   PHE   6           HA       PHE   6  56.602  17.271  -1.173
   37    HB2  PHE   6           HB2      PHE   6  55.159  18.208  -3.685
   38    HB3  PHE   6           HB1      PHE   6  54.476  18.220  -2.040
   39    HD1  PHE   6           HD1      PHE   6  56.733  19.894  -4.391
   40    HD2  PHE   6           HD2      PHE   6  55.543  19.632  -0.249
   41    HE1  PHE   6           HE1      PHE   6  57.834  22.082  -3.934
   42    HE2  PHE   6           HE2      PHE   6  56.644  21.820   0.206
   43    HZ   PHE   6           HZ       PHE   6  57.750  23.066  -1.647
   44    H    LYS   7           HN       LYS   7  57.284  15.049  -3.312
   45    HA   LYS   7           HA       LYS   7  54.841  13.646  -3.810
   46    HB2  LYS   7           HB2      LYS   7  57.153  13.247  -4.852
   47    HB3  LYS   7           HB1      LYS   7  57.562  12.367  -3.366
   48    HG2  LYS   7           HG2      LYS   7  56.780  10.614  -4.723
   49    HG3  LYS   7           HG1      LYS   7  55.300  11.051  -3.843
   50    HD2  LYS   7           HD2      LYS   7  54.507  12.379  -5.739
   51    HD3  LYS   7           HD1      LYS   7  56.048  12.144  -6.599
   52    HE2  LYS   7           HE2      LYS   7  54.236   9.852  -5.742
   53    HE3  LYS   7           HE1      LYS   7  54.167  10.612  -7.349
   54    HZ1  LYS   7           HZ1      LYS   7  56.811  10.134  -7.013
   55    HZ2  LYS   7           HZ2      LYS   7  55.739   9.135  -7.875
   56    HZ3  LYS   7           HZ3      LYS   7  56.114   8.786  -6.255
   57    H    HIS   8           HN       HIS   8  57.296  13.286  -1.218
   58    HA   HIS   8           HA       HIS   8  55.611  11.340   0.215
   59    HB2  HIS   8           HB2      HIS   8  57.418  11.536   1.953
   60    HB3  HIS   8           HB1      HIS   8  58.019  11.087   0.339
   61    HD1  HIS   8           HD1      HIS   8  57.048  14.588   0.292
   62    HD2  HIS   8           HD2      HIS   8  60.453  12.449   1.532
   63    HE1  HIS   8           HE1      HIS   8  58.975  16.256   0.460
   64    H    GLY   9           HN       GLY   9  54.115  13.612  -0.208
   65    HA2  GLY   9           HA1      GLY   9  53.465  14.333   2.537
   66    HA3  GLY   9           HA2      GLY   9  54.181  15.684   1.636
   67    H    ARG  10           HN       ARG  10  52.751  13.864  -0.674
   68    HA   ARG  10           HA       ARG  10  49.984  14.919  -0.271
   69    HB2  ARG  10           HB2      ARG  10  51.562  15.466  -2.814
   70    HB3  ARG  10           HB1      ARG  10  49.933  16.051  -2.395
   71    HG2  ARG  10           HG2      ARG  10  50.950  17.270  -0.432
   72    HG3  ARG  10           HG1      ARG  10  52.558  16.804  -1.039
   73    HD2  ARG  10           HD2      ARG  10  52.102  17.958  -3.173
   74    HD3  ARG  10           HD1      ARG  10  50.481  18.409  -2.593
   75    HE   ARG  10           HE       ARG  10  52.982  19.713  -1.862
   76   HH11  ARG  10          HH11      ARG  10  49.642  19.788  -1.662
   77   HH12  ARG  10          HH12      ARG  10  49.570  20.667  -0.171
   78   HH21  ARG  10          HH21      ARG  10  52.979  20.448   0.429
   79   HH22  ARG  10          HH22      ARG  10  51.458  21.040   1.014
   80    H    HIS  11           HN       HIS  11  52.011  12.446  -0.931
   81    HA   HIS  11           HA       HIS  11  49.842  10.838  -2.061
   82    HB2  HIS  11           HB2      HIS  11  50.840  11.867  -4.126
   83    HB3  HIS  11           HB1      HIS  11  52.409  11.158  -3.673
   84    HD1  HIS  11           HD1      HIS  11  52.735   8.615  -3.950
   85    HD2  HIS  11           HD2      HIS  11  48.906   9.973  -5.035
   86    HE1  HIS  11           HE1      HIS  11  51.542   6.680  -5.118
   87    H    ALA  12           HN       ALA  12  49.987   8.826  -1.787
   88    HA   ALA  12           HA       ALA  12  50.609   6.815  -0.916
   89    HB1  ALA  12           HB1      ALA  12  53.151   8.076  -0.273
   90    HB2  ALA  12           HB2      ALA  12  52.846   7.466  -1.903
   91    HB3  ALA  12           HB3      ALA  12  52.870   6.362  -0.504
   92    H    ALA  13           HN       ALA  13  51.616   9.852   0.532
   93    HA   ALA  13           HA       ALA  13  51.426   8.864   3.283
   94    HB1  ALA  13           HB1      ALA  13  52.367  11.135   2.959
   95    HB2  ALA  13           HB2      ALA  13  50.757  11.310   3.697
   96    HB3  ALA  13           HB3      ALA  13  50.974  11.602   1.954
   97    H    LYS  14           HN       LYS  14  50.242   8.608   0.354
   98    HA   LYS  14           HA       LYS  14  47.235   8.512   1.212
   99    HB2  LYS  14           HB2      LYS  14  48.193  10.084  -0.659
  100    HB3  LYS  14           HB1      LYS  14  48.542   8.547  -1.534
  101    HG2  LYS  14           HG2      LYS  14  46.302   8.254  -2.096
  102    HG3  LYS  14           HG1      LYS  14  45.706   8.821  -0.519
  103    HD2  LYS  14           HD2      LYS  14  45.981  11.144  -1.187
  104    HD3  LYS  14           HD1      LYS  14  46.797  10.660  -2.693
  105    HE2  LYS  14           HE2      LYS  14  44.466  11.205  -3.191
  106    HE3  LYS  14           HE1      LYS  14  44.704   9.451  -3.381
  107    HZ1  LYS  14           HZ1      LYS  14  42.763  10.558  -1.904
  108    HZ2  LYS  14           HZ2      LYS  14  43.952  10.318  -0.716
  109    HZ3  LYS  14           HZ3      LYS  14  43.388   9.005  -1.636
  110    H    HIS  15           HN       HIS  15  46.258   7.101  -0.806
  111    HA   HIS  15           HA       HIS  15  45.752   4.838  -1.164
  112    HB2  HIS  15           HB2      HIS  15  48.548   5.168  -2.298
  113    HB3  HIS  15           HB1      HIS  15  47.424   3.853  -2.719
  114    HD1  HIS  15           HD1      HIS  15  48.562   6.780  -4.203
  115    HD2  HIS  15           HD2      HIS  15  44.691   5.364  -3.366
  116    HE1  HIS  15           HE1      HIS  15  46.942   8.044  -5.722
  117    H    ILE  16           HN       ILE  16  47.179   5.403   1.448
  118    HA   ILE  16           HA       ILE  16  47.315   2.984   2.535
  119    HB   ILE  16           HB       ILE  16  49.076   2.101   1.108
  120   HG12  ILE  16          HG12      ILE  16  50.476   3.011   3.660
  121   HG13  ILE  16          HG11      ILE  16  49.287   1.693   3.607
  122   HG21  ILE  16          HG21      ILE  16  51.325   3.389   1.038
  123   HG22  ILE  16          HG22      ILE  16  50.438   4.756   1.719
  124   HG23  ILE  16          HG23      ILE  16  50.002   4.133   0.116
  125   HD11  ILE  16           HD1      ILE  16  52.101   1.773   2.515
  126   HD12  ILE  16           HD2      ILE  16  50.903   0.789   1.642
  127   HD13  ILE  16           HD3      ILE  16  51.250   0.459   3.353
  128    H    GLY  17           HN       GLY  17  48.782   5.934   2.214
  129    HA2  GLY  17           HA1      GLY  17  49.241   6.148   5.139
  130    HA3  GLY  17           HA2      GLY  17  49.553   7.404   3.928
  131    H    HIS  18           HN       HIS  18  46.880   6.266   2.696
  132    HA   HIS  18           HA       HIS  18  45.125   8.183   4.232
  133    HB2  HIS  18           HB2      HIS  18  45.068   8.420   1.804
  134    HB3  HIS  18           HB1      HIS  18  44.683   6.699   1.605
  135    HD1  HIS  18           HD1      HIS  18  42.428   7.472   0.397
  136    HD2  HIS  18           HD2      HIS  18  42.786   8.682   4.404
  137    HE1  HIS  18           HE1      HIS  18  40.103   8.167   1.196
  138    H    ALA  19           HN       ALA  19  45.458   4.682   3.407
  139    HA   ALA  19           HA       ALA  19  43.497   4.174   5.642
  140    HB1  ALA  19           HB1      ALA  19  42.155   2.636   4.296
  141    HB2  ALA  19           HB2      ALA  19  43.104   3.054   2.854
  142    HB3  ALA  19           HB3      ALA  19  42.097   4.288   3.644
  143    H    ALA  20           HN       ALA  20  46.449   3.664   5.003
  144    HA   ALA  20           HA       ALA  20  47.951   1.960   5.502
  145    HB1  ALA  20           HB1      ALA  20  46.342   1.821   7.491
  146    HB2  ALA  20           HB2      ALA  20  47.347   0.390   7.158
  147    HB3  ALA  20           HB3      ALA  20  45.635   0.407   6.676
  148    H    VAL  21           HN       VAL  21  45.433   1.587   3.342
  149    HA   VAL  21           HA       VAL  21  46.772  -0.763   2.108
  150    HB   VAL  21           HB       VAL  21  43.762  -0.768   2.604
  151   HG11  VAL  21          HG11      VAL  21  44.451  -1.949   0.576
  152   HG12  VAL  21          HG12      VAL  21  44.014  -3.140   1.823
  153   HG13  VAL  21          HG13      VAL  21  45.727  -2.807   1.472
  154   HG21  VAL  21          HG21      VAL  21  46.023  -2.248   4.019
  155   HG22  VAL  21          HG22      VAL  21  44.310  -2.712   4.139
  156   HG23  VAL  21          HG23      VAL  21  44.845  -1.130   4.749
  157    H    ASN  22           HN       ASN  22  44.482   1.929   2.020
  158    HA   ASN  22           HA       ASN  22  45.162   2.616  -0.674
  159    HB2  ASN  22           HB2      ASN  22  42.827   0.753  -0.307
  160    HB3  ASN  22           HB1      ASN  22  42.594   2.100  -1.442
  161   HD21  ASN  22          HD21      ASN  22  43.052  -0.987  -1.777
  162   HD22  ASN  22          HD22      ASN  22  44.331  -1.052  -2.994
  163    H    HIS  23           HN       HIS  23  41.800   2.620   0.369
  164    HA   HIS  23           HA       HIS  23  42.032   5.340   1.546
  165    HB2  HIS  23           HB2      HIS  23  40.180   6.135  -0.017
  166    HB3  HIS  23           HB1      HIS  23  41.783   5.936  -0.764
  167    HD1  HIS  23           HD1      HIS  23  38.577   3.873  -0.233
  168    HD2  HIS  23           HD2      HIS  23  41.773   4.222  -2.940
  169    HE1  HIS  23           HE1      HIS  23  38.073   2.333  -2.208
  170    H    TYR  24           HN       TYR  24  41.268   2.526   2.317
  171    HA   TYR  24           HA       TYR  24  38.381   2.508   2.625
  172    HB2  TYR  24           HB2      TYR  24  39.932   0.487   2.626
  173    HB3  TYR  24           HB1      TYR  24  40.422   0.965   4.269
  174    HD1  TYR  24           HD1      TYR  24  39.022   0.488   6.158
  175    HD2  TYR  24           HD2      TYR  24  37.473   0.030   2.154
  176    HE1  TYR  24           HE1      TYR  24  36.985  -0.619   7.071
  177    HE2  TYR  24           HE2      TYR  24  35.437  -1.077   3.069
  178    HH   TYR  24           HH       TYR  24  35.225  -2.206   6.260
  179    H    LEU  25           HN       LEU  25  40.326   4.736   3.773
  180    HA   LEU  25           HA       LEU  25  40.277   6.153   5.600
  181    HB2  LEU  25           HB2      LEU  25  37.726   5.838   4.959
  182    HB3  LEU  25           HB1      LEU  25  37.641   4.942   6.490
  183    HG   LEU  25           HG       LEU  25  38.665   7.803   6.160
  184   HD11  LEU  25          HD11      LEU  25  36.127   6.794   7.511
  185   HD12  LEU  25          HD12      LEU  25  36.174   7.421   5.845
  186   HD13  LEU  25          HD13      LEU  25  36.594   8.484   7.209
  187   HD21  LEU  25          HD21      LEU  25  38.393   5.925   8.543
  188   HD22  LEU  25          HD22      LEU  25  38.392   7.692   8.751
  189   HD23  LEU  25          HD23      LEU  25  39.805   6.884   8.039
  Start of MODEL   24
    1    H1   GLY   1           HT1      GLY   1  68.491  20.522  -2.494
    2    H2   GLY   1           HT2      GLY   1  67.209  21.169  -1.584
    3    H3   GLY   1           HT3      GLY   1  68.336  22.201  -2.328
    4    HA2  GLY   1           HA1      GLY   1  66.000  21.727  -3.345
    5    HA3  GLY   1           HA2      GLY   1  67.442  22.026  -4.336
    6    H    TRP   2           HN       TRP   2  65.990  19.271  -2.535
    7    HA   TRP   2           HA       TRP   2  67.056  17.256  -4.231
    8    HB2  TRP   2           HB2      TRP   2  64.484  17.278  -2.600
    9    HB3  TRP   2           HB1      TRP   2  65.233  15.825  -3.306
   10    HD1  TRP   2           HD1      TRP   2  67.974  15.568  -2.560
   11    HE1  TRP   2           HE1      TRP   2  68.992  15.802  -0.178
   12    HE3  TRP   2           HE3      TRP   2  64.242  18.290  -0.351
   13    HZ2  TRP   2           HZ2      TRP   2  68.257  17.015   2.328
   14    HZ3  TRP   2           HZ3      TRP   2  64.422  18.975   2.037
   15    HH2  TRP   2           HH2      TRP   2  66.425  18.341   3.377
   16    H    GLY   3           HN       GLY   3  63.581  17.194  -4.149
   17    HA2  GLY   3           HA1      GLY   3  63.057  18.358  -6.710
   18    HA3  GLY   3           HA2      GLY   3  63.324  16.614  -6.903
   19    H    SER   4           HN       SER   4  62.263  16.525  -3.940
   20    HA   SER   4           HA       SER   4  59.498  15.924  -4.755
   21    HB2  SER   4           HB2      SER   4  60.917  15.787  -2.067
   22    HB3  SER   4           HB1      SER   4  59.258  15.227  -2.370
   23    HG   SER   4           HG       SER   4  60.018  13.589  -3.527
   24    H    ILE   5           HN       ILE   5  59.234  18.296  -5.402
   25    HA   ILE   5           HA       ILE   5  59.163  20.458  -3.685
   26    HB   ILE   5           HB       ILE   5  56.731  20.025  -5.456
   27   HG12  ILE   5          HG12      ILE   5  58.473  20.935  -7.321
   28   HG13  ILE   5          HG11      ILE   5  59.639  20.034  -6.327
   29   HG21  ILE   5          HG21      ILE   5  56.958  22.371  -5.866
   30   HG22  ILE   5          HG22      ILE   5  58.621  22.401  -5.235
   31   HG23  ILE   5          HG23      ILE   5  57.252  22.157  -4.125
   32   HD11  ILE   5           HD1      ILE   5  57.834  18.086  -6.486
   33   HD12  ILE   5           HD2      ILE   5  58.925  18.391  -7.858
   34   HD13  ILE   5           HD3      ILE   5  57.256  19.006  -7.895
   35    H    PHE   6           HN       PHE   6  56.624  17.957  -4.022
   36    HA   PHE   6           HA       PHE   6  55.841  18.336  -1.219
   37    HB2  PHE   6           HB2      PHE   6  53.996  19.185  -3.485
   38    HB3  PHE   6           HB1      PHE   6  53.418  18.801  -1.847
   39    HD1  PHE   6           HD1      PHE   6  54.461  20.071   0.137
   40    HD2  PHE   6           HD2      PHE   6  54.893  21.344  -3.965
   41    HE1  PHE   6           HE1      PHE   6  55.067  22.360   0.911
   42    HE2  PHE   6           HE2      PHE   6  55.498  23.633  -3.190
   43    HZ   PHE   6           HZ       PHE   6  55.487  24.164  -0.756
   44    H    LYS   7           HN       LYS   7  56.291  16.543  -3.968
   45    HA   LYS   7           HA       LYS   7  54.202  14.669  -4.048
   46    HB2  LYS   7           HB2      LYS   7  56.131  14.724  -5.617
   47    HB3  LYS   7           HB1      LYS   7  57.178  14.089  -4.324
   48    HG2  LYS   7           HG2      LYS   7  55.912  12.034  -4.200
   49    HG3  LYS   7           HG1      LYS   7  54.652  12.681  -5.277
   50    HD2  LYS   7           HD2      LYS   7  56.206  12.756  -7.149
   51    HD3  LYS   7           HD1      LYS   7  57.564  12.299  -6.091
   52    HE2  LYS   7           HE2      LYS   7  55.100  10.553  -6.490
   53    HE3  LYS   7           HE1      LYS   7  56.579  10.390  -7.464
   54    HZ1  LYS   7           HZ1      LYS   7  56.327  10.085  -4.516
   55    HZ2  LYS   7           HZ2      LYS   7  57.811  10.128  -5.339
   56    HZ3  LYS   7           HZ3      LYS   7  56.703   8.876  -5.643
   57    H    HIS   8           HN       HIS   8  57.231  14.435  -2.115
   58    HA   HIS   8           HA       HIS   8  56.180  12.147  -0.612
   59    HB2  HIS   8           HB2      HIS   8  58.610  12.478  -1.119
   60    HB3  HIS   8           HB1      HIS   8  58.606  13.891  -0.035
   61    HD1  HIS   8           HD1      HIS   8  57.319  10.260   0.210
   62    HD2  HIS   8           HD2      HIS   8  59.340  13.143   2.509
   63    HE1  HIS   8           HE1      HIS   8  57.901   9.178   2.450
   64    H    GLY   9           HN       GLY   9  54.314  14.139  -0.404
   65    HA2  GLY   9           HA1      GLY   9  54.104  14.417   2.454
   66    HA3  GLY   9           HA2      GLY   9  54.564  15.965   1.717
   67    H    ARG  10           HN       ARG  10  52.840  14.111  -0.494
   68    HA   ARG  10           HA       ARG  10  50.152  14.970   0.434
   69    HB2  ARG  10           HB2      ARG  10  51.451  16.023  -2.113
   70    HB3  ARG  10           HB1      ARG  10  49.712  16.128  -1.755
   71    HG2  ARG  10           HG2      ARG  10  50.351  17.319   0.418
   72    HG3  ARG  10           HG1      ARG  10  52.009  17.415  -0.224
   73    HD2  ARG  10           HD2      ARG  10  50.839  19.486  -0.768
   74    HD3  ARG  10           HD1      ARG  10  51.090  18.561  -2.268
   75    HE   ARG  10           HE       ARG  10  48.555  17.808  -1.269
   76   HH11  ARG  10          HH11      ARG  10  49.396  20.958  -0.967
   77   HH12  ARG  10          HH12      ARG  10  48.335  21.584  -2.184
   78   HH21  ARG  10          HH21      ARG  10  47.519  18.462  -3.454
   79   HH22  ARG  10          HH22      ARG  10  47.272  20.171  -3.592
   80    H    HIS  11           HN       HIS  11  52.015  12.597  -0.563
   81    HA   HIS  11           HA       HIS  11  49.776  11.126  -1.747
   82    HB2  HIS  11           HB2      HIS  11  50.783  12.317  -3.738
   83    HB3  HIS  11           HB1      HIS  11  52.305  11.458  -3.406
   84    HD1  HIS  11           HD1      HIS  11  48.849   9.909  -2.993
   85    HD2  HIS  11           HD2      HIS  11  52.117   9.723  -5.633
   86    HE1  HIS  11           HE1      HIS  11  48.460   7.918  -4.546
   87    H    ALA  12           HN       ALA  12  49.893   9.068  -1.684
   88    HA   ALA  12           HA       ALA  12  50.499   6.967  -1.007
   89    HB1  ALA  12           HB1      ALA  12  52.709   7.692  -2.013
   90    HB2  ALA  12           HB2      ALA  12  52.769   6.452  -0.735
   91    HB3  ALA  12           HB3      ALA  12  53.081   8.148  -0.361
   92    H    ALA  13           HN       ALA  13  51.653   9.822   0.713
   93    HA   ALA  13           HA       ALA  13  51.541   8.540   3.341
   94    HB1  ALA  13           HB1      ALA  13  52.455  10.740   3.522
   95    HB2  ALA  13           HB2      ALA  13  50.735  11.048   3.860
   96    HB3  ALA  13           HB3      ALA  13  51.397  11.378   2.241
   97    H    LYS  14           HN       LYS  14  50.224   8.683   0.442
   98    HA   LYS  14           HA       LYS  14  47.253   8.586   1.405
   99    HB2  LYS  14           HB2      LYS  14  48.204  10.254  -0.372
  100    HB3  LYS  14           HB1      LYS  14  48.445   8.782  -1.382
  101    HG2  LYS  14           HG2      LYS  14  46.172   8.638  -1.864
  102    HG3  LYS  14           HG1      LYS  14  45.671   9.090  -0.219
  103    HD2  LYS  14           HD2      LYS  14  46.162  11.469  -0.727
  104    HD3  LYS  14           HD1      LYS  14  46.665  11.011  -2.373
  105    HE2  LYS  14           HE2      LYS  14  44.424  10.170  -2.874
  106    HE3  LYS  14           HE1      LYS  14  43.902  10.471  -1.198
  107    HZ1  LYS  14           HZ1      LYS  14  43.983  12.269  -3.378
  108    HZ2  LYS  14           HZ2      LYS  14  45.004  12.841  -2.146
  109    HZ3  LYS  14           HZ3      LYS  14  43.368  12.516  -1.817
  110    H    HIS  15           HN       HIS  15  46.134   7.378  -0.653
  111    HA   HIS  15           HA       HIS  15  45.496   5.175  -1.155
  112    HB2  HIS  15           HB2      HIS  15  46.880   6.112  -3.052
  113    HB3  HIS  15           HB1      HIS  15  48.269   5.218  -2.392
  114    HD1  HIS  15           HD1      HIS  15  48.348   2.674  -2.708
  115    HD2  HIS  15           HD2      HIS  15  44.808   4.437  -4.137
  116    HE1  HIS  15           HE1      HIS  15  47.081   0.883  -4.017
  117    H    ILE  16           HN       ILE  16  47.183   5.495   1.368
  118    HA   ILE  16           HA       ILE  16  47.198   2.959   2.215
  119    HB   ILE  16           HB       ILE  16  48.866   2.113   0.754
  120   HG12  ILE  16          HG12      ILE  16  50.709   2.871   3.039
  121   HG13  ILE  16          HG11      ILE  16  49.277   1.890   3.400
  122   HG21  ILE  16          HG21      ILE  16  49.735   4.198  -0.229
  123   HG22  ILE  16          HG22      ILE  16  51.105   3.341   0.497
  124   HG23  ILE  16          HG23      ILE  16  50.372   4.699   1.348
  125   HD11  ILE  16           HD1      ILE  16  51.462   1.202   1.383
  126   HD12  ILE  16           HD2      ILE  16  49.990   0.241   1.659
  127   HD13  ILE  16           HD3      ILE  16  51.190   0.425   2.958
  128    H    GLY  17           HN       GLY  17  49.053   5.704   2.157
  129    HA2  GLY  17           HA1      GLY  17  49.473   5.707   5.062
  130    HA3  GLY  17           HA2      GLY  17  49.820   7.044   3.946
  131    H    HIS  18           HN       HIS  18  47.037   6.229   2.729
  132    HA   HIS  18           HA       HIS  18  45.491   8.106   4.499
  133    HB2  HIS  18           HB2      HIS  18  45.370   7.229   1.646
  134    HB3  HIS  18           HB1      HIS  18  43.781   7.390   2.415
  135    HD1  HIS  18           HD1      HIS  18  46.670   9.603   3.469
  136    HD2  HIS  18           HD2      HIS  18  43.254   9.831   1.025
  137    HE1  HIS  18           HE1      HIS  18  46.303  12.067   2.900
  138    H    ALA  19           HN       ALA  19  45.370   4.715   3.213
  139    HA   ALA  19           HA       ALA  19  43.982   3.859   5.635
  140    HB1  ALA  19           HB1      ALA  19  42.162   5.109   4.370
  141    HB2  ALA  19           HB2      ALA  19  41.799   3.419   4.789
  142    HB3  ALA  19           HB3      ALA  19  42.283   3.841   3.127
  143    H    ALA  20           HN       ALA  20  46.271   2.946   4.196
  144    HA   ALA  20           HA       ALA  20  47.162   0.917   3.526
  145    HB1  ALA  20           HB1      ALA  20  44.497  -0.447   3.947
  146    HB2  ALA  20           HB2      ALA  20  45.462   0.113   5.332
  147    HB3  ALA  20           HB3      ALA  20  46.139  -1.081   4.199
  148    H    VAL  21           HN       VAL  21  44.346   2.282   2.073
  149    HA   VAL  21           HA       VAL  21  45.155   1.115  -0.539
  150    HB   VAL  21           HB       VAL  21  42.259   0.975   0.409
  151   HG11  VAL  21          HG11      VAL  21  42.041  -0.425  -1.663
  152   HG12  VAL  21          HG12      VAL  21  43.736  -0.047  -2.056
  153   HG13  VAL  21          HG13      VAL  21  42.521   1.254  -2.009
  154   HG21  VAL  21          HG21      VAL  21  44.412  -1.177   0.212
  155   HG22  VAL  21          HG22      VAL  21  42.673  -1.530   0.344
  156   HG23  VAL  21          HG23      VAL  21  43.510  -0.684   1.667
  157    H    ASN  22           HN       ASN  22  43.186   3.328   1.399
  158    HA   ASN  22           HA       ASN  22  43.686   5.722   0.251
  159    HB2  ASN  22           HB2      ASN  22  43.218   5.233  -2.015
  160    HB3  ASN  22           HB1      ASN  22  41.830   4.199  -1.608
  161   HD21  ASN  22          HD21      ASN  22  40.156   5.290  -2.737
  162   HD22  ASN  22          HD22      ASN  22  39.734   6.978  -2.432
  163    H    HIS  23           HN       HIS  23  40.866   3.600   0.844
  164    HA   HIS  23           HA       HIS  23  40.063   5.228   3.119
  165    HB2  HIS  23           HB2      HIS  23  39.241   6.640   1.225
  166    HB3  HIS  23           HB1      HIS  23  38.246   5.269   0.680
  167    HD1  HIS  23           HD1      HIS  23  38.867   6.811   4.159
  168    HD2  HIS  23           HD2      HIS  23  35.697   5.813   1.584
  169    HE1  HIS  23           HE1      HIS  23  36.692   7.283   5.412
  170    H    TYR  24           HN       TYR  24  40.613   2.805   3.528
  171    HA   TYR  24           HA       TYR  24  38.603   0.855   2.788
  172    HB2  TYR  24           HB2      TYR  24  40.915   0.243   3.442
  173    HB3  TYR  24           HB1      TYR  24  40.595   0.829   5.093
  174    HD1  TYR  24           HD1      TYR  24  39.089  -0.385   6.601
  175    HD2  TYR  24           HD2      TYR  24  39.842  -1.800   2.593
  176    HE1  TYR  24           HE1      TYR  24  38.077  -2.585   7.188
  177    HE2  TYR  24           HE2      TYR  24  38.829  -4.000   3.180
  178    HH   TYR  24           HH       TYR  24  37.653  -5.128   4.717
  179    H    LEU  25           HN       LEU  25  38.649   3.440   5.018
  180    HA   LEU  25           HA       LEU  25  36.992   2.263   7.084
  181    HB2  LEU  25           HB2      LEU  25  37.689   5.098   6.252
  182    HB3  LEU  25           HB1      LEU  25  36.486   4.794   7.526
  183    HG   LEU  25           HG       LEU  25  38.132   3.528   8.830
  184   HD11  LEU  25          HD11      LEU  25  39.488   2.469   7.173
  185   HD12  LEU  25          HD12      LEU  25  40.574   3.618   7.988
  186   HD13  LEU  25          HD13      LEU  25  39.889   4.018   6.393
  187   HD21  LEU  25          HD21      LEU  25  39.304   6.162   7.826
  188   HD22  LEU  25          HD22      LEU  25  39.652   5.380   9.387
  189   HD23  LEU  25          HD23      LEU  25  38.024   6.017   9.053
  Start of MODEL   25
    1    H1   GLY   1           HT1      GLY   1  68.508  13.117   1.190
    2    H2   GLY   1           HT2      GLY   1  67.392  11.878   1.523
    3    H3   GLY   1           HT3      GLY   1  66.941  13.508   1.704
    4    HA2  GLY   1           HA1      GLY   1  67.917  12.696  -0.891
    5    HA3  GLY   1           HA2      GLY   1  66.331  12.075  -0.392
    6    H    TRP   2           HN       TRP   2  66.343  13.637  -2.555
    7    HA   TRP   2           HA       TRP   2  66.140  16.456  -2.046
    8    HB2  TRP   2           HB2      TRP   2  66.408  15.386  -4.304
    9    HB3  TRP   2           HB1      TRP   2  64.718  14.842  -4.198
   10    HD1  TRP   2           HD1      TRP   2  62.969  16.474  -5.060
   11    HE1  TRP   2           HE1      TRP   2  62.873  19.003  -5.655
   12    HE3  TRP   2           HE3      TRP   2  67.643  17.851  -3.487
   13    HZ2  TRP   2           HZ2      TRP   2  64.612  21.291  -5.461
   14    HZ3  TRP   2           HZ3      TRP   2  68.403  20.211  -3.700
   15    HH2  TRP   2           HH2      TRP   2  66.893  21.932  -4.684
   16    H    GLY   3           HN       GLY   3  63.972  17.624  -2.604
   17    HA2  GLY   3           HA1      GLY   3  62.136  16.929  -0.460
   18    HA3  GLY   3           HA2      GLY   3  61.966  18.261  -1.620
   19    H    SER   4           HN       SER   4  62.551  15.463  -3.338
   20    HA   SER   4           HA       SER   4  61.189  14.140  -4.663
   21    HB2  SER   4           HB2      SER   4  60.506  13.359  -2.316
   22    HB3  SER   4           HB1      SER   4  59.073  14.393  -2.499
   23    HG   SER   4           HG       SER   4  59.889  12.395  -4.360
   24    H    ILE   5           HN       ILE   5  59.235  14.095  -6.001
   25    HA   ILE   5           HA       ILE   5  58.479  16.839  -6.743
   26    HB   ILE   5           HB       ILE   5  57.369  14.252  -7.908
   27   HG12  ILE   5          HG12      ILE   5  59.961  15.731  -8.558
   28   HG13  ILE   5          HG11      ILE   5  59.818  14.085  -7.898
   29   HG21  ILE   5          HG21      ILE   5  56.924  15.589  -9.847
   30   HG22  ILE   5          HG22      ILE   5  57.928  16.930  -9.247
   31   HG23  ILE   5          HG23      ILE   5  56.373  16.561  -8.466
   32   HD11  ILE   5           HD1      ILE   5  59.080  15.084 -10.670
   33   HD12  ILE   5           HD2      ILE   5  58.403  13.567 -10.024
   34   HD13  ILE   5           HD3      ILE   5  60.162  13.746 -10.223
   35    H    PHE   6           HN       PHE   6  57.490  17.078  -4.481
   36    HA   PHE   6           HA       PHE   6  55.587  17.297  -3.175
   37    HB2  PHE   6           HB2      PHE   6  54.348  17.172  -5.949
   38    HB3  PHE   6           HB1      PHE   6  53.422  17.564  -4.479
   39    HD1  PHE   6           HD1      PHE   6  56.279  18.640  -6.639
   40    HD2  PHE   6           HD2      PHE   6  53.599  19.726  -3.434
   41    HE1  PHE   6           HE1      PHE   6  57.070  21.000  -6.777
   42    HE2  PHE   6           HE2      PHE   6  54.389  22.085  -3.573
   43    HZ   PHE   6           HZ       PHE   6  56.132  22.720  -5.237
   44    H    LYS   7           HN       LYS   7  56.484  14.456  -4.342
   45    HA   LYS   7           HA       LYS   7  54.046  12.891  -4.142
   46    HB2  LYS   7           HB2      LYS   7  56.956  12.051  -3.840
   47    HB3  LYS   7           HB1      LYS   7  55.573  10.950  -4.051
   48    HG2  LYS   7           HG2      LYS   7  55.059  12.280  -6.211
   49    HG3  LYS   7           HG1      LYS   7  56.689  12.973  -6.029
   50    HD2  LYS   7           HD2      LYS   7  56.017  10.003  -6.235
   51    HD3  LYS   7           HD1      LYS   7  56.748  11.001  -7.514
   52    HE2  LYS   7           HE2      LYS   7  58.614  11.527  -5.793
   53    HE3  LYS   7           HE1      LYS   7  57.954  10.164  -4.854
   54    HZ1  LYS   7           HZ1      LYS   7  58.727   9.953  -7.716
   55    HZ2  LYS   7           HZ2      LYS   7  58.355   8.690  -6.644
   56    HZ3  LYS   7           HZ3      LYS   7  59.782   9.588  -6.439
   57    H    HIS   8           HN       HIS   8  56.939  12.832  -2.013
   58    HA   HIS   8           HA       HIS   8  55.347  11.791   0.208
   59    HB2  HIS   8           HB2      HIS   8  57.716  11.166  -0.109
   60    HB3  HIS   8           HB1      HIS   8  58.197  12.862   0.125
   61    HD1  HIS   8           HD1      HIS   8  59.558  11.489   2.183
   62    HD2  HIS   8           HD2      HIS   8  55.414  12.077   2.593
   63    HE1  HIS   8           HE1      HIS   8  58.996  11.249   4.665
   64    H    GLY   9           HN       GLY   9  53.830  13.775  -0.142
   65    HA2  GLY   9           HA1      GLY   9  54.313  15.542   2.118
   66    HA3  GLY   9           HA2      GLY   9  54.469  16.383   0.562
   67    H    ARG  10           HN       ARG  10  52.452  14.516  -0.671
   68    HA   ARG  10           HA       ARG  10  49.965  15.089   0.799
   69    HB2  ARG  10           HB2      ARG  10  48.993  16.396  -1.135
   70    HB3  ARG  10           HB1      ARG  10  50.241  17.262  -0.209
   71    HG2  ARG  10           HG2      ARG  10  51.922  16.786  -1.886
   72    HG3  ARG  10           HG1      ARG  10  50.819  15.693  -2.756
   73    HD2  ARG  10           HD2      ARG  10  50.963  17.941  -3.835
   74    HD3  ARG  10           HD1      ARG  10  49.317  17.567  -3.273
   75    HE   ARG  10           HE       ARG  10  50.681  18.960  -1.187
   76   HH11  ARG  10          HH11      ARG  10  48.531  19.290  -3.759
   77   HH12  ARG  10          HH12      ARG  10  48.616  21.018  -3.831
   78   HH21  ARG  10          HH21      ARG  10  51.204  21.252  -1.535
   79   HH22  ARG  10          HH22      ARG  10  50.129  22.129  -2.572
   80    H    HIS  11           HN       HIS  11  51.686  12.939  -0.635
   81    HA   HIS  11           HA       HIS  11  49.370  11.462  -1.658
   82    HB2  HIS  11           HB2      HIS  11  50.024  12.777  -3.675
   83    HB3  HIS  11           HB1      HIS  11  51.668  12.107  -3.551
   84    HD1  HIS  11           HD1      HIS  11  48.290  10.327  -3.126
   85    HD2  HIS  11           HD2      HIS  11  51.732  10.183  -5.538
   86    HE1  HIS  11           HE1      HIS  11  48.041   8.319  -4.688
   87    H    ALA  12           HN       ALA  12  49.566   9.407  -1.756
   88    HA   ALA  12           HA       ALA  12  50.326   7.294  -1.305
   89    HB1  ALA  12           HB1      ALA  12  52.632   6.870  -1.323
   90    HB2  ALA  12           HB2      ALA  12  52.916   8.546  -0.854
   91    HB3  ALA  12           HB3      ALA  12  52.377   8.182  -2.494
   92    H    ALA  13           HN       ALA  13  51.552  10.082   0.474
   93    HA   ALA  13           HA       ALA  13  51.785   8.628   3.006
   94    HB1  ALA  13           HB1      ALA  13  50.895  11.523   2.480
   95    HB2  ALA  13           HB2      ALA  13  52.606  11.060   2.647
   96    HB3  ALA  13           HB3      ALA  13  51.490  10.851   4.016
   97    H    LYS  14           HN       LYS  14  50.149   8.898   0.287
   98    HA   LYS  14           HA       LYS  14  47.310   8.598   1.558
   99    HB2  LYS  14           HB2      LYS  14  47.979  10.422  -0.193
  100    HB3  LYS  14           HB1      LYS  14  48.174   9.033  -1.322
  101    HG2  LYS  14           HG2      LYS  14  45.870   8.784  -1.556
  102    HG3  LYS  14           HG1      LYS  14  45.536   9.128   0.157
  103    HD2  LYS  14           HD2      LYS  14  45.841  11.549  -0.268
  104    HD3  LYS  14           HD1      LYS  14  46.200  11.206  -1.979
  105    HE2  LYS  14           HE2      LYS  14  43.955  10.176  -2.239
  106    HE3  LYS  14           HE1      LYS  14  43.594  10.548  -0.536
  107    HZ1  LYS  14           HZ1      LYS  14  43.588  12.817  -0.956
  108    HZ2  LYS  14           HZ2      LYS  14  42.821  12.182  -2.333
  109    HZ3  LYS  14           HZ3      LYS  14  44.446  12.672  -2.412
  110    H    HIS  15           HN       HIS  15  46.022   7.472  -0.439
  111    HA   HIS  15           HA       HIS  15  45.420   5.286  -1.030
  112    HB2  HIS  15           HB2      HIS  15  46.504   6.371  -3.006
  113    HB3  HIS  15           HB1      HIS  15  48.038   5.598  -2.542
  114    HD1  HIS  15           HD1      HIS  15  48.383   3.711  -4.148
  115    HD2  HIS  15           HD2      HIS  15  44.436   3.873  -2.704
  116    HE1  HIS  15           HE1      HIS  15  47.146   1.682  -5.085
  117    H    ILE  16           HN       ILE  16  47.405   5.526   1.300
  118    HA   ILE  16           HA       ILE  16  47.584   2.933   1.971
  119    HB   ILE  16           HB       ILE  16  49.093   2.299   0.245
  120   HG12  ILE  16          HG12      ILE  16  51.193   1.735   1.394
  121   HG13  ILE  16          HG11      ILE  16  50.814   2.880   2.696
  122   HG21  ILE  16          HG21      ILE  16  49.807   4.471  -0.613
  123   HG22  ILE  16          HG22      ILE  16  51.271   3.608  -0.092
  124   HG23  ILE  16          HG23      ILE  16  50.576   4.864   0.937
  125   HD11  ILE  16           HD1      ILE  16  48.909   1.578   3.396
  126   HD12  ILE  16           HD2      ILE  16  50.241   0.425   3.159
  127   HD13  ILE  16           HD3      ILE  16  48.969   0.581   1.924
  128    H    GLY  17           HN       GLY  17  49.297   5.770   1.917
  129    HA2  GLY  17           HA1      GLY  17  50.029   5.606   4.754
  130    HA3  GLY  17           HA2      GLY  17  50.177   7.035   3.712
  131    H    HIS  18           HN       HIS  18  47.340   6.150   2.727
  132    HA   HIS  18           HA       HIS  18  45.873   7.766   4.805
  133    HB2  HIS  18           HB2      HIS  18  45.511   7.139   1.901
  134    HB3  HIS  18           HB1      HIS  18  44.006   7.178   2.837
  135    HD1  HIS  18           HD1      HIS  18  46.931   9.395   3.775
  136    HD2  HIS  18           HD2      HIS  18  43.182   9.708   1.903
  137    HE1  HIS  18           HE1      HIS  18  46.444  11.883   3.458
  138    H    ALA  19           HN       ALA  19  45.659   4.581   3.081
  139    HA   ALA  19           HA       ALA  19  44.959   3.063   5.342
  140    HB1  ALA  19           HB1      ALA  19  42.591   4.502   4.125
  141    HB2  ALA  19           HB2      ALA  19  42.947   4.169   5.838
  142    HB3  ALA  19           HB3      ALA  19  42.371   2.863   4.784
  143    H    ALA  20           HN       ALA  20  45.824   3.361   2.294
  144    HA   ALA  20           HA       ALA  20  46.003   1.890   0.504
  145    HB1  ALA  20           HB1      ALA  20  46.117  -0.437   0.973
  146    HB2  ALA  20           HB2      ALA  20  45.017  -0.296   2.365
  147    HB3  ALA  20           HB3      ALA  20  46.666   0.363   2.462
  148    H    VAL  21           HN       VAL  21  43.319   2.969   1.766
  149    HA   VAL  21           HA       VAL  21  41.585   1.828  -0.375
  150    HB   VAL  21           HB       VAL  21  40.819   1.943   2.581
  151   HG11  VAL  21          HG11      VAL  21  38.841   2.509   1.400
  152   HG12  VAL  21          HG12      VAL  21  38.703   0.748   1.581
  153   HG13  VAL  21          HG13      VAL  21  39.235   1.442   0.031
  154   HG21  VAL  21          HG21      VAL  21  40.529  -0.546   2.275
  155   HG22  VAL  21          HG22      VAL  21  42.212  -0.007   2.087
  156   HG23  VAL  21          HG23      VAL  21  41.235  -0.387   0.649
  157    H    ASN  22           HN       ASN  22  42.879   4.272   1.472
  158    HA   ASN  22           HA       ASN  22  42.686   6.590   0.966
  159    HB2  ASN  22           HB2      ASN  22  39.735   6.213   0.352
  160    HB3  ASN  22           HB1      ASN  22  40.758   7.625   0.020
  161   HD21  ASN  22          HD21      ASN  22  39.195   5.747  -1.873
  162   HD22  ASN  22          HD22      ASN  22  40.417   5.243  -3.046
  163    H    HIS  23           HN       HIS  23  40.206   4.710   2.608
  164    HA   HIS  23           HA       HIS  23  40.664   5.995   5.125
  165    HB2  HIS  23           HB2      HIS  23  38.370   7.118   5.298
  166    HB3  HIS  23           HB1      HIS  23  39.573   7.955   4.290
  167    HD1  HIS  23           HD1      HIS  23  38.726   5.142   2.314
  168    HD2  HIS  23           HD2      HIS  23  36.663   8.676   3.286
  169    HE1  HIS  23           HE1      HIS  23  36.943   5.499   0.521
  170    H    TYR  24           HN       TYR  24  40.719   3.764   5.658
  171    HA   TYR  24           HA       TYR  24  38.483   2.010   5.171
  172    HB2  TYR  24           HB2      TYR  24  40.755   1.191   5.684
  173    HB3  TYR  24           HB1      TYR  24  40.636   1.880   7.321
  174    HD1  TYR  24           HD1      TYR  24  38.778  -0.412   4.970
  175    HD2  TYR  24           HD2      TYR  24  39.784   0.519   9.065
  176    HE1  TYR  24           HE1      TYR  24  37.603  -2.474   5.729
  177    HE2  TYR  24           HE2      TYR  24  38.609  -1.543   9.822
  178    HH   TYR  24           HH       TYR  24  36.459  -3.048   8.432
  179    H    LEU  25           HN       LEU  25  39.087   4.530   7.475
  180    HA   LEU  25           HA       LEU  25  37.306   3.558   9.548
  181    HB2  LEU  25           HB2      LEU  25  37.977   6.469   8.996
  182    HB3  LEU  25           HB1      LEU  25  37.593   5.696  10.552
  183    HG   LEU  25           HG       LEU  25  40.080   5.209   8.854
  184   HD11  LEU  25          HD11      LEU  25  41.265   6.289  10.696
  185   HD12  LEU  25          HD12      LEU  25  39.755   6.434  11.628
  186   HD13  LEU  25          HD13      LEU  25  39.972   7.375  10.131
  187   HD21  LEU  25          HD21      LEU  25  40.759   3.900  10.992
  188   HD22  LEU  25          HD22      LEU  25  39.589   3.121   9.904
  189   HD23  LEU  25          HD23      LEU  25  39.025   3.907  11.399
  Start of MODEL   26
    1    H1   GLY   1           HT1      GLY   1  66.785  13.337  -4.334
    2    H2   GLY   1           HT2      GLY   1  66.665  14.613  -3.218
    3    H3   GLY   1           HT3      GLY   1  68.191  14.031  -3.690
    4    HA2  GLY   1           HA1      GLY   1  68.284  15.375  -5.373
    5    HA3  GLY   1           HA2      GLY   1  66.727  14.757  -5.956
    6    H    TRP   2           HN       TRP   2  65.604  16.527  -6.499
    7    HA   TRP   2           HA       TRP   2  65.796  19.034  -5.105
    8    HB2  TRP   2           HB2      TRP   2  63.649  17.913  -6.947
    9    HB3  TRP   2           HB1      TRP   2  63.714  19.602  -6.387
   10    HD1  TRP   2           HD1      TRP   2  66.259  20.789  -6.878
   11    HE1  TRP   2           HE1      TRP   2  67.635  20.726  -9.083
   12    HE3  TRP   2           HE3      TRP   2  64.126  16.669  -9.042
   13    HZ2  TRP   2           HZ2      TRP   2  67.767  19.091 -11.450
   14    HZ3  TRP   2           HZ3      TRP   2  64.892  15.877 -11.275
   15    HH2  TRP   2           HH2      TRP   2  66.709  17.082 -12.479
   16    H    GLY   3           HN       GLY   3  62.655  17.436  -5.482
   17    HA2  GLY   3           HA1      GLY   3  62.146  16.632  -2.858
   18    HA3  GLY   3           HA2      GLY   3  61.800  18.372  -2.882
   19    H    SER   4           HN       SER   4  61.298  17.228  -5.962
   20    HA   SER   4           HA       SER   4  59.356  16.881  -7.182
   21    HB2  SER   4           HB2      SER   4  59.471  14.719  -5.871
   22    HB3  SER   4           HB1      SER   4  58.345  15.444  -4.700
   23    HG   SER   4           HG       SER   4  56.963  15.837  -6.584
   24    H    ILE   5           HN       ILE   5  56.989  17.321  -7.312
   25    HA   ILE   5           HA       ILE   5  56.450  19.879  -6.029
   26    HB   ILE   5           HB       ILE   5  55.698  19.478  -8.315
   27   HG12  ILE   5          HG12      ILE   5  53.276  19.640  -6.459
   28   HG13  ILE   5          HG11      ILE   5  54.385  20.990  -6.790
   29   HG21  ILE   5          HG21      ILE   5  55.223  16.918  -7.733
   30   HG22  ILE   5          HG22      ILE   5  54.306  17.736  -9.015
   31   HG23  ILE   5          HG23      ILE   5  53.576  17.509  -7.413
   32   HD11  ILE   5           HD1      ILE   5  53.893  20.711  -9.246
   33   HD12  ILE   5           HD2      ILE   5  52.472  21.181  -8.284
   34   HD13  ILE   5           HD3      ILE   5  52.669  19.493  -8.815
   35    H    PHE   6           HN       PHE   6  56.533  19.330  -3.804
   36    HA   PHE   6           HA       PHE   6  55.653  18.582  -1.782
   37    HB2  PHE   6           HB2      PHE   6  53.111  19.328  -3.275
   38    HB3  PHE   6           HB1      PHE   6  53.219  19.065  -1.517
   39    HD1  PHE   6           HD1      PHE   6  54.399  20.645  -0.067
   40    HD2  PHE   6           HD2      PHE   6  54.220  21.258  -4.337
   41    HE1  PHE   6           HE1      PHE   6  55.208  22.983   0.233
   42    HE2  PHE   6           HE2      PHE   6  55.028  23.595  -4.035
   43    HZ   PHE   6           HZ       PHE   6  55.622  24.420  -1.759
   44    H    LYS   7           HN       LYS   7  55.736  16.596  -4.201
   45    HA   LYS   7           HA       LYS   7  53.571  14.743  -3.746
   46    HB2  LYS   7           HB2      LYS   7  55.060  14.815  -5.789
   47    HB3  LYS   7           HB1      LYS   7  56.354  14.108  -4.790
   48    HG2  LYS   7           HG2      LYS   7  54.950  12.150  -4.300
   49    HG3  LYS   7           HG1      LYS   7  53.600  12.868  -5.205
   50    HD2  LYS   7           HD2      LYS   7  54.670  11.281  -6.680
   51    HD3  LYS   7           HD1      LYS   7  55.095  12.907  -7.256
   52    HE2  LYS   7           HE2      LYS   7  57.316  12.745  -6.449
   53    HE3  LYS   7           HE1      LYS   7  56.918  11.426  -5.323
   54    HZ1  LYS   7           HZ1      LYS   7  57.033   9.889  -6.950
   55    HZ2  LYS   7           HZ2      LYS   7  58.060  11.029  -7.677
   56    HZ3  LYS   7           HZ3      LYS   7  56.433  10.921  -8.155
   57    H    HIS   8           HN       HIS   8  56.898  15.023  -2.491
   58    HA   HIS   8           HA       HIS   8  56.649  12.596  -0.865
   59    HB2  HIS   8           HB2      HIS   8  58.819  13.462  -1.793
   60    HB3  HIS   8           HB1      HIS   8  58.693  14.844  -0.677
   61    HD1  HIS   8           HD1      HIS   8  57.464  11.479   0.464
   62    HD2  HIS   8           HD2      HIS   8  60.961  13.793   0.787
   63    HE1  HIS   8           HE1      HIS   8  58.898  10.440   2.306
   64    H    GLY   9           HN       GLY   9  54.442  13.898  -0.195
   65    HA2  GLY   9           HA1      GLY   9  54.539  14.158   2.582
   66    HA3  GLY   9           HA2      GLY   9  54.802  15.799   1.960
   67    H    ARG  10           HN       ARG  10  53.015  14.211  -0.334
   68    HA   ARG  10           HA       ARG  10  50.374  14.686   0.981
   69    HB2  ARG  10           HB2      ARG  10  51.154  16.007  -1.650
   70    HB3  ARG  10           HB1      ARG  10  49.598  16.148  -0.795
   71    HG2  ARG  10           HG2      ARG  10  50.918  17.079   1.195
   72    HG3  ARG  10           HG1      ARG  10  52.319  17.184   0.101
   73    HD2  ARG  10           HD2      ARG  10  49.669  18.654  -0.075
   74    HD3  ARG  10           HD1      ARG  10  51.314  19.333  -0.027
   75    HE   ARG  10           HE       ARG  10  51.184  17.737  -2.349
   76   HH11  ARG  10          HH11      ARG  10  48.851  18.305  -3.455
   77   HH12  ARG  10          HH12      ARG  10  48.817  19.979  -3.898
   78   HH21  ARG  10          HH21      ARG  10  51.481  20.848  -1.855
   79   HH22  ARG  10          HH22      ARG  10  50.306  21.419  -2.992
   80    H    HIS  11           HN       HIS  11  52.014  12.395  -0.064
   81    HA   HIS  11           HA       HIS  11  49.814  11.065  -1.434
   82    HB2  HIS  11           HB2      HIS  11  50.893  12.277  -3.352
   83    HB3  HIS  11           HB1      HIS  11  52.414  11.433  -2.976
   84    HD1  HIS  11           HD1      HIS  11  52.474   8.814  -3.306
   85    HD2  HIS  11           HD2      HIS  11  49.016  10.724  -4.745
   86    HE1  HIS  11           HE1      HIS  11  51.233   7.134  -4.779
   87    H    ALA  12           HN       ALA  12  49.861   9.002  -1.405
   88    HA   ALA  12           HA       ALA  12  50.398   6.862  -0.767
   89    HB1  ALA  12           HB1      ALA  12  52.976   7.958   0.027
   90    HB2  ALA  12           HB2      ALA  12  52.662   7.559  -1.665
   91    HB3  ALA  12           HB3      ALA  12  52.643   6.293  -0.412
   92    H    ALA  13           HN       ALA  13  51.521   9.667   1.042
   93    HA   ALA  13           HA       ALA  13  51.261   8.351   3.647
   94    HB1  ALA  13           HB1      ALA  13  52.310  10.668   3.406
   95    HB2  ALA  13           HB2      ALA  13  50.874  10.678   4.458
   96    HB3  ALA  13           HB3      ALA  13  50.753  11.261   2.780
   97    H    LYS  14           HN       LYS  14  50.091   8.545   0.696
   98    HA   LYS  14           HA       LYS  14  47.072   8.489   1.517
   99    HB2  LYS  14           HB2      LYS  14  48.124  10.180  -0.185
  100    HB3  LYS  14           HB1      LYS  14  48.400   8.725  -1.209
  101    HG2  LYS  14           HG2      LYS  14  46.154   8.610  -1.803
  102    HG3  LYS  14           HG1      LYS  14  45.577   9.033  -0.176
  103    HD2  LYS  14           HD2      LYS  14  46.129  11.420  -0.619
  104    HD3  LYS  14           HD1      LYS  14  46.666  10.979  -2.259
  105    HE2  LYS  14           HE2      LYS  14  43.863  10.610  -1.113
  106    HE3  LYS  14           HE1      LYS  14  44.352  11.796  -2.345
  107    HZ1  LYS  14           HZ1      LYS  14  43.896   8.934  -2.594
  108    HZ2  LYS  14           HZ2      LYS  14  45.242   9.534  -3.439
  109    HZ3  LYS  14           HZ3      LYS  14  43.695  10.172  -3.736
  110    H    HIS  15           HN       HIS  15  46.045   7.329  -0.618
  111    HA   HIS  15           HA       HIS  15  45.412   5.150  -1.196
  112    HB2  HIS  15           HB2      HIS  15  46.908   6.087  -3.000
  113    HB3  HIS  15           HB1      HIS  15  48.255   5.179  -2.271
  114    HD1  HIS  15           HD1      HIS  15  48.409   2.683  -2.725
  115    HD2  HIS  15           HD2      HIS  15  44.758   4.346  -3.985
  116    HE1  HIS  15           HE1      HIS  15  47.190   0.900  -4.090
  117    H    ILE  16           HN       ILE  16  47.015   5.411   1.415
  118    HA   ILE  16           HA       ILE  16  46.909   2.851   2.226
  119    HB   ILE  16           HB       ILE  16  48.637   2.031   0.811
  120   HG12  ILE  16          HG12      ILE  16  50.223   2.670   3.325
  121   HG13  ILE  16          HG11      ILE  16  48.825   1.578   3.397
  122   HG21  ILE  16          HG21      ILE  16  50.125   4.559   1.624
  123   HG22  ILE  16          HG22      ILE  16  49.611   4.124  -0.015
  124   HG23  ILE  16          HG23      ILE  16  50.919   3.228   0.781
  125   HD11  ILE  16           HD1      ILE  16  50.719   0.163   3.080
  126   HD12  ILE  16           HD2      ILE  16  51.407   1.211   1.824
  127   HD13  ILE  16           HD3      ILE  16  49.947   0.252   1.485
  128    H    GLY  17           HN       GLY  17  48.677   5.651   2.317
  129    HA2  GLY  17           HA1      GLY  17  48.958   5.562   5.254
  130    HA3  GLY  17           HA2      GLY  17  49.386   6.919   4.192
  131    H    HIS  18           HN       HIS  18  46.690   6.113   2.770
  132    HA   HIS  18           HA       HIS  18  45.001   7.930   4.488
  133    HB2  HIS  18           HB2      HIS  18  45.121   7.191   1.587
  134    HB3  HIS  18           HB1      HIS  18  43.483   7.389   2.238
  135    HD1  HIS  18           HD1      HIS  18  43.199   9.575   0.793
  136    HD2  HIS  18           HD2      HIS  18  46.252   9.767   3.680
  137    HE1  HIS  18           HE1      HIS  18  43.840  12.033   1.062
  138    H    ALA  19           HN       ALA  19  44.935   4.664   2.911
  139    HA   ALA  19           HA       ALA  19  43.717   3.320   5.047
  140    HB1  ALA  19           HB1      ALA  19  41.715   4.520   5.142
  141    HB2  ALA  19           HB2      ALA  19  41.260   3.252   3.985
  142    HB3  ALA  19           HB3      ALA  19  41.724   4.867   3.397
  143    H    ALA  20           HN       ALA  20  45.158   3.369   2.227
  144    HA   ALA  20           HA       ALA  20  45.593   1.764   0.607
  145    HB1  ALA  20           HB1      ALA  20  45.630   0.315   2.738
  146    HB2  ALA  20           HB2      ALA  20  45.390  -0.522   1.185
  147    HB3  ALA  20           HB3      ALA  20  44.002  -0.220   2.257
  148    H    VAL  21           HN       VAL  21  42.751   3.102   1.214
  149    HA   VAL  21           HA       VAL  21  41.546   2.057  -1.295
  150    HB   VAL  21           HB       VAL  21  39.926   2.219   1.287
  151   HG11  VAL  21          HG11      VAL  21  39.340   1.292  -1.559
  152   HG12  VAL  21          HG12      VAL  21  38.532   2.584  -0.644
  153   HG13  VAL  21          HG13      VAL  21  38.292   0.887  -0.182
  154   HG21  VAL  21          HG21      VAL  21  41.141  -0.177  -0.161
  155   HG22  VAL  21          HG22      VAL  21  39.860  -0.316   1.067
  156   HG23  VAL  21          HG23      VAL  21  41.448   0.342   1.513
  157    H    ASN  22           HN       ASN  22  42.346   4.437   0.941
  158    HA   ASN  22           HA       ASN  22  42.361   6.762   0.259
  159    HB2  ASN  22           HB2      ASN  22  40.901   6.363  -1.769
  160    HB3  ASN  22           HB1      ASN  22  39.488   6.426  -0.683
  161   HD21  ASN  22          HD21      ASN  22  39.511   8.371  -2.612
  162   HD22  ASN  22          HD22      ASN  22  39.980   9.926  -1.917
  163    H    HIS  23           HN       HIS  23  39.504   5.090   1.607
  164    HA   HIS  23           HA       HIS  23  39.831   6.365   4.166
  165    HB2  HIS  23           HB2      HIS  23  38.955   8.337   2.861
  166    HB3  HIS  23           HB1      HIS  23  37.477   7.402   2.539
  167    HD1  HIS  23           HD1      HIS  23  35.939   6.797   4.596
  168    HD2  HIS  23           HD2      HIS  23  39.110   9.427   5.444
  169    HE1  HIS  23           HE1      HIS  23  35.494   7.809   6.899
  170    H    TYR  24           HN       TYR  24  38.049   4.491   1.842
  171    HA   TYR  24           HA       TYR  24  36.006   3.579   3.720
  172    HB2  TYR  24           HB2      TYR  24  36.931   2.361   1.090
  173    HB3  TYR  24           HB1      TYR  24  35.427   1.979   1.959
  174    HD1  TYR  24           HD1      TYR  24  33.553   3.542   1.998
  175    HD2  TYR  24           HD2      TYR  24  37.241   4.559   0.001
  176    HE1  TYR  24           HE1      TYR  24  32.421   5.466   0.888
  177    HE2  TYR  24           HE2      TYR  24  36.110   6.483  -1.108
  178    HH   TYR  24           HH       TYR  24  32.652   7.023  -0.839
  179    H    LEU  25           HN       LEU  25  38.600   3.379   4.847
  180    HA   LEU  25           HA       LEU  25  39.981   0.998   4.688
  181    HB2  LEU  25           HB2      LEU  25  40.635   2.710   6.257
  182    HB3  LEU  25           HB1      LEU  25  39.112   2.549   7.158
  183    HG   LEU  25           HG       LEU  25  39.734   0.344   7.961
  184   HD11  LEU  25          HD11      LEU  25  42.095  -0.528   7.319
  185   HD12  LEU  25          HD12      LEU  25  42.009   0.616   5.957
  186   HD13  LEU  25          HD13      LEU  25  40.810  -0.692   6.102
  187   HD21  LEU  25          HD21      LEU  25  40.729   2.389   9.067
  188   HD22  LEU  25          HD22      LEU  25  42.206   2.120   8.111
  189   HD23  LEU  25          HD23      LEU  25  41.680   0.903   9.299
  Start of MODEL   27
    1    H1   GLY   1           HT1      GLY   1  62.680  15.933   7.411
    2    H2   GLY   1           HT2      GLY   1  61.105  15.400   7.760
    3    H3   GLY   1           HT3      GLY   1  61.416  17.055   7.532
    4    HA2  GLY   1           HA1      GLY   1  61.825  15.004   5.465
    5    HA3  GLY   1           HA2      GLY   1  60.324  15.932   5.653
    6    H    TRP   2           HN       TRP   2  62.049  15.890   3.350
    7    HA   TRP   2           HA       TRP   2  63.666  18.313   3.360
    8    HB2  TRP   2           HB2      TRP   2  62.543  16.705   1.030
    9    HB3  TRP   2           HB1      TRP   2  63.833  17.928   0.937
   10    HD1  TRP   2           HD1      TRP   2  66.091  17.367   2.423
   11    HE1  TRP   2           HE1      TRP   2  67.264  15.090   2.875
   12    HE3  TRP   2           HE3      TRP   2  62.207  14.224   1.308
   13    HZ2  TRP   2           HZ2      TRP   2  66.577  12.297   2.759
   14    HZ3  TRP   2           HZ3      TRP   2  62.489  11.756   1.485
   15    HH2  TRP   2           HH2      TRP   2  64.668  10.791   2.209
   16    H    GLY   3           HN       GLY   3  63.082  19.691   1.128
   17    HA2  GLY   3           HA1      GLY   3  60.460  20.970   1.827
   18    HA3  GLY   3           HA2      GLY   3  61.826  21.749   1.005
   19    H    SER   4           HN       SER   4  60.868  18.513   0.128
   20    HA   SER   4           HA       SER   4  60.707  18.865  -2.596
   21    HB2  SER   4           HB2      SER   4  58.730  17.158  -1.048
   22    HB3  SER   4           HB1      SER   4  59.324  16.897  -2.703
   23    HG   SER   4           HG       SER   4  60.378  16.062  -0.411
   24    H    ILE   5           HN       ILE   5  58.929  18.999  -4.126
   25    HA   ILE   5           HA       ILE   5  57.187  21.265  -3.477
   26    HB   ILE   5           HB       ILE   5  56.331  20.853  -5.850
   27   HG12  ILE   5          HG12      ILE   5  58.640  18.852  -5.928
   28   HG13  ILE   5          HG11      ILE   5  56.942  18.364  -5.753
   29   HG21  ILE   5          HG21      ILE   5  58.361  21.726  -6.882
   30   HG22  ILE   5          HG22      ILE   5  59.362  21.074  -5.564
   31   HG23  ILE   5          HG23      ILE   5  58.229  22.409  -5.246
   32   HD11  ILE   5           HD1      ILE   5  57.354  18.210  -8.085
   33   HD12  ILE   5           HD2      ILE   5  58.281  19.727  -8.113
   34   HD13  ILE   5           HD3      ILE   5  56.514  19.766  -7.904
   35    H    PHE   6           HN       PHE   6  56.413  19.552  -1.642
   36    HA   PHE   6           HA       PHE   6  54.597  18.367  -0.820
   37    HB2  PHE   6           HB2      PHE   6  53.136  19.545  -3.216
   38    HB3  PHE   6           HB1      PHE   6  52.406  18.936  -1.713
   39    HD1  PHE   6           HD1      PHE   6  53.937  21.793  -3.351
   40    HD2  PHE   6           HD2      PHE   6  53.037  20.065   0.501
   41    HE1  PHE   6           HE1      PHE   6  54.240  24.022  -2.279
   42    HE2  PHE   6           HE2      PHE   6  53.340  22.294   1.572
   43    HZ   PHE   6           HZ       PHE   6  53.872  24.285   0.171
   44    H    LYS   7           HN       LYS   7  56.219  16.672  -1.974
   45    HA   LYS   7           HA       LYS   7  54.459  14.915  -3.690
   46    HB2  LYS   7           HB2      LYS   7  56.525  15.928  -4.820
   47    HB3  LYS   7           HB1      LYS   7  57.500  14.969  -3.688
   48    HG2  LYS   7           HG2      LYS   7  57.375  13.497  -5.513
   49    HG3  LYS   7           HG1      LYS   7  55.995  12.942  -4.541
   50    HD2  LYS   7           HD2      LYS   7  54.442  14.237  -5.928
   51    HD3  LYS   7           HD1      LYS   7  55.797  14.957  -6.831
   52    HE2  LYS   7           HE2      LYS   7  55.268  11.960  -6.695
   53    HE3  LYS   7           HE1      LYS   7  54.666  13.009  -8.000
   54    HZ1  LYS   7           HZ1      LYS   7  56.640  12.419  -8.903
   55    HZ2  LYS   7           HZ2      LYS   7  57.394  12.144  -7.405
   56    HZ3  LYS   7           HZ3      LYS   7  57.205  13.730  -7.986
   57    H    HIS   8           HN       HIS   8  57.166  15.001  -1.338
   58    HA   HIS   8           HA       HIS   8  56.776  12.170  -0.647
   59    HB2  HIS   8           HB2      HIS   8  59.008  13.277  -0.589
   60    HB3  HIS   8           HB1      HIS   8  58.432  14.321   0.732
   61    HD1  HIS   8           HD1      HIS   8  57.415  10.680   0.482
   62    HD2  HIS   8           HD2      HIS   8  60.050  13.086   2.709
   63    HE1  HIS   8           HE1      HIS   8  58.307   9.254   2.405
   64    H    GLY   9           HN       GLY   9  54.369  13.606  -0.344
   65    HA2  GLY   9           HA1      GLY   9  53.647  12.838   2.309
   66    HA3  GLY   9           HA2      GLY   9  53.913  14.591   2.279
   67    H    ARG  10           HN       ARG  10  53.052  14.268  -0.738
   68    HA   ARG  10           HA       ARG  10  50.154  14.714  -0.140
   69    HB2  ARG  10           HB2      ARG  10  51.655  16.342  -1.506
   70    HB3  ARG  10           HB1      ARG  10  51.543  15.141  -2.812
   71    HG2  ARG  10           HG2      ARG  10  49.084  15.301  -2.783
   72    HG3  ARG  10           HG1      ARG  10  49.153  16.434  -1.415
   73    HD2  ARG  10           HD2      ARG  10  50.602  17.937  -2.913
   74    HD3  ARG  10           HD1      ARG  10  50.131  16.874  -4.262
   75    HE   ARG  10           HE       ARG  10  48.028  17.937  -4.239
   76   HH11  ARG  10          HH11      ARG  10  49.792  18.549  -1.349
   77   HH12  ARG  10          HH12      ARG  10  48.519  19.454  -0.601
   78   HH21  ARG  10          HH21      ARG  10  46.293  18.996  -3.221
   79   HH22  ARG  10          HH22      ARG  10  46.538  19.708  -1.660
   80    H    HIS  11           HN       HIS  11  52.185  12.246  -0.968
   81    HA   HIS  11           HA       HIS  11  49.924  10.622  -1.953
   82    HB2  HIS  11           HB2      HIS  11  51.022  11.620  -4.030
   83    HB3  HIS  11           HB1      HIS  11  52.499  10.738  -3.572
   84    HD1  HIS  11           HD1      HIS  11  48.878  10.175  -4.617
   85    HD2  HIS  11           HD2      HIS  11  52.382   7.940  -3.993
   86    HE1  HIS  11           HE1      HIS  11  48.468   7.838  -5.565
   87    H    ALA  12           HN       ALA  12  50.050   8.595  -1.636
   88    HA   ALA  12           HA       ALA  12  50.654   6.600  -0.703
   89    HB1  ALA  12           HB1      ALA  12  52.902   7.223  -1.706
   90    HB2  ALA  12           HB2      ALA  12  52.911   6.140  -0.290
   91    HB3  ALA  12           HB3      ALA  12  53.204   7.870  -0.102
   92    H    ALA  13           HN       ALA  13  51.713   9.666   0.689
   93    HA   ALA  13           HA       ALA  13  51.512   8.709   3.454
   94    HB1  ALA  13           HB1      ALA  13  51.287  11.408   2.030
   95    HB2  ALA  13           HB2      ALA  13  52.429  10.938   3.313
   96    HB3  ALA  13           HB3      ALA  13  50.716  11.224   3.705
   97    H    LYS  14           HN       LYS  14  50.312   8.458   0.523
   98    HA   LYS  14           HA       LYS  14  47.305   8.424   1.380
   99    HB2  LYS  14           HB2      LYS  14  48.292   9.911  -0.536
  100    HB3  LYS  14           HB1      LYS  14  48.608   8.340  -1.364
  101    HG2  LYS  14           HG2      LYS  14  46.361   8.081  -1.917
  102    HG3  LYS  14           HG1      LYS  14  45.781   8.695  -0.352
  103    HD2  LYS  14           HD2      LYS  14  46.130  11.003  -1.079
  104    HD3  LYS  14           HD1      LYS  14  46.873  10.446  -2.599
  105    HE2  LYS  14           HE2      LYS  14  44.796   9.477  -3.355
  106    HE3  LYS  14           HE1      LYS  14  44.037   9.716  -1.763
  107    HZ1  LYS  14           HZ1      LYS  14  43.509  11.407  -3.559
  108    HZ2  LYS  14           HZ2      LYS  14  45.095  11.981  -3.362
  109    HZ3  LYS  14           HZ3      LYS  14  44.005  12.025  -2.060
  110    H    HIS  15           HN       HIS  15  46.300   6.961  -0.584
  111    HA   HIS  15           HA       HIS  15  45.732   4.700  -0.849
  112    HB2  HIS  15           HB2      HIS  15  48.509   4.990  -2.052
  113    HB3  HIS  15           HB1      HIS  15  47.444   3.594  -2.347
  114    HD1  HIS  15           HD1      HIS  15  44.987   6.003  -2.053
  115    HD2  HIS  15           HD2      HIS  15  47.930   5.364  -4.991
  116    HE1  HIS  15           HE1      HIS  15  44.206   7.179  -4.184
  117    H    ILE  16           HN       ILE  16  47.290   5.353   1.682
  118    HA   ILE  16           HA       ILE  16  47.308   2.940   2.835
  119    HB   ILE  16           HB       ILE  16  49.051   1.979   1.531
  120   HG12  ILE  16          HG12      ILE  16  50.554   3.030   3.958
  121   HG13  ILE  16          HG11      ILE  16  49.256   1.827   4.111
  122   HG21  ILE  16          HG21      ILE  16  50.485   4.630   1.976
  123   HG22  ILE  16          HG22      ILE  16  49.971   3.963   0.417
  124   HG23  ILE  16          HG23      ILE  16  51.300   3.210   1.318
  125   HD11  ILE  16           HD1      ILE  16  50.628   0.491   2.285
  126   HD12  ILE  16           HD2      ILE  16  51.183   0.479   3.972
  127   HD13  ILE  16           HD3      ILE  16  51.972   1.541   2.789
  128    H    GLY  17           HN       GLY  17  49.035   5.749   2.527
  129    HA2  GLY  17           HA1      GLY  17  49.350   6.079   5.435
  130    HA3  GLY  17           HA2      GLY  17  49.713   7.293   4.192
  131    H    HIS  18           HN       HIS  18  47.015   6.238   2.961
  132    HA   HIS  18           HA       HIS  18  45.314   8.223   4.477
  133    HB2  HIS  18           HB2      HIS  18  45.372   7.117   1.688
  134    HB3  HIS  18           HB1      HIS  18  43.752   7.394   2.360
  135    HD1  HIS  18           HD1      HIS  18  46.611   9.613   3.433
  136    HD2  HIS  18           HD2      HIS  18  43.429   9.704   0.683
  137    HE1  HIS  18           HE1      HIS  18  46.380  12.022   2.615
  138    H    ALA  19           HN       ALA  19  45.326   4.790   3.334
  139    HA   ALA  19           HA       ALA  19  44.209   3.659   5.625
  140    HB1  ALA  19           HB1      ALA  19  42.174   4.808   5.676
  141    HB2  ALA  19           HB2      ALA  19  41.715   3.414   4.678
  142    HB3  ALA  19           HB3      ALA  19  42.104   4.971   3.906
  143    H    ALA  20           HN       ALA  20  45.530   3.472   2.752
  144    HA   ALA  20           HA       ALA  20  45.948   1.738   1.270
  145    HB1  ALA  20           HB1      ALA  20  45.878  -0.489   2.084
  146    HB2  ALA  20           HB2      ALA  20  44.559  -0.123   3.219
  147    HB3  ALA  20           HB3      ALA  20  46.193   0.518   3.516
  148    H    VAL  21           HN       VAL  21  43.097   3.017   1.885
  149    HA   VAL  21           HA       VAL  21  41.771   1.612  -0.384
  150    HB   VAL  21           HB       VAL  21  40.377   2.106   2.290
  151   HG11  VAL  21          HG11      VAL  21  38.609   0.617   1.095
  152   HG12  VAL  21          HG12      VAL  21  39.492   0.993  -0.402
  153   HG13  VAL  21          HG13      VAL  21  38.756   2.301   0.553
  154   HG21  VAL  21          HG21      VAL  21  40.270  -0.425   2.369
  155   HG22  VAL  21          HG22      VAL  21  41.914   0.229   2.528
  156   HG23  VAL  21          HG23      VAL  21  41.379  -0.462   0.978
  157    H    ASN  22           HN       ASN  22  42.675   4.304   1.403
  158    HA   ASN  22           HA       ASN  22  42.573   6.528   0.503
  159    HB2  ASN  22           HB2      ASN  22  41.122   5.734  -1.468
  160    HB3  ASN  22           HB1      ASN  22  39.716   6.025  -0.408
  161   HD21  ASN  22          HD21      ASN  22  40.658   7.494  -2.935
  162   HD22  ASN  22          HD22      ASN  22  40.781   9.179  -2.420
  163    H    HIS  23           HN       HIS  23  39.922   4.814   2.064
  164    HA   HIS  23           HA       HIS  23  40.030   6.532   4.383
  165    HB2  HIS  23           HB2      HIS  23  37.689   7.454   4.144
  166    HB3  HIS  23           HB1      HIS  23  38.874   8.160   3.020
  167    HD1  HIS  23           HD1      HIS  23  38.507   4.986   1.608
  168    HD2  HIS  23           HD2      HIS  23  35.956   8.325   1.781
  169    HE1  HIS  23           HE1      HIS  23  36.781   4.723  -0.258
  170    H    TYR  24           HN       TYR  24  39.797   4.980   5.866
  171    HA   TYR  24           HA       TYR  24  38.375   2.534   5.379
  172    HB2  TYR  24           HB2      TYR  24  38.783   2.033   7.699
  173    HB3  TYR  24           HB1      TYR  24  40.210   2.891   7.079
  174    HD1  TYR  24           HD1      TYR  24  37.455   2.958   9.473
  175    HD2  TYR  24           HD2      TYR  24  40.480   5.370   7.559
  176    HE1  TYR  24           HE1      TYR  24  37.182   4.700  11.234
  177    HE2  TYR  24           HE2      TYR  24  40.205   7.112   9.318
  178    HH   TYR  24           HH       TYR  24  37.860   7.572  11.153
  179    H    LEU  25           HN       LEU  25  37.150   5.583   5.665
  180    HA   LEU  25           HA       LEU  25  34.896   5.089   7.434
  181    HB2  LEU  25           HB2      LEU  25  35.007   7.150   5.204
  182    HB3  LEU  25           HB1      LEU  25  34.108   7.227   6.738
  183    HG   LEU  25           HG       LEU  25  37.147   7.252   6.444
  184   HD11  LEU  25          HD11      LEU  25  35.236   9.437   7.376
  185   HD12  LEU  25          HD12      LEU  25  35.915   9.339   5.733
  186   HD13  LEU  25          HD13      LEU  25  36.993   9.578   7.129
  187   HD21  LEU  25          HD21      LEU  25  35.277   7.270   8.850
  188   HD22  LEU  25          HD22      LEU  25  36.941   7.896   8.945
  189   HD23  LEU  25          HD23      LEU  25  36.656   6.191   8.531
  Start of MODEL   28
    1    H1   GLY   1           HT1      GLY   1  68.246  16.748  -6.423
    2    H2   GLY   1           HT2      GLY   1  68.245  15.211  -7.149
    3    H3   GLY   1           HT3      GLY   1  66.984  15.663  -6.101
    4    HA2  GLY   1           HA1      GLY   1  67.585  17.080  -8.603
    5    HA3  GLY   1           HA2      GLY   1  66.465  15.706  -8.512
    6    H    TRP   2           HN       TRP   2  64.400  16.107  -8.096
    7    HA   TRP   2           HA       TRP   2  63.477  18.810  -7.773
    8    HB2  TRP   2           HB2      TRP   2  62.001  16.200  -7.241
    9    HB3  TRP   2           HB1      TRP   2  61.259  17.796  -7.502
   10    HD1  TRP   2           HD1      TRP   2  61.082  18.683  -9.940
   11    HE1  TRP   2           HE1      TRP   2  61.544  17.670 -12.290
   12    HE3  TRP   2           HE3      TRP   2  63.645  14.486  -8.519
   13    HZ2  TRP   2           HZ2      TRP   2  62.855  15.344 -13.372
   14    HZ3  TRP   2           HZ3      TRP   2  64.492  12.884 -10.226
   15    HH2  TRP   2           HH2      TRP   2  64.101  13.309 -12.648
   16    H    GLY   3           HN       GLY   3  62.955  20.004  -6.031
   17    HA2  GLY   3           HA1      GLY   3  63.956  19.166  -3.453
   18    HA3  GLY   3           HA2      GLY   3  63.045  20.648  -3.805
   19    H    SER   4           HN       SER   4  61.125  18.389  -5.086
   20    HA   SER   4           HA       SER   4  59.058  17.579  -4.394
   21    HB2  SER   4           HB2      SER   4  59.172  16.107  -2.343
   22    HB3  SER   4           HB1      SER   4  60.396  15.746  -3.580
   23    HG   SER   4           HG       SER   4  60.891  16.173  -1.116
   24    H    ILE   5           HN       ILE   5  58.124  19.683  -4.152
   25    HA   ILE   5           HA       ILE   5  58.233  21.246  -1.798
   26    HB   ILE   5           HB       ILE   5  57.194  21.897  -4.030
   27   HG12  ILE   5          HG12      ILE   5  55.619  22.326  -1.454
   28   HG13  ILE   5          HG11      ILE   5  56.949  23.329  -2.071
   29   HG21  ILE   5          HG21      ILE   5  54.953  21.257  -4.554
   30   HG22  ILE   5          HG22      ILE   5  54.690  20.555  -2.939
   31   HG23  ILE   5          HG23      ILE   5  55.772  19.745  -4.098
   32   HD11  ILE   5           HD1      ILE   5  55.478  23.675  -4.177
   33   HD12  ILE   5           HD2      ILE   5  54.975  24.508  -2.686
   34   HD13  ILE   5           HD3      ILE   5  54.144  23.020  -3.198
   35    H    PHE   6           HN       PHE   6  56.062  18.547  -2.677
   36    HA   PHE   6           HA       PHE   6  55.622  17.956   0.168
   37    HB2  PHE   6           HB2      PHE   6  53.406  19.084  -1.584
   38    HB3  PHE   6           HB1      PHE   6  53.044  18.007  -0.217
   39    HD1  PHE   6           HD1      PHE   6  54.380  18.649   2.048
   40    HD2  PHE   6           HD2      PHE   6  53.408  21.405  -1.133
   41    HE1  PHE   6           HE1      PHE   6  54.570  20.555   3.637
   42    HE2  PHE   6           HE2      PHE   6  53.605  23.308   0.459
   43    HZ   PHE   6           HZ       PHE   6  54.173  22.883   2.846
   44    H    LYS   7           HN       LYS   7  55.811  17.209  -3.113
   45    HA   LYS   7           HA       LYS   7  54.174  14.952  -3.448
   46    HB2  LYS   7           HB2      LYS   7  57.030  15.333  -4.426
   47    HB3  LYS   7           HB1      LYS   7  55.841  14.189  -5.095
   48    HG2  LYS   7           HG2      LYS   7  54.314  16.212  -5.490
   49    HG3  LYS   7           HG1      LYS   7  55.724  17.231  -5.117
   50    HD2  LYS   7           HD2      LYS   7  55.628  15.096  -7.294
   51    HD3  LYS   7           HD1      LYS   7  55.466  16.845  -7.569
   52    HE2  LYS   7           HE2      LYS   7  57.754  17.048  -6.332
   53    HE3  LYS   7           HE1      LYS   7  57.899  15.296  -6.621
   54    HZ1  LYS   7           HZ1      LYS   7  57.750  15.630  -8.944
   55    HZ2  LYS   7           HZ2      LYS   7  58.878  16.767  -8.375
   56    HZ3  LYS   7           HZ3      LYS   7  57.300  17.257  -8.772
   57    H    HIS   8           HN       HIS   8  56.818  15.394  -1.279
   58    HA   HIS   8           HA       HIS   8  57.602  12.602  -1.090
   59    HB2  HIS   8           HB2      HIS   8  59.077  14.473  -0.398
   60    HB3  HIS   8           HB1      HIS   8  57.943  14.867   0.915
   61    HD1  HIS   8           HD1      HIS   8  59.018  14.091   3.036
   62    HD2  HIS   8           HD2      HIS   8  59.471  11.302  -0.079
   63    HE1  HIS   8           HE1      HIS   8  60.127  12.014   4.028
   64    H    GLY   9           HN       GLY   9  54.696  13.947  -0.457
   65    HA2  GLY   9           HA1      GLY   9  53.880  11.738   1.224
   66    HA3  GLY   9           HA2      GLY   9  53.980  13.245   2.155
   67    H    ARG  10           HN       ARG  10  53.221  13.426  -1.233
   68    HA   ARG  10           HA       ARG  10  50.450  14.313  -0.523
   69    HB2  ARG  10           HB2      ARG  10  52.195  15.641  -1.993
   70    HB3  ARG  10           HB1      ARG  10  51.720  14.510  -3.274
   71    HG2  ARG  10           HG2      ARG  10  50.179  16.246  -3.630
   72    HG3  ARG  10           HG1      ARG  10  49.241  15.186  -2.557
   73    HD2  ARG  10           HD2      ARG  10  49.789  16.567  -0.621
   74    HD3  ARG  10           HD1      ARG  10  50.920  17.547  -1.586
   75    HE   ARG  10           HE       ARG  10  48.142  17.515  -2.578
   76   HH11  ARG  10          HH11      ARG  10  47.078  18.954  -0.698
   77   HH12  ARG  10          HH12      ARG  10  47.815  20.521  -0.642
   78   HH21  ARG  10          HH21      ARG  10  50.599  19.570  -2.476
   79   HH22  ARG  10          HH22      ARG  10  49.808  20.869  -1.648
   80    H    HIS  11           HN       HIS  11  52.012  11.532  -1.354
   81    HA   HIS  11           HA       HIS  11  49.498  10.290  -2.216
   82    HB2  HIS  11           HB2      HIS  11  50.578   9.240  -4.253
   83    HB3  HIS  11           HB1      HIS  11  50.260  10.984  -4.413
   84    HD1  HIS  11           HD1      HIS  11  53.157   8.892  -2.955
   85    HD2  HIS  11           HD2      HIS  11  52.494  12.254  -5.391
   86    HE1  HIS  11           HE1      HIS  11  55.442   9.749  -3.710
   87    H    ALA  12           HN       ALA  12  49.336   8.275  -1.906
   88    HA   ALA  12           HA       ALA  12  49.709   6.193  -1.048
   89    HB1  ALA  12           HB1      ALA  12  51.922   6.485  -2.253
   90    HB2  ALA  12           HB2      ALA  12  51.894   5.383  -0.853
   91    HB3  ALA  12           HB3      ALA  12  52.466   7.043  -0.681
   92    H    ALA  13           HN       ALA  13  51.343   9.033   0.244
   93    HA   ALA  13           HA       ALA  13  51.286   8.085   3.011
   94    HB1  ALA  13           HB1      ALA  13  50.938  10.662   3.373
   95    HB2  ALA  13           HB2      ALA  13  51.253  10.819   1.628
   96    HB3  ALA  13           HB3      ALA  13  52.509  10.162   2.706
   97    H    LYS  14           HN       LYS  14  49.771   8.059   0.216
   98    HA   LYS  14           HA       LYS  14  46.883   8.453   1.368
   99    HB2  LYS  14           HB2      LYS  14  47.894   9.820  -0.636
  100    HB3  LYS  14           HB1      LYS  14  47.896   8.234  -1.494
  101    HG2  LYS  14           HG2      LYS  14  45.592   8.302  -1.826
  102    HG3  LYS  14           HG1      LYS  14  45.258   8.956  -0.210
  103    HD2  LYS  14           HD2      LYS  14  44.572  10.632  -1.777
  104    HD3  LYS  14           HD1      LYS  14  46.105  11.217  -1.094
  105    HE2  LYS  14           HE2      LYS  14  47.304  10.256  -3.074
  106    HE3  LYS  14           HE1      LYS  14  45.736   9.780  -3.760
  107    HZ1  LYS  14           HZ1      LYS  14  46.843  12.066  -4.358
  108    HZ2  LYS  14           HZ2      LYS  14  46.103  12.567  -2.913
  109    HZ3  LYS  14           HZ3      LYS  14  45.163  11.932  -4.176
  110    H    HIS  15           HN       HIS  15  45.497   7.177  -0.516
  111    HA   HIS  15           HA       HIS  15  44.601   5.018  -0.765
  112    HB2  HIS  15           HB2      HIS  15  45.907   5.582  -2.816
  113    HB3  HIS  15           HB1      HIS  15  47.308   4.734  -2.122
  114    HD1  HIS  15           HD1      HIS  15  47.299   2.166  -2.108
  115    HD2  HIS  15           HD2      HIS  15  43.721   3.847  -3.547
  116    HE1  HIS  15           HE1      HIS  15  45.932   0.272  -3.143
  117    H    ILE  16           HN       ILE  16  46.417   5.390   1.659
  118    HA   ILE  16           HA       ILE  16  46.216   2.989   2.770
  119    HB   ILE  16           HB       ILE  16  47.684   1.772   1.291
  120   HG12  ILE  16          HG12      ILE  16  49.590   2.568   3.524
  121   HG13  ILE  16          HG11      ILE  16  48.125   1.627   3.871
  122   HG21  ILE  16          HG21      ILE  16  49.541   4.180   1.580
  123   HG22  ILE  16          HG22      ILE  16  48.753   3.644   0.090
  124   HG23  ILE  16          HG23      ILE  16  50.033   2.665   0.825
  125   HD11  ILE  16           HD1      ILE  16  50.516   0.836   2.168
  126   HD12  ILE  16           HD2      ILE  16  48.954  -0.001   2.012
  127   HD13  ILE  16           HD3      ILE  16  49.817  -0.008   3.564
  128    H    GLY  17           HN       GLY  17  48.405   5.428   2.281
  129    HA2  GLY  17           HA1      GLY  17  49.069   5.687   5.120
  130    HA3  GLY  17           HA2      GLY  17  49.486   6.832   3.832
  131    H    HIS  18           HN       HIS  18  46.506   6.286   2.955
  132    HA   HIS  18           HA       HIS  18  45.411   8.565   4.590
  133    HB2  HIS  18           HB2      HIS  18  44.873   7.335   1.925
  134    HB3  HIS  18           HB1      HIS  18  43.396   7.747   2.818
  135    HD1  HIS  18           HD1      HIS  18  46.512   9.813   3.333
  136    HD2  HIS  18           HD2      HIS  18  42.992   9.987   1.041
  137    HE1  HIS  18           HE1      HIS  18  46.300  12.197   2.440
  138    H    ALA  19           HN       ALA  19  45.149   5.100   4.028
  139    HA   ALA  19           HA       ALA  19  43.856   4.712   6.598
  140    HB1  ALA  19           HB1      ALA  19  41.833   5.446   5.612
  141    HB2  ALA  19           HB2      ALA  19  41.735   3.671   5.595
  142    HB3  ALA  19           HB3      ALA  19  42.137   4.554   4.098
  143    H    ALA  20           HN       ALA  20  43.595   3.145   3.404
  144    HA   ALA  20           HA       ALA  20  45.552   1.104   3.958
  145    HB1  ALA  20           HB1      ALA  20  43.690   0.428   5.545
  146    HB2  ALA  20           HB2      ALA  20  44.141  -0.798   4.337
  147    HB3  ALA  20           HB3      ALA  20  42.667   0.172   4.113
  148    H    VAL  21           HN       VAL  21  42.942   2.588   2.273
  149    HA   VAL  21           HA       VAL  21  43.976   1.560  -0.308
  150    HB   VAL  21           HB       VAL  21  41.048   1.191   0.493
  151   HG11  VAL  21          HG11      VAL  21  42.596   0.770  -2.096
  152   HG12  VAL  21          HG12      VAL  21  41.142   1.762  -1.833
  153   HG13  VAL  21          HG13      VAL  21  41.025  -0.009  -1.789
  154   HG21  VAL  21          HG21      VAL  21  43.347  -0.768   0.063
  155   HG22  VAL  21          HG22      VAL  21  41.640  -1.267   0.062
  156   HG23  VAL  21          HG23      VAL  21  42.354  -0.559   1.524
  157    H    ASN  22           HN       ASN  22  42.321   3.852   1.693
  158    HA   ASN  22           HA       ASN  22  42.711   6.107   0.126
  159    HB2  ASN  22           HB2      ASN  22  41.440   5.377  -1.745
  160    HB3  ASN  22           HB1      ASN  22  40.200   4.624  -0.713
  161   HD21  ASN  22          HD21      ASN  22  41.675   7.938  -1.135
  162   HD22  ASN  22          HD22      ASN  22  40.119   8.774  -1.109
  163    H    HIS  23           HN       HIS  23  40.281   4.338   2.012
  164    HA   HIS  23           HA       HIS  23  40.292   6.323   4.117
  165    HB2  HIS  23           HB2      HIS  23  38.949   7.520   2.347
  166    HB3  HIS  23           HB1      HIS  23  37.754   6.206   2.450
  167    HD1  HIS  23           HD1      HIS  23  39.678   7.945   5.286
  168    HD2  HIS  23           HD2      HIS  23  35.728   7.285   3.997
  169    HE1  HIS  23           HE1      HIS  23  38.124   8.935   7.056
  170    H    TYR  24           HN       TYR  24  40.452   3.392   3.519
  171    HA   TYR  24           HA       TYR  24  38.197   1.925   4.225
  172    HB2  TYR  24           HB2      TYR  24  40.527   1.075   3.647
  173    HB3  TYR  24           HB1      TYR  24  40.966   1.365   5.346
  174    HD1  TYR  24           HD1      TYR  24  39.991   0.018   7.154
  175    HD2  TYR  24           HD2      TYR  24  38.917  -0.672   3.033
  176    HE1  TYR  24           HE1      TYR  24  38.966  -2.164   7.787
  177    HE2  TYR  24           HE2      TYR  24  37.891  -2.852   3.664
  178    HH   TYR  24           HH       TYR  24  37.153  -4.122   5.577
  179    H    LEU  25           HN       LEU  25  39.913   4.207   6.179
  180    HA   LEU  25           HA       LEU  25  39.284   3.135   8.768
  181    HB2  LEU  25           HB2      LEU  25  40.933   5.004   8.213
  182    HB3  LEU  25           HB1      LEU  25  39.526   6.072   8.030
  183    HG   LEU  25           HG       LEU  25  38.857   5.202  10.438
  184   HD11  LEU  25          HD11      LEU  25  41.835   4.537  10.314
  185   HD12  LEU  25          HD12      LEU  25  40.500   3.435  10.720
  186   HD13  LEU  25          HD13      LEU  25  40.933   4.752  11.830
  187   HD21  LEU  25          HD21      LEU  25  40.228   6.998  11.473
  188   HD22  LEU  25          HD22      LEU  25  39.521   7.526   9.927
  189   HD23  LEU  25          HD23      LEU  25  41.237   7.063  10.009
  Start of MODEL   29
    1    H1   GLY   1           HT1      GLY   1  65.595   6.633  -4.718
    2    H2   GLY   1           HT2      GLY   1  64.128   6.877  -5.541
    3    H3   GLY   1           HT3      GLY   1  64.126   6.487  -3.887
    4    HA2  GLY   1           HA1      GLY   1  63.796   8.670  -3.713
    5    HA3  GLY   1           HA2      GLY   1  65.570   8.610  -3.715
    6    H    TRP   2           HN       TRP   2  64.419  10.944  -4.400
    7    HA   TRP   2           HA       TRP   2  65.386  11.286  -7.127
    8    HB2  TRP   2           HB2      TRP   2  63.060  10.374  -7.499
    9    HB3  TRP   2           HB1      TRP   2  62.425  11.799  -6.644
   10    HD1  TRP   2           HD1      TRP   2  62.051  13.894  -8.046
   11    HE1  TRP   2           HE1      TRP   2  62.693  14.704 -10.432
   12    HE3  TRP   2           HE3      TRP   2  65.158  10.054  -9.393
   13    HZ2  TRP   2           HZ2      TRP   2  64.339  13.783 -12.608
   14    HZ3  TRP   2           HZ3      TRP   2  66.253  10.041 -11.629
   15    HH2  TRP   2           HH2      TRP   2  65.846  11.900 -13.237
   16    H    GLY   3           HN       GLY   3  62.887  12.888  -5.100
   17    HA2  GLY   3           HA1      GLY   3  64.574  14.877  -4.008
   18    HA3  GLY   3           HA2      GLY   3  63.958  15.507  -5.549
   19    H    SER   4           HN       SER   4  61.611  13.462  -4.679
   20    HA   SER   4           HA       SER   4  59.480  13.791  -3.825
   21    HB2  SER   4           HB2      SER   4  60.906  15.472  -1.729
   22    HB3  SER   4           HB1      SER   4  59.312  14.700  -1.578
   23    HG   SER   4           HG       SER   4  61.402  13.615  -0.773
   24    H    ILE   5           HN       ILE   5  59.264  15.118  -5.875
   25    HA   ILE   5           HA       ILE   5  59.316  17.998  -5.700
   26    HB   ILE   5           HB       ILE   5  57.547  16.371  -7.574
   27   HG12  ILE   5          HG12      ILE   5  60.531  16.989  -7.786
   28   HG13  ILE   5          HG11      ILE   5  59.797  15.378  -7.608
   29   HG21  ILE   5          HG21      ILE   5  57.746  18.256  -9.031
   30   HG22  ILE   5          HG22      ILE   5  59.095  18.942  -8.094
   31   HG23  ILE   5          HG23      ILE   5  57.448  18.949  -7.421
   32   HD11  ILE   5           HD1      ILE   5  59.666  17.260  -9.987
   33   HD12  ILE   5           HD2      ILE   5  58.487  15.941  -9.783
   34   HD13  ILE   5           HD3      ILE   5  60.221  15.571  -9.937
   35    H    PHE   6           HN       PHE   6  56.852  15.514  -5.142
   36    HA   PHE   6           HA       PHE   6  55.291  17.377  -3.504
   37    HB2  PHE   6           HB2      PHE   6  54.225  16.394  -6.182
   38    HB3  PHE   6           HB1      PHE   6  53.174  16.973  -4.870
   39    HD1  PHE   6           HD1      PHE   6  54.977  17.987  -7.763
   40    HD2  PHE   6           HD2      PHE   6  53.924  19.299  -3.786
   41    HE1  PHE   6           HE1      PHE   6  55.387  20.351  -8.432
   42    HE2  PHE   6           HE2      PHE   6  54.338  21.663  -4.457
   43    HZ   PHE   6           HZ       PHE   6  55.099  22.185  -6.770
   44    H    LYS   7           HN       LYS   7  56.493  14.415  -4.317
   45    HA   LYS   7           HA       LYS   7  54.414  12.590  -3.671
   46    HB2  LYS   7           HB2      LYS   7  57.394  12.345  -3.098
   47    HB3  LYS   7           HB1      LYS   7  56.224  11.004  -3.169
   48    HG2  LYS   7           HG2      LYS   7  55.686  11.709  -5.544
   49    HG3  LYS   7           HG1      LYS   7  57.043  12.858  -5.445
   50    HD2  LYS   7           HD2      LYS   7  58.604  11.010  -4.976
   51    HD3  LYS   7           HD1      LYS   7  57.256   9.846  -5.011
   52    HE2  LYS   7           HE2      LYS   7  58.550   9.953  -7.173
   53    HE3  LYS   7           HE1      LYS   7  56.821  10.332  -7.357
   54    HZ1  LYS   7           HZ1      LYS   7  59.006  12.337  -7.083
   55    HZ2  LYS   7           HZ2      LYS   7  57.356  12.680  -7.296
   56    HZ3  LYS   7           HZ3      LYS   7  58.236  11.917  -8.534
   57    H    HIS   8           HN       HIS   8  57.176  13.174  -1.478
   58    HA   HIS   8           HA       HIS   8  55.542  12.506   0.839
   59    HB2  HIS   8           HB2      HIS   8  58.305  13.780   0.723
   60    HB3  HIS   8           HB1      HIS   8  57.563  12.968   2.123
   61    HD1  HIS   8           HD1      HIS   8  59.087  12.305  -1.282
   62    HD2  HIS   8           HD2      HIS   8  57.449  10.117   1.911
   63    HE1  HIS   8           HE1      HIS   8  59.693   9.850  -1.650
   64    H    GLY   9           HN       GLY   9  53.845  14.146   0.377
   65    HA2  GLY   9           HA1      GLY   9  54.133  16.362   2.170
   66    HA3  GLY   9           HA2      GLY   9  54.304  16.933   0.499
   67    H    ARG  10           HN       ARG  10  52.499  14.782  -0.507
   68    HA   ARG  10           HA       ARG  10  49.913  15.230   0.771
   69    HB2  ARG  10           HB2      ARG  10  48.915  16.389  -1.246
   70    HB3  ARG  10           HB1      ARG  10  50.028  17.394  -0.286
   71    HG2  ARG  10           HG2      ARG  10  51.838  17.003  -1.865
   72    HG3  ARG  10           HG1      ARG  10  50.853  15.828  -2.768
   73    HD2  ARG  10           HD2      ARG  10  50.928  18.115  -3.834
   74    HD3  ARG  10           HD1      ARG  10  49.284  17.565  -3.434
   75    HE   ARG  10           HE       ARG  10  49.148  19.328  -1.864
   76   HH11  ARG  10          HH11      ARG  10  51.662  18.559  -0.367
   77   HH12  ARG  10          HH12      ARG  10  52.636  19.976  -0.578
   78   HH21  ARG  10          HH21      ARG  10  50.724  21.229  -3.184
   79   HH22  ARG  10          HH22      ARG  10  52.106  21.488  -2.171
   80    H    HIS  11           HN       HIS  11  51.751  13.104  -0.274
   81    HA   HIS  11           HA       HIS  11  49.651  11.500  -1.525
   82    HB2  HIS  11           HB2      HIS  11  50.615  12.748  -3.496
   83    HB3  HIS  11           HB1      HIS  11  52.188  12.004  -3.126
   84    HD1  HIS  11           HD1      HIS  11  48.576  10.684  -3.432
   85    HD2  HIS  11           HD2      HIS  11  52.495   9.697  -4.592
   86    HE1  HIS  11           HE1      HIS  11  48.446   8.536  -4.810
   87    H    ALA  12           HN       ALA  12  49.918   9.455  -1.499
   88    HA   ALA  12           HA       ALA  12  50.637   7.401  -0.815
   89    HB1  ALA  12           HB1      ALA  12  52.920   7.036  -0.438
   90    HB2  ALA  12           HB2      ALA  12  53.099   8.742  -0.029
   91    HB3  ALA  12           HB3      ALA  12  52.835   8.273  -1.710
   92    H    ALA  13           HN       ALA  13  51.486  10.312   0.978
   93    HA   ALA  13           HA       ALA  13  51.334   8.993   3.590
   94    HB1  ALA  13           HB1      ALA  13  50.472  11.361   4.236
   95    HB2  ALA  13           HB2      ALA  13  50.830  11.841   2.560
   96    HB3  ALA  13           HB3      ALA  13  52.145  11.306   3.634
   97    H    LYS  14           HN       LYS  14  50.171   9.045   0.636
   98    HA   LYS  14           HA       LYS  14  47.172   8.710   1.442
   99    HB2  LYS  14           HB2      LYS  14  48.070  10.503  -0.241
  100    HB3  LYS  14           HB1      LYS  14  48.487   9.083  -1.270
  101    HG2  LYS  14           HG2      LYS  14  46.261   8.755  -1.872
  102    HG3  LYS  14           HG1      LYS  14  45.636   9.153  -0.254
  103    HD2  LYS  14           HD2      LYS  14  45.838  11.535  -0.700
  104    HD3  LYS  14           HD1      LYS  14  46.679  11.222  -2.238
  105    HE2  LYS  14           HE2      LYS  14  44.657  10.071  -3.104
  106    HE3  LYS  14           HE1      LYS  14  43.814  10.412  -1.573
  107    HZ1  LYS  14           HZ1      LYS  14  44.407  12.172  -3.794
  108    HZ2  LYS  14           HZ2      LYS  14  44.742  12.841  -2.268
  109    HZ3  LYS  14           HZ3      LYS  14  43.182  12.271  -2.624
  110    H    HIS  15           HN       HIS  15  46.261   7.479  -0.713
  111    HA   HIS  15           HA       HIS  15  45.837   5.242  -1.296
  112    HB2  HIS  15           HB2      HIS  15  47.239   6.325  -3.095
  113    HB3  HIS  15           HB1      HIS  15  48.665   5.554  -2.362
  114    HD1  HIS  15           HD1      HIS  15  45.255   4.623  -3.856
  115    HD2  HIS  15           HD2      HIS  15  49.058   2.947  -3.216
  116    HE1  HIS  15           HE1      HIS  15  45.262   2.310  -4.944
  117    H    ILE  16           HN       ILE  16  47.270   5.637   1.337
  118    HA   ILE  16           HA       ILE  16  47.468   3.122   2.155
  119    HB   ILE  16           HB       ILE  16  49.294   2.419   0.790
  120   HG12  ILE  16          HG12      ILE  16  50.904   3.266   3.219
  121   HG13  ILE  16          HG11      ILE  16  49.526   2.177   3.459
  122   HG21  ILE  16          HG21      ILE  16  50.080   4.578  -0.096
  123   HG22  ILE  16          HG22      ILE  16  51.450   3.817   0.732
  124   HG23  ILE  16          HG23      ILE  16  50.546   5.100   1.535
  125   HD11  ILE  16           HD1      ILE  16  51.570   0.863   3.139
  126   HD12  ILE  16           HD2      ILE  16  51.894   1.688   1.597
  127   HD13  ILE  16           HD3      ILE  16  50.482   0.617   1.755
  128    H    GLY  17           HN       GLY  17  49.067   6.024   2.249
  129    HA2  GLY  17           HA1      GLY  17  49.369   5.981   5.159
  130    HA3  GLY  17           HA2      GLY  17  49.584   7.388   4.102
  131    H    HIS  18           HN       HIS  18  46.942   6.342   2.750
  132    HA   HIS  18           HA       HIS  18  45.156   7.910   4.620
  133    HB2  HIS  18           HB2      HIS  18  45.112   8.493   2.213
  134    HB3  HIS  18           HB1      HIS  18  44.588   6.842   1.823
  135    HD1  HIS  18           HD1      HIS  18  42.448   6.285   3.878
  136    HD2  HIS  18           HD2      HIS  18  42.881  10.069   2.109
  137    HE1  HIS  18           HE1      HIS  18  40.196   7.470   4.067
  138    H    ALA  19           HN       ALA  19  45.427   4.649   3.051
  139    HA   ALA  19           HA       ALA  19  44.028   3.464   5.332
  140    HB1  ALA  19           HB1      ALA  19  42.107   4.564   4.190
  141    HB2  ALA  19           HB2      ALA  19  41.971   2.792   4.243
  142    HB3  ALA  19           HB3      ALA  19  42.472   3.601   2.737
  143    H    ALA  20           HN       ALA  20  46.449   2.839   4.016
  144    HA   ALA  20           HA       ALA  20  47.544   0.978   3.180
  145    HB1  ALA  20           HB1      ALA  20  45.983  -0.105   4.921
  146    HB2  ALA  20           HB2      ALA  20  46.683  -1.161   3.671
  147    HB3  ALA  20           HB3      ALA  20  44.997  -0.615   3.532
  148    H    VAL  21           HN       VAL  21  44.680   2.202   1.716
  149    HA   VAL  21           HA       VAL  21  45.609   1.154  -0.909
  150    HB   VAL  21           HB       VAL  21  42.699   0.846  -0.050
  151   HG11  VAL  21          HG11      VAL  21  43.047   1.177  -2.458
  152   HG12  VAL  21          HG12      VAL  21  42.610  -0.521  -2.146
  153   HG13  VAL  21          HG13      VAL  21  44.304  -0.083  -2.473
  154   HG21  VAL  21          HG21      VAL  21  44.956  -1.199  -0.207
  155   HG22  VAL  21          HG22      VAL  21  43.232  -1.630  -0.128
  156   HG23  VAL  21          HG23      VAL  21  43.996  -0.765   1.227
  157    H    ASN  22           HN       ASN  22  43.449   3.207   1.020
  158    HA   ASN  22           HA       ASN  22  43.864   5.647  -0.094
  159    HB2  ASN  22           HB2      ASN  22  43.443   5.169  -2.366
  160    HB3  ASN  22           HB1      ASN  22  42.126   4.036  -1.987
  161   HD21  ASN  22          HD21      ASN  22  42.847   7.223  -3.026
  162   HD22  ASN  22          HD22      ASN  22  41.250   7.927  -2.752
  163    H    HIS  23           HN       HIS  23  41.111   3.405   0.411
  164    HA   HIS  23           HA       HIS  23  40.227   4.922   2.725
  165    HB2  HIS  23           HB2      HIS  23  39.430   6.425   0.899
  166    HB3  HIS  23           HB1      HIS  23  38.483   5.073   0.232
  167    HD1  HIS  23           HD1      HIS  23  38.477   4.713   3.824
  168    HD2  HIS  23           HD2      HIS  23  36.390   7.164   1.120
  169    HE1  HIS  23           HE1      HIS  23  36.371   5.537   5.013
  170    H    TYR  24           HN       TYR  24  40.203   2.986   3.784
  171    HA   TYR  24           HA       TYR  24  37.797   1.410   3.507
  172    HB2  TYR  24           HB2      TYR  24  39.024   0.464   1.583
  173    HB3  TYR  24           HB1      TYR  24  40.400   0.083   2.646
  174    HD1  TYR  24           HD1      TYR  24  36.735  -0.562   2.136
  175    HD2  TYR  24           HD2      TYR  24  40.414  -1.927   3.936
  176    HE1  TYR  24           HE1      TYR  24  35.627  -2.699   2.782
  177    HE2  TYR  24           HE2      TYR  24  39.305  -4.063   4.580
  178    HH   TYR  24           HH       TYR  24  35.880  -4.688   3.776
  179    H    LEU  25           HN       LEU  25  40.334   2.672   5.138
  180    HA   LEU  25           HA       LEU  25  41.283   2.298   7.230
  181    HB2  LEU  25           HB2      LEU  25  38.674   0.912   7.928
  182    HB3  LEU  25           HB1      LEU  25  39.721   1.900   8.975
  183    HG   LEU  25           HG       LEU  25  38.087   2.888   6.595
  184   HD11  LEU  25          HD11      LEU  25  37.874   3.570   9.557
  185   HD12  LEU  25          HD12      LEU  25  36.867   2.341   8.754
  186   HD13  LEU  25          HD13      LEU  25  36.758   4.047   8.255
  187   HD21  LEU  25          HD21      LEU  25  40.070   4.224   6.632
  188   HD22  LEU  25          HD22      LEU  25  40.122   4.246   8.411
  189   HD23  LEU  25          HD23      LEU  25  38.873   5.170   7.543
  Start of MODEL   30
    1    H1   GLY   1           HT1      GLY   1  65.877  10.872   8.907
    2    H2   GLY   1           HT2      GLY   1  66.298  11.752   7.515
    3    H3   GLY   1           HT3      GLY   1  66.150  10.061   7.444
    4    HA2  GLY   1           HA1      GLY   1  64.216  10.732   6.509
    5    HA3  GLY   1           HA2      GLY   1  63.778  10.436   8.204
    6    H    TRP   2           HN       TRP   2  64.858  12.985   5.940
    7    HA   TRP   2           HA       TRP   2  64.200  15.184   7.659
    8    HB2  TRP   2           HB2      TRP   2  64.247  15.039   4.618
    9    HB3  TRP   2           HB1      TRP   2  64.253  16.531   5.587
   10    HD1  TRP   2           HD1      TRP   2  66.477  17.233   6.754
   11    HE1  TRP   2           HE1      TRP   2  68.938  16.402   6.628
   12    HE3  TRP   2           HE3      TRP   2  65.711  12.814   4.284
   13    HZ2  TRP   2           HZ2      TRP   2  70.350  14.119   5.587
   14    HZ3  TRP   2           HZ3      TRP   2  67.630  11.326   3.735
   15    HH2  TRP   2           HH2      TRP   2  69.946  11.972   4.383
   16    H    GLY   3           HN       GLY   3  62.471  14.394   4.621
   17    HA2  GLY   3           HA1      GLY   3  59.927  13.886   5.638
   18    HA3  GLY   3           HA2      GLY   3  60.049  15.656   5.599
   19    H    SER   4           HN       SER   4  62.069  14.780   3.219
   20    HA   SER   4           HA       SER   4  61.891  14.844   0.908
   21    HB2  SER   4           HB2      SER   4  59.225  13.426   1.239
   22    HB3  SER   4           HB1      SER   4  60.366  13.328  -0.121
   23    HG   SER   4           HG       SER   4  61.433  12.705   2.350
   24    H    ILE   5           HN       ILE   5  60.642  15.700  -0.952
   25    HA   ILE   5           HA       ILE   5  59.447  18.223  -0.240
   26    HB   ILE   5           HB       ILE   5  58.998  18.467  -2.657
   27   HG12  ILE   5          HG12      ILE   5  59.752  15.505  -2.731
   28   HG13  ILE   5          HG11      ILE   5  58.188  16.221  -3.182
   29   HG21  ILE   5          HG21      ILE   5  61.349  18.670  -1.643
   30   HG22  ILE   5          HG22      ILE   5  61.276  18.394  -3.398
   31   HG23  ILE   5          HG23      ILE   5  61.668  17.048  -2.301
   32   HD11  ILE   5           HD1      ILE   5  59.541  17.598  -4.929
   33   HD12  ILE   5           HD2      ILE   5  59.275  15.869  -5.261
   34   HD13  ILE   5           HD3      ILE   5  60.845  16.423  -4.634
   35    H    PHE   6           HN       PHE   6  57.296  18.157  -2.290
   36    HA   PHE   6           HA       PHE   6  55.117  17.554  -0.542
   37    HB2  PHE   6           HB2      PHE   6  55.067  17.758  -3.577
   38    HB3  PHE   6           HB1      PHE   6  53.695  17.982  -2.466
   39    HD1  PHE   6           HD1      PHE   6  53.460  20.009  -1.131
   40    HD2  PHE   6           HD2      PHE   6  56.894  19.426  -3.680
   41    HE1  PHE   6           HE1      PHE   6  54.065  22.410  -0.866
   42    HE2  PHE   6           HE2      PHE   6  57.498  21.828  -3.415
   43    HZ   PHE   6           HZ       PHE   6  56.037  23.337  -2.074
   44    H    LYS   7           HN       LYS   7  57.197  15.402  -1.921
   45    HA   LYS   7           HA       LYS   7  55.458  13.421  -3.033
   46    HB2  LYS   7           HB2      LYS   7  57.979  13.498  -3.224
   47    HB3  LYS   7           HB1      LYS   7  58.058  12.930  -1.538
   48    HG2  LYS   7           HG2      LYS   7  56.775  10.911  -2.134
   49    HG3  LYS   7           HG1      LYS   7  56.633  11.482  -3.815
   50    HD2  LYS   7           HD2      LYS   7  59.098  11.441  -4.045
   51    HD3  LYS   7           HD1      LYS   7  59.246  10.870  -2.365
   52    HE2  LYS   7           HE2      LYS   7  59.386   8.939  -3.841
   53    HE3  LYS   7           HE1      LYS   7  57.828   8.878  -2.983
   54    HZ1  LYS   7           HZ1      LYS   7  57.361   8.459  -5.239
   55    HZ2  LYS   7           HZ2      LYS   7  58.345   9.734  -5.781
   56    HZ3  LYS   7           HZ3      LYS   7  56.884  10.066  -4.978
   57    H    HIS   8           HN       HIS   8  56.748  13.899   0.274
   58    HA   HIS   8           HA       HIS   8  55.158  11.629   1.300
   59    HB2  HIS   8           HB2      HIS   8  57.424  12.166   2.178
   60    HB3  HIS   8           HB1      HIS   8  56.799  13.719   2.782
   61    HD1  HIS   8           HD1      HIS   8  55.240  10.203   2.916
   62    HD2  HIS   8           HD2      HIS   8  56.560  13.243   5.504
   63    HE1  HIS   8           HE1      HIS   8  54.593   9.516   5.290
   64    H    GLY   9           HN       GLY   9  53.149  12.830   0.360
   65    HA2  GLY   9           HA1      GLY   9  51.528  13.634   2.501
   66    HA3  GLY   9           HA2      GLY   9  52.186  15.131   1.816
   67    H    ARG  10           HN       ARG  10  52.316  13.994  -0.918
   68    HA   ARG  10           HA       ARG  10  49.565  14.664  -1.677
   69    HB2  ARG  10           HB2      ARG  10  52.061  13.934  -3.233
   70    HB3  ARG  10           HB1      ARG  10  50.490  14.232  -4.017
   71    HG2  ARG  10           HG2      ARG  10  50.394  16.487  -3.107
   72    HG3  ARG  10           HG1      ARG  10  51.865  16.207  -2.148
   73    HD2  ARG  10           HD2      ARG  10  53.236  16.072  -4.113
   74    HD3  ARG  10           HD1      ARG  10  51.818  15.964  -5.181
   75    HE   ARG  10           HE       ARG  10  52.974  18.415  -4.146
   76   HH11  ARG  10          HH11      ARG  10  51.189  19.928  -3.386
   77   HH12  ARG  10          HH12      ARG  10  49.845  20.027  -4.474
   78   HH21  ARG  10          HH21      ARG  10  50.745  17.197  -6.266
   79   HH22  ARG  10          HH22      ARG  10  49.594  18.482  -6.105
   80    H    HIS  11           HN       HIS  11  50.758  12.451  -3.822
   81    HA   HIS  11           HA       HIS  11  48.695  10.470  -3.075
   82    HB2  HIS  11           HB2      HIS  11  50.509  10.453  -5.510
   83    HB3  HIS  11           HB1      HIS  11  48.963   9.599  -5.288
   84    HD1  HIS  11           HD1      HIS  11  48.481  12.804  -3.778
   85    HD2  HIS  11           HD2      HIS  11  48.658  11.487  -7.768
   86    HE1  HIS  11           HE1      HIS  11  47.298  14.557  -5.212
   87    H    ALA  12           HN       ALA  12  48.988   8.429  -2.746
   88    HA   ALA  12           HA       ALA  12  49.949   6.491  -2.011
   89    HB1  ALA  12           HB1      ALA  12  52.207   6.068  -2.524
   90    HB2  ALA  12           HB2      ALA  12  52.495   7.811  -2.535
   91    HB3  ALA  12           HB3      ALA  12  51.585   7.071  -3.855
   92    H    ALA  13           HN       ALA  13  51.464   9.601  -1.270
   93    HA   ALA  13           HA       ALA  13  52.393   8.762   1.373
   94    HB1  ALA  13           HB1      ALA  13  53.050  11.012   0.410
   95    HB2  ALA  13           HB2      ALA  13  52.111  11.196   1.910
   96    HB3  ALA  13           HB3      ALA  13  51.330  11.456   0.331
   97    H    LYS  14           HN       LYS  14  50.112   8.484  -0.840
   98    HA   LYS  14           HA       LYS  14  47.697   8.490   1.154
   99    HB2  LYS  14           HB2      LYS  14  47.831   9.839  -1.086
  100    HB3  LYS  14           HB1      LYS  14  47.790   8.217  -1.869
  101    HG2  LYS  14           HG2      LYS  14  45.515   7.970  -1.439
  102    HG3  LYS  14           HG1      LYS  14  45.609   8.728   0.167
  103    HD2  LYS  14           HD2      LYS  14  45.640  10.957  -0.843
  104    HD3  LYS  14           HD1      LYS  14  45.702  10.250  -2.476
  105    HE2  LYS  14           HE2      LYS  14  43.503   9.108  -1.992
  106    HE3  LYS  14           HE1      LYS  14  43.428  10.009  -0.458
  107    HZ1  LYS  14           HZ1      LYS  14  44.002  11.657  -2.756
  108    HZ2  LYS  14           HZ2      LYS  14  42.865  11.879  -1.513
  109    HZ3  LYS  14           HZ3      LYS  14  42.492  10.890  -2.842
  110    H    HIS  15           HN       HIS  15  45.997   6.967  -0.115
  111    HA   HIS  15           HA       HIS  15  45.345   4.723  -0.009
  112    HB2  HIS  15           HB2      HIS  15  47.445   4.668  -2.207
  113    HB3  HIS  15           HB1      HIS  15  46.074   3.546  -2.024
  114    HD1  HIS  15           HD1      HIS  15  46.938   6.275  -4.040
  115    HD2  HIS  15           HD2      HIS  15  43.531   5.400  -1.737
  116    HE1  HIS  15           HE1      HIS  15  45.029   7.726  -4.923
  117    H    ILE  16           HN       ILE  16  47.852   5.438   1.595
  118    HA   ILE  16           HA       ILE  16  48.297   3.068   2.764
  119    HB   ILE  16           HB       ILE  16  49.325   2.014   0.899
  120   HG12  ILE  16          HG12      ILE  16  51.673   1.679   1.553
  121   HG13  ILE  16          HG11      ILE  16  51.602   3.100   2.615
  122   HG21  ILE  16          HG21      ILE  16  51.292   3.154  -0.286
  123   HG22  ILE  16          HG22      ILE  16  50.842   4.631   0.571
  124   HG23  ILE  16          HG23      ILE  16  49.713   3.909  -0.590
  125   HD11  ILE  16           HD1      ILE  16  49.710   0.728   2.893
  126   HD12  ILE  16           HD2      ILE  16  49.993   2.037   4.063
  127   HD13  ILE  16           HD3      ILE  16  51.262   0.830   3.755
  128    H    GLY  17           HN       GLY  17  49.833   5.773   1.621
  129    HA2  GLY  17           HA1      GLY  17  51.277   6.233   4.134
  130    HA3  GLY  17           HA2      GLY  17  51.101   7.385   2.796
  131    H    HIS  18           HN       HIS  18  48.123   6.378   2.804
  132    HA   HIS  18           HA       HIS  18  47.214   8.453   4.796
  133    HB2  HIS  18           HB2      HIS  18  46.100   7.221   2.301
  134    HB3  HIS  18           HB1      HIS  18  44.907   7.540   3.575
  135    HD1  HIS  18           HD1      HIS  18  47.907   9.801   3.321
  136    HD2  HIS  18           HD2      HIS  18  43.920   9.750   1.985
  137    HE1  HIS  18           HE1      HIS  18  47.327  12.170   2.560
  138    H    ALA  19           HN       ALA  19  46.655   4.972   3.925
  139    HA   ALA  19           HA       ALA  19  46.590   4.035   6.583
  140    HB1  ALA  19           HB1      ALA  19  43.958   3.761   6.733
  141    HB2  ALA  19           HB2      ALA  19  43.945   5.187   5.671
  142    HB3  ALA  19           HB3      ALA  19  44.716   5.272   7.274
  143    H    ALA  20           HN       ALA  20  46.669   3.593   3.424
  144    HA   ALA  20           HA       ALA  20  46.470   1.737   2.041
  145    HB1  ALA  20           HB1      ALA  20  46.060   0.068   4.543
  146    HB2  ALA  20           HB2      ALA  20  47.654   0.706   4.078
  147    HB3  ALA  20           HB3      ALA  20  46.794  -0.414   2.996
  148    H    VAL  21           HN       VAL  21  44.137   3.133   3.643
  149    HA   VAL  21           HA       VAL  21  41.983   1.580   2.300
  150    HB   VAL  21           HB       VAL  21  41.901   2.330   5.258
  151   HG11  VAL  21          HG11      VAL  21  39.678   2.509   4.441
  152   HG12  VAL  21          HG12      VAL  21  39.745   0.850   5.064
  153   HG13  VAL  21          HG13      VAL  21  39.879   1.146   3.315
  154   HG21  VAL  21          HG21      VAL  21  41.765  -0.193   5.567
  155   HG22  VAL  21          HG22      VAL  21  43.332   0.388   4.967
  156   HG23  VAL  21          HG23      VAL  21  42.174  -0.362   3.842
  157    H    ASN  22           HN       ASN  22  43.576   4.349   3.253
  158    HA   ASN  22           HA       ASN  22  43.148   6.522   2.386
  159    HB2  ASN  22           HB2      ASN  22  40.157   6.025   2.573
  160    HB3  ASN  22           HB1      ASN  22  41.009   7.336   1.732
  161   HD21  ASN  22          HD21      ASN  22  39.170   5.687   0.304
  162   HD22  ASN  22          HD22      ASN  22  40.091   4.702  -0.839
  163    H    HIS  23           HN       HIS  23  41.216   4.978   4.886
  164    HA   HIS  23           HA       HIS  23  42.068   7.014   6.833
  165    HB2  HIS  23           HB2      HIS  23  39.119   6.682   6.143
  166    HB3  HIS  23           HB1      HIS  23  39.760   7.611   7.519
  167    HD1  HIS  23           HD1      HIS  23  39.709   7.567   3.703
  168    HD2  HIS  23           HD2      HIS  23  40.812  10.136   6.844
  169    HE1  HIS  23           HE1      HIS  23  40.169   9.864   2.683
  170    H    TYR  24           HN       TYR  24  40.267   6.479   8.860
  171    HA   TYR  24           HA       TYR  24  39.938   4.931  10.554
  172    HB2  TYR  24           HB2      TYR  24  39.670   2.888   8.319
  173    HB3  TYR  24           HB1      TYR  24  38.952   2.823   9.946
  174    HD1  TYR  24           HD1      TYR  24  38.682   4.235   6.562
  175    HD2  TYR  24           HD2      TYR  24  37.136   4.413  10.588
  176    HE1  TYR  24           HE1      TYR  24  36.689   5.485   5.741
  177    HE2  TYR  24           HE2      TYR  24  35.143   5.664   9.767
  178    HH   TYR  24           HH       TYR  24  34.679   6.324   6.293
  179    H    LEU  25           HN       LEU  25  42.674   5.381   9.419
  180    HA   LEU  25           HA       LEU  25  44.807   4.484   9.638
  181    HB2  LEU  25           HB2      LEU  25  43.296   3.167  11.920
  182    HB3  LEU  25           HB1      LEU  25  45.031   2.868  11.665
  183    HG   LEU  25           HG       LEU  25  45.498   5.280  11.826
  184   HD11  LEU  25          HD11      LEU  25  43.519   6.742  12.673
  185   HD12  LEU  25          HD12      LEU  25  42.467   5.456  12.033
  186   HD13  LEU  25          HD13      LEU  25  43.561   6.341  10.942
  187   HD21  LEU  25          HD21      LEU  25  45.419   3.868  13.891
  188   HD22  LEU  25          HD22      LEU  25  43.712   4.320  14.107
  189   HD23  LEU  25          HD23      LEU  25  44.982   5.563  14.212
  Start of MODEL   31
    1    H1   GLY   1           HT1      GLY   1  65.069  11.020  10.423
    2    H2   GLY   1           HT2      GLY   1  65.088  10.210   8.930
    3    H3   GLY   1           HT3      GLY   1  63.646  10.326   9.821
    4    HA2  GLY   1           HA1      GLY   1  63.281  12.460   9.296
    5    HA3  GLY   1           HA2      GLY   1  65.011  12.772   9.053
    6    H    TRP   2           HN       TRP   2  62.014  12.005   7.592
    7    HA   TRP   2           HA       TRP   2  63.041  10.818   5.155
    8    HB2  TRP   2           HB2      TRP   2  60.432  12.253   5.788
    9    HB3  TRP   2           HB1      TRP   2  60.772  11.421   4.252
   10    HD1  TRP   2           HD1      TRP   2  60.374  10.723   8.017
   11    HE1  TRP   2           HE1      TRP   2  59.782   8.216   8.369
   12    HE3  TRP   2           HE3      TRP   2  60.866   9.091   3.189
   13    HZ2  TRP   2           HZ2      TRP   2  59.561   5.845   6.748
   14    HZ3  TRP   2           HZ3      TRP   2  60.459   6.702   2.616
   15    HH2  TRP   2           HH2      TRP   2  59.809   5.080   4.390
   16    H    GLY   3           HN       GLY   3  61.677  14.083   5.825
   17    HA2  GLY   3           HA1      GLY   3  62.310  16.142   4.959
   18    HA3  GLY   3           HA2      GLY   3  63.778  15.385   4.312
   19    H    SER   4           HN       SER   4  61.089  13.627   3.331
   20    HA   SER   4           HA       SER   4  61.420  14.493   0.577
   21    HB2  SER   4           HB2      SER   4  59.623  12.883   0.103
   22    HB3  SER   4           HB1      SER   4  60.831  12.169   1.194
   23    HG   SER   4           HG       SER   4  58.821  11.760   2.053
   24    H    ILE   5           HN       ILE   5  59.805  15.399  -0.807
   25    HA   ILE   5           HA       ILE   5  58.468  17.663   0.392
   26    HB   ILE   5           HB       ILE   5  57.919  16.455  -2.353
   27   HG12  ILE   5          HG12      ILE   5  60.420  16.947  -1.795
   28   HG13  ILE   5          HG11      ILE   5  59.745  17.657  -3.272
   29   HG21  ILE   5          HG21      ILE   5  57.523  19.212  -1.130
   30   HG22  ILE   5          HG22      ILE   5  56.286  18.113  -1.785
   31   HG23  ILE   5          HG23      ILE   5  57.445  18.903  -2.880
   32   HD11  ILE   5           HD1      ILE   5  61.162  19.230  -1.855
   33   HD12  ILE   5           HD2      ILE   5  59.884  19.169  -0.625
   34   HD13  ILE   5           HD3      ILE   5  59.534  19.827  -2.239
   35    H    PHE   6           HN       PHE   6  57.210  16.618   2.046
   36    HA   PHE   6           HA       PHE   6  55.234  15.763   2.895
   37    HB2  PHE   6           HB2      PHE   6  54.234  16.757   0.196
   38    HB3  PHE   6           HB1      PHE   6  53.167  16.151   1.483
   39    HD1  PHE   6           HD1      PHE   6  53.321  17.250   3.808
   40    HD2  PHE   6           HD2      PHE   6  55.028  19.008   0.253
   41    HE1  PHE   6           HE1      PHE   6  53.393  19.468   4.939
   42    HE2  PHE   6           HE2      PHE   6  55.099  21.227   1.385
   43    HZ   PHE   6           HZ       PHE   6  54.329  21.445   3.746
   44    H    LYS   7           HN       LYS   7  56.941  13.852   1.957
   45    HA   LYS   7           HA       LYS   7  57.003  11.633   1.319
   46    HB2  LYS   7           HB2      LYS   7  53.989  11.739   1.706
   47    HB3  LYS   7           HB1      LYS   7  55.023  10.290   1.736
   48    HG2  LYS   7           HG2      LYS   7  56.306  11.384   3.656
   49    HG3  LYS   7           HG1      LYS   7  55.015  12.612   3.706
   50    HD2  LYS   7           HD2      LYS   7  53.350  10.687   3.928
   51    HD3  LYS   7           HD1      LYS   7  54.749   9.613   4.167
   52    HE2  LYS   7           HE2      LYS   7  53.883  10.323   6.349
   53    HE3  LYS   7           HE1      LYS   7  55.485  11.051   6.079
   54    HZ1  LYS   7           HZ1      LYS   7  53.427  12.477   6.859
   55    HZ2  LYS   7           HZ2      LYS   7  53.127  12.549   5.188
   56    HZ3  LYS   7           HZ3      LYS   7  54.602  13.114   5.814
   57    H    HIS   8           HN       HIS   8  57.597  12.539  -0.820
   58    HA   HIS   8           HA       HIS   8  57.477  12.394  -3.121
   59    HB2  HIS   8           HB2      HIS   8  56.829   9.998  -2.496
   60    HB3  HIS   8           HB1      HIS   8  55.139  10.483  -2.766
   61    HD1  HIS   8           HD1      HIS   8  58.215  11.545  -4.793
   62    HD2  HIS   8           HD2      HIS   8  54.617   9.422  -5.276
   63    HE1  HIS   8           HE1      HIS   8  58.019  10.931  -7.266
   64    H    GLY   9           HN       GLY   9  56.331  14.616  -2.168
   65    HA2  GLY   9           HA1      GLY   9  54.881  16.308  -2.771
   66    HA3  GLY   9           HA2      GLY   9  54.639  15.423  -4.287
   67    H    ARG  10           HN       ARG  10  53.797  14.546  -0.911
   68    HA   ARG  10           HA       ARG  10  51.751  14.121   0.052
   69    HB2  ARG  10           HB2      ARG  10  51.244  16.426  -1.072
   70    HB3  ARG  10           HB1      ARG  10  50.339  15.478  -2.266
   71    HG2  ARG  10           HG2      ARG  10  48.687  16.022  -0.665
   72    HG3  ARG  10           HG1      ARG  10  49.160  14.369  -0.218
   73    HD2  ARG  10           HD2      ARG  10  50.394  15.108   1.671
   74    HD3  ARG  10           HD1      ARG  10  50.511  16.777   1.067
   75    HE   ARG  10           HE       ARG  10  48.453  17.184   2.117
   76   HH11  ARG  10          HH11      ARG  10  49.023  14.386   3.443
   77   HH12  ARG  10          HH12      ARG  10  47.452  13.673   3.285
   78   HH21  ARG  10          HH21      ARG  10  46.319  16.038   1.015
   79   HH22  ARG  10          HH22      ARG  10  45.921  14.609   1.910
   80    H    HIS  11           HN       HIS  11  52.877  12.098  -1.382
   81    HA   HIS  11           HA       HIS  11  50.444  10.619  -2.221
   82    HB2  HIS  11           HB2      HIS  11  52.937  10.818  -3.969
   83    HB3  HIS  11           HB1      HIS  11  51.562   9.724  -4.251
   84    HD1  HIS  11           HD1      HIS  11  52.630  13.334  -4.472
   85    HD2  HIS  11           HD2      HIS  11  49.205  11.010  -5.216
   86    HE1  HIS  11           HE1      HIS  11  50.973  14.805  -5.743
   87    H    ALA  12           HN       ALA  12  50.500   9.549  -0.495
   88    HA   ALA  12           HA       ALA  12  51.269   7.103  -0.026
   89    HB1  ALA  12           HB1      ALA  12  53.482   8.946   0.534
   90    HB2  ALA  12           HB2      ALA  12  53.596   7.507  -0.514
   91    HB3  ALA  12           HB3      ALA  12  53.452   7.336   1.245
   92    H    ALA  13           HN       ALA  13  51.704  10.407   0.963
   93    HA   ALA  13           HA       ALA  13  50.904   9.961   3.766
   94    HB1  ALA  13           HB1      ALA  13  50.389  12.342   1.888
   95    HB2  ALA  13           HB2      ALA  13  51.829  12.209   2.925
   96    HB3  ALA  13           HB3      ALA  13  50.212  12.340   3.657
   97    H    LYS  14           HN       LYS  14  50.475   9.102   0.722
   98    HA   LYS  14           HA       LYS  14  47.369   8.819   0.863
   99    HB2  LYS  14           HB2      LYS  14  48.652  10.112  -0.995
  100    HB3  LYS  14           HB1      LYS  14  49.349   8.505  -1.435
  101    HG2  LYS  14           HG2      LYS  14  47.359   7.836  -2.451
  102    HG3  LYS  14           HG1      LYS  14  46.327   8.612  -1.227
  103    HD2  LYS  14           HD2      LYS  14  46.746  10.818  -2.280
  104    HD3  LYS  14           HD1      LYS  14  47.784  10.038  -3.499
  105    HE2  LYS  14           HE2      LYS  14  44.858   9.318  -3.031
  106    HE3  LYS  14           HE1      LYS  14  45.421  10.445  -4.290
  107    HZ1  LYS  14           HZ1      LYS  14  45.788   7.534  -4.087
  108    HZ2  LYS  14           HZ2      LYS  14  46.996   8.449  -4.855
  109    HZ3  LYS  14           HZ3      LYS  14  45.401   8.485  -5.438
  110    H    HIS  15           HN       HIS  15  47.034   6.977  -0.995
  111    HA   HIS  15           HA       HIS  15  46.732   4.663  -1.007
  112    HB2  HIS  15           HB2      HIS  15  49.710   5.034  -1.477
  113    HB3  HIS  15           HB1      HIS  15  48.797   3.557  -1.867
  114    HD1  HIS  15           HD1      HIS  15  49.720   6.862  -3.195
  115    HD2  HIS  15           HD2      HIS  15  46.694   4.027  -3.883
  116    HE1  HIS  15           HE1      HIS  15  48.594   7.471  -5.406
  117    H    ILE  16           HN       ILE  16  47.505   5.839   1.703
  118    HA   ILE  16           HA       ILE  16  47.422   3.638   3.220
  119    HB   ILE  16           HB       ILE  16  49.524   2.704   2.499
  120   HG12  ILE  16          HG12      ILE  16  50.211   4.229   5.047
  121   HG13  ILE  16          HG11      ILE  16  49.124   2.825   5.015
  122   HG21  ILE  16          HG21      ILE  16  50.540   4.612   1.346
  123   HG22  ILE  16          HG22      ILE  16  51.645   4.165   2.659
  124   HG23  ILE  16          HG23      ILE  16  50.561   5.544   2.855
  125   HD11  ILE  16           HD1      ILE  16  51.151   1.770   5.504
  126   HD12  ILE  16           HD2      ILE  16  52.113   2.937   4.575
  127   HD13  ILE  16           HD3      ILE  16  51.186   1.675   3.730
  128    H    GLY  17           HN       GLY  17  48.818   6.603   2.753
  129    HA2  GLY  17           HA1      GLY  17  48.421   7.382   5.586
  130    HA3  GLY  17           HA2      GLY  17  49.028   8.418   4.280
  131    H    HIS  18           HN       HIS  18  46.820   6.847   2.645
  132    HA   HIS  18           HA       HIS  18  44.654   8.864   3.261
  133    HB2  HIS  18           HB2      HIS  18  45.552   7.347   0.841
  134    HB3  HIS  18           HB1      HIS  18  43.792   7.492   1.009
  135    HD1  HIS  18           HD1      HIS  18  43.743   9.119  -1.062
  136    HD2  HIS  18           HD2      HIS  18  45.971  10.535   2.212
  137    HE1  HIS  18           HE1      HIS  18  44.138  11.616  -1.430
  138    H    ALA  19           HN       ALA  19  45.322   5.324   3.209
  139    HA   ALA  19           HA       ALA  19  42.835   5.004   4.846
  140    HB1  ALA  19           HB1      ALA  19  43.176   3.352   2.329
  141    HB2  ALA  19           HB2      ALA  19  42.181   4.819   2.415
  142    HB3  ALA  19           HB3      ALA  19  41.779   3.418   3.427
  143    H    ALA  20           HN       ALA  20  45.804   4.634   5.139
  144    HA   ALA  20           HA       ALA  20  47.164   3.123   6.249
  145    HB1  ALA  20           HB1      ALA  20  46.186   1.613   7.765
  146    HB2  ALA  20           HB2      ALA  20  44.740   1.386   6.753
  147    HB3  ALA  20           HB3      ALA  20  44.992   2.923   7.614
  148    H    VAL  21           HN       VAL  21  45.279   2.208   3.530
  149    HA   VAL  21           HA       VAL  21  47.287   0.147   2.836
  150    HB   VAL  21           HB       VAL  21  44.309  -0.520   3.010
  151   HG11  VAL  21          HG11      VAL  21  46.702  -2.001   1.840
  152   HG12  VAL  21          HG12      VAL  21  45.183  -1.561   1.025
  153   HG13  VAL  21          HG13      VAL  21  45.186  -2.825   2.273
  154   HG21  VAL  21          HG21      VAL  21  46.773  -1.471   4.536
  155   HG22  VAL  21          HG22      VAL  21  45.232  -2.360   4.544
  156   HG23  VAL  21          HG23      VAL  21  45.305  -0.713   5.199
  157    H    ASN  22           HN       ASN  22  44.675   2.375   1.996
  158    HA   ASN  22           HA       ASN  22  45.722   2.586  -0.697
  159    HB2  ASN  22           HB2      ASN  22  44.602   0.445  -1.014
  160    HB3  ASN  22           HB1      ASN  22  43.086   1.108  -0.367
  161   HD21  ASN  22          HD21      ASN  22  41.859   0.882  -2.337
  162   HD22  ASN  22          HD22      ASN  22  42.238   1.832  -3.777
  163    H    HIS  23           HN       HIS  23  42.257   2.685  -0.332
  164    HA   HIS  23           HA       HIS  23  42.248   5.624   0.227
  165    HB2  HIS  23           HB2      HIS  23  40.960   4.369  -2.226
  166    HB3  HIS  23           HB1      HIS  23  40.868   6.079  -1.737
  167    HD1  HIS  23           HD1      HIS  23  42.512   4.185  -4.163
  168    HD2  HIS  23           HD2      HIS  23  43.895   6.938  -1.300
  169    HE1  HIS  23           HE1      HIS  23  44.800   5.012  -4.944
  170    H    TYR  24           HN       TYR  24  40.677   6.115   1.598
  171    HA   TYR  24           HA       TYR  24  38.716   4.079   2.354
  172    HB2  TYR  24           HB2      TYR  24  39.700   5.709   3.978
  173    HB3  TYR  24           HB1      TYR  24  38.870   7.027   3.118
  174    HD1  TYR  24           HD1      TYR  24  36.458   7.324   3.284
  175    HD2  TYR  24           HD2      TYR  24  38.406   3.988   5.208
  176    HE1  TYR  24           HE1      TYR  24  34.380   6.858   4.580
  177    HE2  TYR  24           HE2      TYR  24  36.330   3.522   6.503
  178    HH   TYR  24           HH       TYR  24  34.135   4.992   7.193
  179    H    LEU  25           HN       LEU  25  39.020   6.165  -0.207
  180    HA   LEU  25           HA       LEU  25  36.255   5.752  -1.021
  181    HB2  LEU  25           HB2      LEU  25  35.923   8.374  -1.262
  182    HB3  LEU  25           HB1      LEU  25  35.555   7.569   0.281
  183    HG   LEU  25           HG       LEU  25  37.739   8.197   1.188
  184   HD11  LEU  25          HD11      LEU  25  38.206   9.243  -1.633
  185   HD12  LEU  25          HD12      LEU  25  39.209   8.111  -0.692
  186   HD13  LEU  25          HD13      LEU  25  39.150   9.829  -0.241
  187   HD21  LEU  25          HD21      LEU  25  37.429  10.643   1.239
  188   HD22  LEU  25          HD22      LEU  25  35.854   9.819   1.330
  189   HD23  LEU  25          HD23      LEU  25  36.387  10.555  -0.200
  Start of MODEL   32
    1    H1   GLY   1           HT1      GLY   1  65.194   9.821 -11.507
    2    H2   GLY   1           HT2      GLY   1  63.577   9.630 -11.997
    3    H3   GLY   1           HT3      GLY   1  64.084   9.056 -10.480
    4    HA2  GLY   1           HA1      GLY   1  63.905  11.857 -11.364
    5    HA3  GLY   1           HA2      GLY   1  62.862  11.039 -10.184
    6    H    TRP   2           HN       TRP   2  63.494  10.817  -8.092
    7    HA   TRP   2           HA       TRP   2  66.287  11.301  -7.307
    8    HB2  TRP   2           HB2      TRP   2  64.106  13.321  -6.649
    9    HB3  TRP   2           HB1      TRP   2  65.684  13.245  -5.829
   10    HD1  TRP   2           HD1      TRP   2  64.023  14.813  -8.698
   11    HE1  TRP   2           HE1      TRP   2  65.733  15.860 -10.354
   12    HE3  TRP   2           HE3      TRP   2  68.301  12.627  -6.929
   13    HZ2  TRP   2           HZ2      TRP   2  68.571  15.742 -10.821
   14    HZ3  TRP   2           HZ3      TRP   2  70.499  13.110  -7.995
   15    HH2  TRP   2           HH2      TRP   2  70.639  14.663  -9.937
   16    H    GLY   3           HN       GLY   3  63.346  12.103  -5.482
   17    HA2  GLY   3           HA1      GLY   3  62.835   9.597  -4.308
   18    HA3  GLY   3           HA2      GLY   3  64.086  10.369  -3.313
   19    H    SER   4           HN       SER   4  62.289  12.767  -4.780
   20    HA   SER   4           HA       SER   4  60.782  14.295  -3.908
   21    HB2  SER   4           HB2      SER   4  59.320  12.222  -4.334
   22    HB3  SER   4           HB1      SER   4  59.405  11.935  -2.581
   23    HG   SER   4           HG       SER   4  57.761  13.280  -2.622
   24    H    ILE   5           HN       ILE   5  59.576  14.973  -1.784
   25    HA   ILE   5           HA       ILE   5  61.136  14.241   0.652
   26    HB   ILE   5           HB       ILE   5  60.808  17.166  -0.148
   27   HG12  ILE   5          HG12      ILE   5  63.189  15.297  -0.551
   28   HG13  ILE   5          HG11      ILE   5  62.266  16.136  -1.819
   29   HG21  ILE   5          HG21      ILE   5  62.295  17.588   1.684
   30   HG22  ILE   5          HG22      ILE   5  62.738  15.870   1.820
   31   HG23  ILE   5          HG23      ILE   5  61.112  16.411   2.297
   32   HD11  ILE   5           HD1      ILE   5  64.152  17.323   0.244
   33   HD12  ILE   5           HD2      ILE   5  62.943  18.329  -0.591
   34   HD13  ILE   5           HD3      ILE   5  64.199  17.483  -1.526
   35    H    PHE   6           HN       PHE   6  58.541  16.153  -0.878
   36    HA   PHE   6           HA       PHE   6  57.103  16.454   1.680
   37    HB2  PHE   6           HB2      PHE   6  56.411  17.143  -1.202
   38    HB3  PHE   6           HB1      PHE   6  55.339  17.467   0.181
   39    HD1  PHE   6           HD1      PHE   6  55.942  19.131   1.890
   40    HD2  PHE   6           HD2      PHE   6  58.509  18.377  -1.496
   41    HE1  PHE   6           HE1      PHE   6  57.201  21.224   2.379
   42    HE2  PHE   6           HE2      PHE   6  59.768  20.472  -1.008
   43    HZ   PHE   6           HZ       PHE   6  59.081  21.920   0.900
   44    H    LYS   7           HN       LYS   7  57.480  13.814   1.482
   45    HA   LYS   7           HA       LYS   7  56.354  11.785   1.439
   46    HB2  LYS   7           HB2      LYS   7  53.812  13.441   1.299
   47    HB3  LYS   7           HB1      LYS   7  54.008  11.797   1.951
   48    HG2  LYS   7           HG2      LYS   7  55.534  12.687   3.705
   49    HG3  LYS   7           HG1      LYS   7  55.284  14.331   3.070
   50    HD2  LYS   7           HD2      LYS   7  52.835  14.098   3.493
   51    HD3  LYS   7           HD1      LYS   7  53.130  12.490   4.197
   52    HE2  LYS   7           HE2      LYS   7  54.226  15.149   5.211
   53    HE3  LYS   7           HE1      LYS   7  52.994  14.135   6.000
   54    HZ1  LYS   7           HZ1      LYS   7  55.888  13.653   5.693
   55    HZ2  LYS   7           HZ2      LYS   7  54.830  12.334   5.853
   56    HZ3  LYS   7           HZ3      LYS   7  54.915  13.510   7.075
   57    H    HIS   8           HN       HIS   8  57.363  11.784  -0.821
   58    HA   HIS   8           HA       HIS   8  57.160  11.357  -3.096
   59    HB2  HIS   8           HB2      HIS   8  55.986   9.383  -1.995
   60    HB3  HIS   8           HB1      HIS   8  54.448  10.207  -2.344
   61    HD1  HIS   8           HD1      HIS   8  53.526  10.058  -4.701
   62    HD2  HIS   8           HD2      HIS   8  57.476   8.643  -4.395
   63    HE1  HIS   8           HE1      HIS   8  54.134   9.005  -6.948
   64    H    GLY   9           HN       GLY   9  55.725  13.820  -1.820
   65    HA2  GLY   9           HA1      GLY   9  54.886  15.710  -2.928
   66    HA3  GLY   9           HA2      GLY   9  54.587  14.741  -4.382
   67    H    ARG  10           HN       ARG  10  53.482  14.659  -0.955
   68    HA   ARG  10           HA       ARG  10  51.361  14.483  -0.071
   69    HB2  ARG  10           HB2      ARG  10  50.771  16.103  -2.575
   70    HB3  ARG  10           HB1      ARG  10  49.509  15.688  -1.395
   71    HG2  ARG  10           HG2      ARG  10  50.520  17.930  -0.961
   72    HG3  ARG  10           HG1      ARG  10  50.757  16.803   0.395
   73    HD2  ARG  10           HD2      ARG  10  53.050  16.495  -0.105
   74    HD3  ARG  10           HD1      ARG  10  52.867  17.082  -1.776
   75    HE   ARG  10           HE       ARG  10  53.329  19.217  -0.913
   76   HH11  ARG  10          HH11      ARG  10  51.451  20.505   0.338
   77   HH12  ARG  10          HH12      ARG  10  51.614  20.300   2.050
   78   HH21  ARG  10          HH21      ARG  10  53.696  17.538   1.788
   79   HH22  ARG  10          HH22      ARG  10  52.884  18.618   2.872
   80    H    HIS  11           HN       HIS  11  52.364  12.270  -1.535
   81    HA   HIS  11           HA       HIS  11  49.774  10.956  -2.065
   82    HB2  HIS  11           HB2      HIS  11  51.967  11.222  -4.154
   83    HB3  HIS  11           HB1      HIS  11  50.825   9.858  -4.179
   84    HD1  HIS  11           HD1      HIS  11  50.608  13.701  -3.886
   85    HD2  HIS  11           HD2      HIS  11  48.598  10.465  -5.666
   86    HE1  HIS  11           HE1      HIS  11  48.665  14.664  -5.239
   87    H    ALA  12           HN       ALA  12  50.346  10.321  -0.055
   88    HA   ALA  12           HA       ALA  12  51.175   7.640   0.076
   89    HB1  ALA  12           HB1      ALA  12  52.985   9.807   0.911
   90    HB2  ALA  12           HB2      ALA  12  53.406   8.593  -0.321
   91    HB3  ALA  12           HB3      ALA  12  53.284   8.132   1.393
   92    H    ALA  13           HN       ALA  13  51.085  10.902   1.315
   93    HA   ALA  13           HA       ALA  13  50.282  10.153   4.047
   94    HB1  ALA  13           HB1      ALA  13  49.294  12.407   4.106
   95    HB2  ALA  13           HB2      ALA  13  49.406  12.551   2.336
   96    HB3  ALA  13           HB3      ALA  13  50.885  12.566   3.326
   97    H    LYS  14           HN       LYS  14  50.016   9.527   0.913
   98    HA   LYS  14           HA       LYS  14  46.995   8.769   0.944
   99    HB2  LYS  14           HB2      LYS  14  48.161  10.339  -0.764
  100    HB3  LYS  14           HB1      LYS  14  49.083   8.857  -1.263
  101    HG2  LYS  14           HG2      LYS  14  47.234   8.012  -2.412
  102    HG3  LYS  14           HG1      LYS  14  46.064   8.567  -1.191
  103    HD2  LYS  14           HD2      LYS  14  46.076  10.811  -2.102
  104    HD3  LYS  14           HD1      LYS  14  47.441  10.425  -3.178
  105    HE2  LYS  14           HE2      LYS  14  44.707   9.078  -3.291
  106    HE3  LYS  14           HE1      LYS  14  45.235  10.395  -4.366
  107    HZ1  LYS  14           HZ1      LYS  14  45.840   8.604  -5.607
  108    HZ2  LYS  14           HZ2      LYS  14  46.108   7.597  -4.265
  109    HZ3  LYS  14           HZ3      LYS  14  47.261   8.766  -4.696
  110    H    HIS  15           HN       HIS  15  46.981   7.014  -1.034
  111    HA   HIS  15           HA       HIS  15  47.029   4.679  -1.214
  112    HB2  HIS  15           HB2      HIS  15  48.782   5.625  -2.727
  113    HB3  HIS  15           HB1      HIS  15  49.985   5.348  -1.446
  114    HD1  HIS  15           HD1      HIS  15  47.219   3.258  -3.142
  115    HD2  HIS  15           HD2      HIS  15  51.164   2.878  -1.732
  116    HE1  HIS  15           HE1      HIS  15  47.990   0.879  -3.667
  117    H    ILE  16           HN       ILE  16  47.603   5.809   1.588
  118    HA   ILE  16           HA       ILE  16  47.733   3.515   2.959
  119    HB   ILE  16           HB       ILE  16  49.948   2.901   2.303
  120   HG12  ILE  16          HG12      ILE  16  50.386   4.357   4.937
  121   HG13  ILE  16          HG11      ILE  16  49.396   2.886   4.825
  122   HG21  ILE  16          HG21      ILE  16  50.679   5.802   2.914
  123   HG22  ILE  16          HG22      ILE  16  50.705   5.046   1.309
  124   HG23  ILE  16          HG23      ILE  16  51.869   4.548   2.551
  125   HD11  ILE  16           HD1      ILE  16  51.516   2.028   5.390
  126   HD12  ILE  16           HD2      ILE  16  52.381   3.211   4.388
  127   HD13  ILE  16           HD3      ILE  16  51.516   1.859   3.621
  128    H    GLY  17           HN       GLY  17  48.941   6.599   2.847
  129    HA2  GLY  17           HA1      GLY  17  48.325   7.149   5.662
  130    HA3  GLY  17           HA2      GLY  17  48.786   8.344   4.434
  131    H    HIS  18           HN       HIS  18  46.776   6.675   2.654
  132    HA   HIS  18           HA       HIS  18  44.398   8.359   3.411
  133    HB2  HIS  18           HB2      HIS  18  45.437   7.023   0.947
  134    HB3  HIS  18           HB1      HIS  18  43.684   6.881   1.151
  135    HD1  HIS  18           HD1      HIS  18  43.333   8.495  -0.902
  136    HD2  HIS  18           HD2      HIS  18  45.399  10.221   2.328
  137    HE1  HIS  18           HE1      HIS  18  43.317  11.027  -1.250
  138    H    ALA  19           HN       ALA  19  45.439   4.967   2.957
  139    HA   ALA  19           HA       ALA  19  44.184   3.717   5.021
  140    HB1  ALA  19           HB1      ALA  19  42.107   4.459   2.959
  141    HB2  ALA  19           HB2      ALA  19  41.964   4.407   4.732
  142    HB3  ALA  19           HB3      ALA  19  41.956   2.896   3.796
  143    H    ALA  20           HN       ALA  20  45.884   3.779   2.372
  144    HA   ALA  20           HA       ALA  20  46.907   2.173   1.059
  145    HB1  ALA  20           HB1      ALA  20  45.664   0.051   2.834
  146    HB2  ALA  20           HB2      ALA  20  47.044   1.041   3.364
  147    HB3  ALA  20           HB3      ALA  20  47.199  -0.010   1.937
  148    H    VAL  21           HN       VAL  21  43.778   2.806   1.164
  149    HA   VAL  21           HA       VAL  21  43.192   1.086  -1.205
  150    HB   VAL  21           HB       VAL  21  41.280   1.348   1.163
  151   HG11  VAL  21          HG11      VAL  21  40.094  -0.517  -0.202
  152   HG12  VAL  21          HG12      VAL  21  41.132  -0.012  -1.557
  153   HG13  VAL  21          HG13      VAL  21  39.988   1.141  -0.832
  154   HG21  VAL  21          HG21      VAL  21  41.698  -1.137   1.391
  155   HG22  VAL  21          HG22      VAL  21  43.123  -0.140   1.758
  156   HG23  VAL  21          HG23      VAL  21  43.004  -0.978   0.193
  157    H    ASN  22           HN       ASN  22  43.124   4.007   0.515
  158    HA   ASN  22           HA       ASN  22  42.729   6.044  -0.838
  159    HB2  ASN  22           HB2      ASN  22  41.451   4.964  -2.674
  160    HB3  ASN  22           HB1      ASN  22  40.063   4.760  -1.570
  161   HD21  ASN  22          HD21      ASN  22  38.592   6.231  -2.540
  162   HD22  ASN  22          HD22      ASN  22  38.930   7.960  -2.674
  163    H    HIS  23           HN       HIS  23  40.189   4.213   0.901
  164    HA   HIS  23           HA       HIS  23  40.235   6.055   3.119
  165    HB2  HIS  23           HB2      HIS  23  39.044   7.467   1.377
  166    HB3  HIS  23           HB1      HIS  23  37.746   6.251   1.379
  167    HD1  HIS  23           HD1      HIS  23  39.667   7.330   4.486
  168    HD2  HIS  23           HD2      HIS  23  35.832   7.728   2.806
  169    HE1  HIS  23           HE1      HIS  23  38.175   8.429   6.245
  170    H    TYR  24           HN       TYR  24  39.316   3.255   1.484
  171    HA   TYR  24           HA       TYR  24  37.151   2.423   3.260
  172    HB2  TYR  24           HB2      TYR  24  38.910   0.913   1.292
  173    HB3  TYR  24           HB1      TYR  24  37.555   0.179   2.184
  174    HD1  TYR  24           HD1      TYR  24  38.427   2.996  -0.145
  175    HD2  TYR  24           HD2      TYR  24  35.317   0.429   1.397
  176    HE1  TYR  24           HE1      TYR  24  36.838   3.902  -1.838
  177    HE2  TYR  24           HE2      TYR  24  33.730   1.335  -0.297
  178    HH   TYR  24           HH       TYR  24  34.231   2.556  -2.834
  179    H    LEU  25           HN       LEU  25  39.586   3.337   4.608
  180    HA   LEU  25           HA       LEU  25  40.977   2.676   6.338
  181    HB2  LEU  25           HB2      LEU  25  38.549   1.884   7.026
  182    HB3  LEU  25           HB1      LEU  25  39.208   0.252   6.783
  183    HG   LEU  25           HG       LEU  25  40.337   2.397   8.641
  184   HD11  LEU  25          HD11      LEU  25  38.192   1.246   9.339
  185   HD12  LEU  25          HD12      LEU  25  39.563   0.961  10.438
  186   HD13  LEU  25          HD13      LEU  25  39.070  -0.299   9.282
  187   HD21  LEU  25          HD21      LEU  25  41.297  -0.382   7.850
  188   HD22  LEU  25          HD22      LEU  25  41.740   0.337   9.417
  189   HD23  LEU  25          HD23      LEU  25  42.219   1.139   7.906
  Start of MODEL   33
    1    H1   GLY   1           HT1      GLY   1  67.294  24.876  -2.234
    2    H2   GLY   1           HT2      GLY   1  67.145  24.906  -0.542
    3    H3   GLY   1           HT3      GLY   1  65.820  24.458  -1.508
    4    HA2  GLY   1           HA1      GLY   1  67.702  22.743  -2.313
    5    HA3  GLY   1           HA2      GLY   1  68.047  22.928  -0.581
    6    H    TRP   2           HN       TRP   2  66.275  21.247  -2.863
    7    HA   TRP   2           HA       TRP   2  64.826  19.788  -0.822
    8    HB2  TRP   2           HB2      TRP   2  62.525  20.329  -1.756
    9    HB3  TRP   2           HB1      TRP   2  63.287  21.632  -0.813
   10    HD1  TRP   2           HD1      TRP   2  62.952  20.533  -4.517
   11    HE1  TRP   2           HE1      TRP   2  62.883  22.653  -6.022
   12    HE3  TRP   2           HE3      TRP   2  63.638  24.104  -0.913
   13    HZ2  TRP   2           HZ2      TRP   2  63.101  25.504  -5.674
   14    HZ3  TRP   2           HZ3      TRP   2  63.704  26.517  -1.522
   15    HH2  TRP   2           HH2      TRP   2  63.438  27.220  -3.897
   16    H    GLY   3           HN       GLY   3  62.908  18.511  -2.170
   17    HA2  GLY   3           HA1      GLY   3  63.697  17.830  -4.888
   18    HA3  GLY   3           HA2      GLY   3  64.210  16.605  -3.711
   19    H    SER   4           HN       SER   4  61.306  18.605  -3.429
   20    HA   SER   4           HA       SER   4  59.534  16.534  -4.489
   21    HB2  SER   4           HB2      SER   4  59.475  17.033  -1.490
   22    HB3  SER   4           HB1      SER   4  58.445  15.920  -2.418
   23    HG   SER   4           HG       SER   4  61.270  15.791  -2.053
   24    H    ILE   5           HN       ILE   5  58.139  17.781  -5.539
   25    HA   ILE   5           HA       ILE   5  57.596  20.510  -4.710
   26    HB   ILE   5           HB       ILE   5  55.867  18.905  -6.637
   27   HG12  ILE   5          HG12      ILE   5  58.608  20.153  -7.142
   28   HG13  ILE   5          HG11      ILE   5  58.199  18.425  -7.238
   29   HG21  ILE   5          HG21      ILE   5  55.376  21.345  -5.888
   30   HG22  ILE   5          HG22      ILE   5  55.428  21.023  -7.636
   31   HG23  ILE   5          HG23      ILE   5  56.818  21.792  -6.830
   32   HD11  ILE   5           HD1      ILE   5  58.151  19.189  -9.496
   33   HD12  ILE   5           HD2      ILE   5  57.287  20.681  -9.059
   34   HD13  ILE   5           HD3      ILE   5  56.442  19.115  -9.010
   35    H    PHE   6           HN       PHE   6  55.716  17.456  -4.673
   36    HA   PHE   6           HA       PHE   6  54.284  18.341  -2.269
   37    HB2  PHE   6           HB2      PHE   6  52.826  18.073  -4.928
   38    HB3  PHE   6           HB1      PHE   6  52.012  18.046  -3.347
   39    HD1  PHE   6           HD1      PHE   6  52.739  20.037  -1.696
   40    HD2  PHE   6           HD2      PHE   6  53.033  20.168  -6.003
   41    HE1  PHE   6           HE1      PHE   6  52.750  22.526  -1.622
   42    HE2  PHE   6           HE2      PHE   6  53.044  22.657  -5.925
   43    HZ   PHE   6           HZ       PHE   6  52.939  23.836  -3.732
   44    H    LYS   7           HN       LYS   7  55.479  16.054  -4.450
   45    HA   LYS   7           HA       LYS   7  53.848  13.799  -4.128
   46    HB2  LYS   7           HB2      LYS   7  55.966  13.995  -5.509
   47    HB3  LYS   7           HB1      LYS   7  56.886  13.751  -4.006
   48    HG2  LYS   7           HG2      LYS   7  55.693  11.596  -3.640
   49    HG3  LYS   7           HG1      LYS   7  54.821  11.833  -5.175
   50    HD2  LYS   7           HD2      LYS   7  57.001  11.900  -6.382
   51    HD3  LYS   7           HD1      LYS   7  57.844  11.591  -4.845
   52    HE2  LYS   7           HE2      LYS   7  56.573   9.460  -4.600
   53    HE3  LYS   7           HE1      LYS   7  55.798   9.759  -6.173
   54    HZ1  LYS   7           HZ1      LYS   7  58.165   8.462  -5.769
   55    HZ2  LYS   7           HZ2      LYS   7  58.654  10.006  -6.279
   56    HZ3  LYS   7           HZ3      LYS   7  57.609   9.080  -7.248
   57    H    HIS   8           HN       HIS   8  56.863  14.181  -2.225
   58    HA   HIS   8           HA       HIS   8  55.824  12.440  -0.133
   59    HB2  HIS   8           HB2      HIS   8  58.289  14.221  -0.264
   60    HB3  HIS   8           HB1      HIS   8  57.944  13.063   1.043
   61    HD1  HIS   8           HD1      HIS   8  57.068  10.562  -0.254
   62    HD2  HIS   8           HD2      HIS   8  59.971  13.003  -2.071
   63    HE1  HIS   8           HE1      HIS   8  58.412   9.088  -1.851
   64    H    GLY   9           HN       GLY   9  53.812  13.839   0.086
   65    HA2  GLY   9           HA1      GLY   9  53.835  15.129   2.588
   66    HA3  GLY   9           HA2      GLY   9  54.015  16.406   1.368
   67    H    ARG  10           HN       ARG  10  52.450  14.358  -0.435
   68    HA   ARG  10           HA       ARG  10  49.721  14.678   0.723
   69    HB2  ARG  10           HB2      ARG  10  50.614  15.906  -1.917
   70    HB3  ARG  10           HB1      ARG  10  48.915  15.701  -1.428
   71    HG2  ARG  10           HG2      ARG  10  49.436  17.034   0.660
   72    HG3  ARG  10           HG1      ARG  10  51.046  17.367  -0.024
   73    HD2  ARG  10           HD2      ARG  10  49.902  18.317  -2.068
   74    HD3  ARG  10           HD1      ARG  10  48.349  18.138  -1.216
   75    HE   ARG  10           HE       ARG  10  50.006  19.584   0.530
   76   HH11  ARG  10          HH11      ARG  10  48.675  21.599   0.650
   77   HH12  ARG  10          HH12      ARG  10  48.688  22.569  -0.785
   78   HH21  ARG  10          HH21      ARG  10  50.076  20.087  -2.770
   79   HH22  ARG  10          HH22      ARG  10  49.479  21.714  -2.721
   80    H    HIS  11           HN       HIS  11  51.814  12.596  -0.193
   81    HA   HIS  11           HA       HIS  11  49.809  10.842  -1.482
   82    HB2  HIS  11           HB2      HIS  11  50.959  11.923  -3.418
   83    HB3  HIS  11           HB1      HIS  11  52.519  11.351  -2.778
   84    HD1  HIS  11           HD1      HIS  11  52.912   8.727  -2.696
   85    HD2  HIS  11           HD2      HIS  11  49.511   9.985  -4.823
   86    HE1  HIS  11           HE1      HIS  11  52.084   6.731  -4.059
   87    H    ALA  12           HN       ALA  12  50.073   8.803  -1.258
   88    HA   ALA  12           HA       ALA  12  50.726   6.810  -0.338
   89    HB1  ALA  12           HB1      ALA  12  53.058   8.252   0.641
   90    HB2  ALA  12           HB2      ALA  12  53.006   7.668  -1.025
   91    HB3  ALA  12           HB3      ALA  12  52.953   6.528   0.342
   92    H    ALA  13           HN       ALA  13  51.324   9.867   1.314
   93    HA   ALA  13           HA       ALA  13  50.867   8.747   3.984
   94    HB1  ALA  13           HB1      ALA  13  51.695  11.165   3.546
   95    HB2  ALA  13           HB2      ALA  13  50.241  11.052   4.568
   96    HB3  ALA  13           HB3      ALA  13  50.091  11.496   2.850
   97    H    LYS  14           HN       LYS  14  50.070   8.569   0.911
   98    HA   LYS  14           HA       LYS  14  46.993   8.244   1.370
   99    HB2  LYS  14           HB2      LYS  14  48.081   9.895  -0.349
  100    HB3  LYS  14           HB1      LYS  14  48.626   8.399  -1.190
  101    HG2  LYS  14           HG2      LYS  14  46.499   7.997  -2.041
  102    HG3  LYS  14           HG1      LYS  14  45.681   8.448  -0.531
  103    HD2  LYS  14           HD2      LYS  14  45.004  10.030  -2.216
  104    HD3  LYS  14           HD1      LYS  14  46.124  10.886  -1.133
  105    HE2  LYS  14           HE2      LYS  14  47.979  10.179  -2.822
  106    HE3  LYS  14           HE1      LYS  14  46.635   9.817  -3.930
  107    HZ1  LYS  14           HZ1      LYS  14  47.404  12.069  -4.245
  108    HZ2  LYS  14           HZ2      LYS  14  47.172  12.428  -2.601
  109    HZ3  LYS  14           HZ3      LYS  14  45.837  12.094  -3.598
  110    H    HIS  15           HN       HIS  15  46.375   6.792  -0.761
  111    HA   HIS  15           HA       HIS  15  46.054   4.512  -1.196
  112    HB2  HIS  15           HB2      HIS  15  48.950   5.041  -1.954
  113    HB3  HIS  15           HB1      HIS  15  48.018   3.620  -2.481
  114    HD1  HIS  15           HD1      HIS  15  48.990   6.797  -3.712
  115    HD2  HIS  15           HD2      HIS  15  45.304   4.773  -3.603
  116    HE1  HIS  15           HE1      HIS  15  47.504   7.824  -5.520
  117    H    ILE  16           HN       ILE  16  47.272   5.182   1.558
  118    HA   ILE  16           HA       ILE  16  47.318   2.706   2.600
  119    HB   ILE  16           HB       ILE  16  49.285   1.958   1.500
  120   HG12  ILE  16          HG12      ILE  16  50.344   3.037   4.143
  121   HG13  ILE  16          HG11      ILE  16  49.208   1.675   4.055
  122   HG21  ILE  16          HG21      ILE  16  50.131   4.072   0.575
  123   HG22  ILE  16          HG22      ILE  16  51.416   3.383   1.585
  124   HG23  ILE  16          HG23      ILE  16  50.417   4.696   2.210
  125   HD11  ILE  16           HD1      ILE  16  52.099   1.812   3.157
  126   HD12  ILE  16           HD2      ILE  16  50.997   0.671   2.352
  127   HD13  ILE  16           HD3      ILE  16  51.274   0.557   4.103
  128    H    GLY  17           HN       GLY  17  48.847   5.645   2.644
  129    HA2  GLY  17           HA1      GLY  17  48.750   5.860   5.574
  130    HA3  GLY  17           HA2      GLY  17  49.152   7.162   4.435
  131    H    HIS  18           HN       HIS  18  46.750   5.963   2.818
  132    HA   HIS  18           HA       HIS  18  44.698   7.729   4.134
  133    HB2  HIS  18           HB2      HIS  18  45.226   6.694   1.378
  134    HB3  HIS  18           HB1      HIS  18  43.510   6.719   1.825
  135    HD1  HIS  18           HD1      HIS  18  45.925   9.289   3.215
  136    HD2  HIS  18           HD2      HIS  18  42.905   9.022   0.300
  137    HE1  HIS  18           HE1      HIS  18  45.435  11.663   2.405
  138    H    ALA  19           HN       ALA  19  45.131   4.331   2.965
  139    HA   ALA  19           HA       ALA  19  43.885   3.063   5.123
  140    HB1  ALA  19           HB1      ALA  19  41.871   4.161   3.150
  141    HB2  ALA  19           HB2      ALA  19  41.766   4.053   4.925
  142    HB3  ALA  19           HB3      ALA  19  41.551   2.597   3.935
  143    H    ALA  20           HN       ALA  20  45.509   3.069   2.388
  144    HA   ALA  20           HA       ALA  20  46.230   1.419   0.922
  145    HB1  ALA  20           HB1      ALA  20  46.328  -0.820   1.710
  146    HB2  ALA  20           HB2      ALA  20  44.892  -0.609   2.741
  147    HB3  ALA  20           HB3      ALA  20  46.423   0.190   3.170
  148    H    VAL  21           HN       VAL  21  43.259   2.419   1.293
  149    HA   VAL  21           HA       VAL  21  42.215   0.874  -1.038
  150    HB   VAL  21           HB       VAL  21  40.653   1.352   1.547
  151   HG11  VAL  21          HG11      VAL  21  39.082   1.566  -0.221
  152   HG12  VAL  21          HG12      VAL  21  38.957  -0.146   0.236
  153   HG13  VAL  21          HG13      VAL  21  39.883   0.322  -1.211
  154   HG21  VAL  21          HG21      VAL  21  40.576  -1.156   1.619
  155   HG22  VAL  21          HG22      VAL  21  42.231  -0.521   1.760
  156   HG23  VAL  21          HG23      VAL  21  41.669  -1.202   0.214
  157    H    ASN  22           HN       ASN  22  42.839   3.677   0.703
  158    HA   ASN  22           HA       ASN  22  42.695   5.868  -0.240
  159    HB2  ASN  22           HB2      ASN  22  41.547   4.881  -2.343
  160    HB3  ASN  22           HB1      ASN  22  40.011   5.181  -1.489
  161   HD21  ASN  22          HD21      ASN  22  41.167   6.535  -3.968
  162   HD22  ASN  22          HD22      ASN  22  41.201   8.250  -3.547
  163    H    HIS  23           HN       HIS  23  40.012   4.014   1.020
  164    HA   HIS  23           HA       HIS  23  38.847   4.393   3.021
  165    HB2  HIS  23           HB2      HIS  23  40.712   6.190   3.552
  166    HB3  HIS  23           HB1      HIS  23  39.488   7.364   3.018
  167    HD1  HIS  23           HD1      HIS  23  40.668   5.830   6.012
  168    HD2  HIS  23           HD2      HIS  23  36.827   6.573   4.469
  169    HE1  HIS  23           HE1      HIS  23  39.036   5.792   7.978
  170    H    TYR  24           HN       TYR  24  38.804   6.809   0.417
  171    HA   TYR  24           HA       TYR  24  35.986   7.479   0.842
  172    HB2  TYR  24           HB2      TYR  24  37.953   8.006  -1.420
  173    HB3  TYR  24           HB1      TYR  24  36.266   8.573  -1.442
  174    HD1  TYR  24           HD1      TYR  24  35.554  10.436  -0.079
  175    HD2  TYR  24           HD2      TYR  24  39.522   8.798   0.375
  176    HE1  TYR  24           HE1      TYR  24  36.199  12.390   1.326
  177    HE2  TYR  24           HE2      TYR  24  40.166  10.753   1.782
  178    HH   TYR  24           HH       TYR  24  38.603  12.435   3.369
  179    H    LEU  25           HN       LEU  25  37.168   4.626   0.189
  180    HA   LEU  25           HA       LEU  25  36.279   2.744  -0.819
  181    HB2  LEU  25           HB2      LEU  25  34.069   4.085  -0.202
  182    HB3  LEU  25           HB1      LEU  25  33.952   4.319  -1.959
  183    HG   LEU  25           HG       LEU  25  34.117   1.656  -0.473
  184   HD11  LEU  25          HD11      LEU  25  31.934   2.856  -2.235
  185   HD12  LEU  25          HD12      LEU  25  31.915   2.873  -0.455
  186   HD13  LEU  25          HD13      LEU  25  31.853   1.325  -1.333
  187   HD21  LEU  25          HD21      LEU  25  33.688   0.753  -2.863
  188   HD22  LEU  25          HD22      LEU  25  35.333   1.323  -2.505
  189   HD23  LEU  25          HD23      LEU  25  34.218   2.352  -3.438
  Start of MODEL   34
    1    H1   GLY   1           HT1      GLY   1  68.606  12.150   4.686
    2    H2   GLY   1           HT2      GLY   1  67.429  13.156   3.987
    3    H3   GLY   1           HT3      GLY   1  69.008  13.732   4.232
    4    HA2  GLY   1           HA1      GLY   1  69.832  12.749   2.450
    5    HA3  GLY   1           HA2      GLY   1  68.781  11.335   2.660
    6    H    TRP   2           HN       TRP   2  66.643  11.370   1.866
    7    HA   TRP   2           HA       TRP   2  66.374  12.962  -0.567
    8    HB2  TRP   2           HB2      TRP   2  64.385  11.127   0.830
    9    HB3  TRP   2           HB1      TRP   2  64.247  11.754  -0.830
   10    HD1  TRP   2           HD1      TRP   2  65.557   8.885   1.060
   11    HE1  TRP   2           HE1      TRP   2  67.139   7.418  -0.392
   12    HE3  TRP   2           HE3      TRP   2  66.279  12.104  -2.857
   13    HZ2  TRP   2           HZ2      TRP   2  68.516   7.642  -2.912
   14    HZ3  TRP   2           HZ3      TRP   2  67.731  11.456  -4.773
   15    HH2  TRP   2           HH2      TRP   2  68.849   9.230  -4.804
   16    H    GLY   3           HN       GLY   3  65.456  14.887  -0.808
   17    HA2  GLY   3           HA1      GLY   3  64.371  16.280   1.488
   18    HA3  GLY   3           HA2      GLY   3  64.427  16.871  -0.184
   19    H    SER   4           HN       SER   4  63.025  14.089  -0.753
   20    HA   SER   4           HA       SER   4  60.830  13.558  -1.307
   21    HB2  SER   4           HB2      SER   4  59.223  13.691   0.619
   22    HB3  SER   4           HB1      SER   4  60.764  12.906   1.027
   23    HG   SER   4           HG       SER   4  59.642  15.093   2.097
   24    H    ILE   5           HN       ILE   5  60.346  14.938  -2.982
   25    HA   ILE   5           HA       ILE   5  59.664  17.706  -2.624
   26    HB   ILE   5           HB       ILE   5  58.666  15.911  -4.877
   27   HG12  ILE   5          HG12      ILE   5  61.367  17.314  -4.588
   28   HG13  ILE   5          HG11      ILE   5  61.106  15.556  -4.516
   29   HG21  ILE   5          HG21      ILE   5  57.859  18.341  -4.607
   30   HG22  ILE   5          HG22      ILE   5  58.618  17.939  -6.163
   31   HG23  ILE   5          HG23      ILE   5  59.538  18.832  -4.927
   32   HD11  ILE   5           HD1      ILE   5  60.000  15.828  -6.863
   33   HD12  ILE   5           HD2      ILE   5  61.772  15.936  -6.759
   34   HD13  ILE   5           HD3      ILE   5  60.799  17.419  -6.893
   35    H    PHE   6           HN       PHE   6  58.263  17.506  -0.725
   36    HA   PHE   6           HA       PHE   6  56.173  17.406   0.284
   37    HB2  PHE   6           HB2      PHE   6  55.376  18.151  -2.555
   38    HB3  PHE   6           HB1      PHE   6  54.281  18.221  -1.154
   39    HD1  PHE   6           HD1      PHE   6  57.189  19.757  -2.821
   40    HD2  PHE   6           HD2      PHE   6  54.691  19.820   0.696
   41    HE1  PHE   6           HE1      PHE   6  58.109  21.991  -2.209
   42    HE2  PHE   6           HE2      PHE   6  55.609  22.054   1.309
   43    HZ   PHE   6           HZ       PHE   6  57.266  23.169  -0.182
   44    H    LYS   7           HN       LYS   7  57.254  14.973  -1.376
   45    HA   LYS   7           HA       LYS   7  54.906  13.547  -2.255
   46    HB2  LYS   7           HB2      LYS   7  57.262  13.000  -2.920
   47    HB3  LYS   7           HB1      LYS   7  57.547  12.400  -1.268
   48    HG2  LYS   7           HG2      LYS   7  55.801  10.714  -1.521
   49    HG3  LYS   7           HG1      LYS   7  55.351  11.368  -3.115
   50    HD2  LYS   7           HD2      LYS   7  57.716  10.879  -3.889
   51    HD3  LYS   7           HD1      LYS   7  57.980  10.033  -2.344
   52    HE2  LYS   7           HE2      LYS   7  57.335   8.367  -3.979
   53    HE3  LYS   7           HE1      LYS   7  55.951   8.604  -2.885
   54    HZ1  LYS   7           HZ1      LYS   7  56.072   8.982  -5.675
   55    HZ2  LYS   7           HZ2      LYS   7  55.739  10.478  -4.943
   56    HZ3  LYS   7           HZ3      LYS   7  54.736   9.141  -4.641
   57    H    HIS   8           HN       HIS   8  56.657  13.766   0.830
   58    HA   HIS   8           HA       HIS   8  54.990  11.702   2.095
   59    HB2  HIS   8           HB2      HIS   8  56.882  13.727   3.352
   60    HB3  HIS   8           HB1      HIS   8  56.237  12.253   4.114
   61    HD1  HIS   8           HD1      HIS   8  56.670  11.063   0.873
   62    HD2  HIS   8           HD2      HIS   8  59.407  12.104   3.892
   63    HE1  HIS   8           HE1      HIS   8  58.885   9.917   0.321
   64    H    GLY   9           HN       GLY   9  53.130  13.286   1.093
   65    HA2  GLY   9           HA1      GLY   9  51.585  14.095   3.291
   66    HA3  GLY   9           HA2      GLY   9  52.437  15.550   2.740
   67    H    ARG  10           HN       ARG  10  52.232  13.812   0.012
   68    HA   ARG  10           HA       ARG  10  49.592  15.048  -0.758
   69    HB2  ARG  10           HB2      ARG  10  52.124  14.503  -2.337
   70    HB3  ARG  10           HB1      ARG  10  50.575  14.947  -3.093
   71    HG2  ARG  10           HG2      ARG  10  50.513  17.042  -1.813
   72    HG3  ARG  10           HG1      ARG  10  52.017  16.597  -0.969
   73    HD2  ARG  10           HD2      ARG  10  52.387  18.179  -2.892
   74    HD3  ARG  10           HD1      ARG  10  53.265  16.640  -3.068
   75    HE   ARG  10           HE       ARG  10  50.824  16.236  -4.376
   76   HH11  ARG  10          HH11      ARG  10  52.032  15.793  -6.524
   77   HH12  ARG  10          HH12      ARG  10  52.486  17.247  -7.347
   78   HH21  ARG  10          HH21      ARG  10  52.020  19.277  -4.574
   79   HH22  ARG  10          HH22      ARG  10  52.482  19.221  -6.243
   80    H    HIS  11           HN       HIS  11  50.884  13.142  -3.127
   81    HA   HIS  11           HA       HIS  11  48.808  11.092  -2.779
   82    HB2  HIS  11           HB2      HIS  11  50.894  11.374  -4.977
   83    HB3  HIS  11           HB1      HIS  11  49.415  10.384  -5.019
   84    HD1  HIS  11           HD1      HIS  11  50.153  12.856  -6.986
   85    HD2  HIS  11           HD2      HIS  11  47.455  12.886  -3.759
   86    HE1  HIS  11           HE1      HIS  11  48.523  14.786  -7.372
   87    H    ALA  12           HN       ALA  12  49.084   9.027  -2.532
   88    HA   ALA  12           HA       ALA  12  50.011   7.041  -1.856
   89    HB1  ALA  12           HB1      ALA  12  52.317   6.690  -2.129
   90    HB2  ALA  12           HB2      ALA  12  52.573   8.428  -1.955
   91    HB3  ALA  12           HB3      ALA  12  51.850   7.799  -3.439
   92    H    ALA  13           HN       ALA  13  51.321  10.127  -0.741
   93    HA   ALA  13           HA       ALA  13  51.944   9.145   1.944
   94    HB1  ALA  13           HB1      ALA  13  51.205  11.616   2.477
   95    HB2  ALA  13           HB2      ALA  13  51.193  11.847   0.711
   96    HB3  ALA  13           HB3      ALA  13  52.705  11.411   1.543
   97    H    LYS  14           HN       LYS  14  49.975   8.949  -0.547
   98    HA   LYS  14           HA       LYS  14  47.327   8.754   1.121
   99    HB2  LYS  14           HB2      LYS  14  47.676  10.263  -0.995
  100    HB3  LYS  14           HB1      LYS  14  47.797   8.699  -1.882
  101    HG2  LYS  14           HG2      LYS  14  45.499   8.353  -1.760
  102    HG3  LYS  14           HG1      LYS  14  45.368   8.977  -0.101
  103    HD2  LYS  14           HD2      LYS  14  45.385  11.274  -0.906
  104    HD3  LYS  14           HD1      LYS  14  45.730  10.734  -2.567
  105    HE2  LYS  14           HE2      LYS  14  43.566   9.492  -2.589
  106    HE3  LYS  14           HE1      LYS  14  43.214  10.111  -0.958
  107    HZ1  LYS  14           HZ1      LYS  14  43.926  12.307  -2.482
  108    HZ2  LYS  14           HZ2      LYS  14  42.370  11.897  -1.935
  109    HZ3  LYS  14           HZ3      LYS  14  42.893  11.396  -3.472
  110    H    HIS  15           HN       HIS  15  45.857   7.260  -0.464
  111    HA   HIS  15           HA       HIS  15  45.300   4.993  -0.606
  112    HB2  HIS  15           HB2      HIS  15  46.104   5.765  -2.857
  113    HB3  HIS  15           HB1      HIS  15  47.702   5.089  -2.466
  114    HD1  HIS  15           HD1      HIS  15  48.050   2.729  -3.179
  115    HD2  HIS  15           HD2      HIS  15  43.979   3.625  -2.625
  116    HE1  HIS  15           HE1      HIS  15  46.721   0.632  -3.779
  117    H    ILE  16           HN       ILE  16  47.566   5.690   1.365
  118    HA   ILE  16           HA       ILE  16  47.929   3.256   2.437
  119    HB   ILE  16           HB       ILE  16  49.242   2.352   0.675
  120   HG12  ILE  16          HG12      ILE  16  51.467   3.391   2.462
  121   HG13  ILE  16          HG11      ILE  16  50.232   2.311   3.141
  122   HG21  ILE  16          HG21      ILE  16  49.725   4.368  -0.632
  123   HG22  ILE  16          HG22      ILE  16  51.287   3.659  -0.180
  124   HG23  ILE  16          HG23      ILE  16  50.664   5.046   0.711
  125   HD11  ILE  16           HD1      ILE  16  52.097   0.947   2.404
  126   HD12  ILE  16           HD2      ILE  16  52.099   1.713   0.800
  127   HD13  ILE  16           HD3      ILE  16  50.746   0.664   1.285
  128    H    GLY  17           HN       GLY  17  49.440   6.110   1.695
  129    HA2  GLY  17           HA1      GLY  17  50.561   6.416   4.400
  130    HA3  GLY  17           HA2      GLY  17  50.519   7.656   3.131
  131    H    HIS  18           HN       HIS  18  47.619   6.548   2.674
  132    HA   HIS  18           HA       HIS  18  46.348   8.453   4.634
  133    HB2  HIS  18           HB2      HIS  18  45.656   7.332   1.945
  134    HB3  HIS  18           HB1      HIS  18  44.279   7.494   3.051
  135    HD1  HIS  18           HD1      HIS  18  47.170   9.912   3.296
  136    HD2  HIS  18           HD2      HIS  18  43.306   9.781   1.634
  137    HE1  HIS  18           HE1      HIS  18  46.544  12.299   2.633
  138    H    ALA  19           HN       ALA  19  46.098   5.009   3.520
  139    HA   ALA  19           HA       ALA  19  45.755   3.891   6.074
  140    HB1  ALA  19           HB1      ALA  19  43.764   5.000   6.638
  141    HB2  ALA  19           HB2      ALA  19  43.129   3.518   5.897
  142    HB3  ALA  19           HB3      ALA  19  43.184   5.029   4.956
  143    H    ALA  20           HN       ALA  20  46.212   3.678   2.927
  144    HA   ALA  20           HA       ALA  20  46.220   1.928   1.397
  145    HB1  ALA  20           HB1      ALA  20  47.271   0.789   3.430
  146    HB2  ALA  20           HB2      ALA  20  46.517  -0.288   2.231
  147    HB3  ALA  20           HB3      ALA  20  45.667   0.088   3.749
  148    H    VAL  21           HN       VAL  21  43.692   3.132   2.804
  149    HA   VAL  21           HA       VAL  21  41.740   1.552   1.203
  150    HB   VAL  21           HB       VAL  21  41.389   2.205   4.167
  151   HG11  VAL  21          HG11      VAL  21  39.508   1.154   2.020
  152   HG12  VAL  21          HG12      VAL  21  39.237   2.457   3.201
  153   HG13  VAL  21          HG13      VAL  21  39.238   0.766   3.735
  154   HG21  VAL  21          HG21      VAL  21  42.821   0.251   3.866
  155   HG22  VAL  21          HG22      VAL  21  41.704  -0.434   2.661
  156   HG23  VAL  21          HG23      VAL  21  41.214  -0.313   4.368
  157    H    ASN  22           HN       ASN  22  43.143   4.342   2.361
  158    HA   ASN  22           HA       ASN  22  42.747   6.518   1.488
  159    HB2  ASN  22           HB2      ASN  22  39.767   5.942   1.369
  160    HB3  ASN  22           HB1      ASN  22  40.661   7.290   0.638
  161   HD21  ASN  22          HD21      ASN  22  42.919   5.264  -0.081
  162   HD22  ASN  22          HD22      ASN  22  42.294   4.479  -1.534
  163    H    HIS  23           HN       HIS  23  40.611   4.897   3.772
  164    HA   HIS  23           HA       HIS  23  41.231   6.924   5.810
  165    HB2  HIS  23           HB2      HIS  23  38.407   6.620   4.714
  166    HB3  HIS  23           HB1      HIS  23  38.796   7.404   6.264
  167    HD1  HIS  23           HD1      HIS  23  40.593   9.476   6.073
  168    HD2  HIS  23           HD2      HIS  23  38.541   8.364   2.575
  169    HE1  HIS  23           HE1      HIS  23  40.836  11.395   4.404
  170    H    TYR  24           HN       TYR  24  41.969   5.402   7.201
  171    HA   TYR  24           HA       TYR  24  40.921   2.801   7.555
  172    HB2  TYR  24           HB2      TYR  24  43.083   3.588   8.484
  173    HB3  TYR  24           HB1      TYR  24  42.202   4.596   9.656
  174    HD1  TYR  24           HD1      TYR  24  41.277   3.642  11.656
  175    HD2  TYR  24           HD2      TYR  24  42.745   1.070   8.516
  176    HE1  TYR  24           HE1      TYR  24  41.051   1.673  13.164
  177    HE2  TYR  24           HE2      TYR  24  42.518  -0.901  10.026
  178    HH   TYR  24           HH       TYR  24  42.429  -1.436  12.289
  179    H    LEU  25           HN       LEU  25  39.534   5.832   8.339
  180    HA   LEU  25           HA       LEU  25  38.015   5.092  10.666
  181    HB2  LEU  25           HB2      LEU  25  37.693   7.190   8.497
  182    HB3  LEU  25           HB1      LEU  25  36.463   6.993   9.767
  183    HG   LEU  25           HG       LEU  25  38.153   7.370  11.509
  184   HD11  LEU  25          HD11      LEU  25  40.466   8.195  10.686
  185   HD12  LEU  25          HD12      LEU  25  40.045   7.449   9.126
  186   HD13  LEU  25          HD13      LEU  25  40.155   6.447  10.593
  187   HD21  LEU  25          HD21      LEU  25  36.998   9.324  10.490
  188   HD22  LEU  25          HD22      LEU  25  38.303   9.460   9.288
  189   HD23  LEU  25          HD23      LEU  25  38.647   9.742  11.012
  Start of MODEL   35
    1    H1   GLY   1           HT1      GLY   1  58.908  20.786   5.931
    2    H2   GLY   1           HT2      GLY   1  59.643  20.576   4.411
    3    H3   GLY   1           HT3      GLY   1  59.276  22.136   4.975
    4    HA2  GLY   1           HA1      GLY   1  61.540  21.903   5.261
    5    HA3  GLY   1           HA2      GLY   1  60.795  21.718   6.861
    6    H    TRP   2           HN       TRP   2  61.732  19.773   3.995
    7    HA   TRP   2           HA       TRP   2  63.230  17.924   5.727
    8    HB2  TRP   2           HB2      TRP   2  60.729  16.999   4.254
    9    HB3  TRP   2           HB1      TRP   2  61.949  15.915   4.966
   10    HD1  TRP   2           HD1      TRP   2  62.201  15.935   7.636
   11    HE1  TRP   2           HE1      TRP   2  60.541  16.556   9.538
   12    HE3  TRP   2           HE3      TRP   2  58.771  18.559   4.887
   13    HZ2  TRP   2           HZ2      TRP   2  58.063  18.001   9.797
   14    HZ3  TRP   2           HZ3      TRP   2  56.766  19.550   5.983
   15    HH2  TRP   2           HH2      TRP   2  56.410  19.273   8.433
   16    H    GLY   3           HN       GLY   3  61.587  17.243   2.644
   17    HA2  GLY   3           HA1      GLY   3  63.733  18.037   0.936
   18    HA3  GLY   3           HA2      GLY   3  63.949  16.328   1.363
   19    H    SER   4           HN       SER   4  60.853  16.286   1.652
   20    HA   SER   4           HA       SER   4  60.398  15.303  -1.066
   21    HB2  SER   4           HB2      SER   4  58.139  14.780  -0.225
   22    HB3  SER   4           HB1      SER   4  59.389  14.206   0.899
   23    HG   SER   4           HG       SER   4  57.417  16.039   1.269
   24    H    ILE   5           HN       ILE   5  59.830  16.488  -2.757
   25    HA   ILE   5           HA       ILE   5  59.072  19.274  -2.456
   26    HB   ILE   5           HB       ILE   5  58.719  17.575  -4.961
   27   HG12  ILE   5          HG12      ILE   5  61.231  18.925  -3.869
   28   HG13  ILE   5          HG11      ILE   5  60.979  17.176  -4.075
   29   HG21  ILE   5          HG21      ILE   5  59.537  20.496  -4.673
   30   HG22  ILE   5          HG22      ILE   5  57.834  19.990  -4.783
   31   HG23  ILE   5          HG23      ILE   5  58.950  19.655  -6.127
   32   HD11  ILE   5           HD1      ILE   5  60.535  17.734  -6.581
   33   HD12  ILE   5           HD2      ILE   5  62.216  17.810  -6.000
   34   HD13  ILE   5           HD3      ILE   5  61.284  19.309  -6.215
   35    H    PHE   6           HN       PHE   6  57.331  16.290  -3.411
   36    HA   PHE   6           HA       PHE   6  54.841  17.348  -2.298
   37    HB2  PHE   6           HB2      PHE   6  53.561  17.308  -4.403
   38    HB3  PHE   6           HB1      PHE   6  54.859  18.524  -4.469
   39    HD1  PHE   6           HD1      PHE   6  56.691  18.316  -6.026
   40    HD2  PHE   6           HD2      PHE   6  53.859  15.093  -5.554
   41    HE1  PHE   6           HE1      PHE   6  57.630  17.194  -8.044
   42    HE2  PHE   6           HE2      PHE   6  54.799  13.973  -7.571
   43    HZ   PHE   6           HZ       PHE   6  56.644  15.054  -8.850
   44    H    LYS   7           HN       LYS   7  56.930  14.920  -3.185
   45    HA   LYS   7           HA       LYS   7  55.107  12.796  -3.849
   46    HB2  LYS   7           HB2      LYS   7  57.651  12.827  -4.133
   47    HB3  LYS   7           HB1      LYS   7  57.758  12.508  -2.390
   48    HG2  LYS   7           HG2      LYS   7  57.818  10.322  -3.246
   49    HG3  LYS   7           HG1      LYS   7  56.081  10.514  -2.928
   50    HD2  LYS   7           HD2      LYS   7  55.662  11.040  -5.285
   51    HD3  LYS   7           HD1      LYS   7  57.408  11.039  -5.631
   52    HE2  LYS   7           HE2      LYS   7  57.496   8.636  -4.890
   53    HE3  LYS   7           HE1      LYS   7  55.723   8.665  -4.734
   54    HZ1  LYS   7           HZ1      LYS   7  56.382   9.731  -7.231
   55    HZ2  LYS   7           HZ2      LYS   7  55.582   8.271  -6.894
   56    HZ3  LYS   7           HZ3      LYS   7  57.273   8.299  -7.054
   57    H    HIS   8           HN       HIS   8  57.007  13.023  -0.813
   58    HA   HIS   8           HA       HIS   8  54.848  11.585   0.614
   59    HB2  HIS   8           HB2      HIS   8  57.473  12.711   1.665
   60    HB3  HIS   8           HB1      HIS   8  56.416  11.527   2.469
   61    HD1  HIS   8           HD1      HIS   8  59.503  11.173   1.344
   62    HD2  HIS   8           HD2      HIS   8  55.965   9.677  -0.363
   63    HE1  HIS   8           HE1      HIS   8  60.140   9.147  -0.074
   64    H    GLY   9           HN       GLY   9  55.125  14.653  -0.377
   65    HA2  GLY   9           HA1      GLY   9  54.525  16.032   2.161
   66    HA3  GLY   9           HA2      GLY   9  54.612  16.750   0.543
   67    H    ARG  10           HN       ARG  10  52.776  14.602  -0.531
   68    HA   ARG  10           HA       ARG  10  50.251  15.010   0.895
   69    HB2  ARG  10           HB2      ARG  10  49.165  16.225  -1.035
   70    HB3  ARG  10           HB1      ARG  10  50.343  17.196  -0.120
   71    HG2  ARG  10           HG2      ARG  10  52.070  16.760  -1.804
   72    HG3  ARG  10           HG1      ARG  10  50.963  15.688  -2.697
   73    HD2  ARG  10           HD2      ARG  10  50.479  18.651  -2.163
   74    HD3  ARG  10           HD1      ARG  10  51.064  17.971  -3.700
   75    HE   ARG  10           HE       ARG  10  48.687  16.591  -3.111
   76   HH11  ARG  10          HH11      ARG  10  47.901  19.268  -1.946
   77   HH12  ARG  10          HH12      ARG  10  47.192  20.050  -3.320
   78   HH21  ARG  10          HH21      ARG  10  48.559  17.841  -5.616
   79   HH22  ARG  10          HH22      ARG  10  47.565  19.243  -5.398
   80    H    HIS  11           HN       HIS  11  52.022  12.892  -0.324
   81    HA   HIS  11           HA       HIS  11  49.821  11.364  -1.518
   82    HB2  HIS  11           HB2      HIS  11  52.265  12.113  -3.170
   83    HB3  HIS  11           HB1      HIS  11  51.190  10.752  -3.567
   84    HD1  HIS  11           HD1      HIS  11  48.426  11.793  -3.159
   85    HD2  HIS  11           HD2      HIS  11  51.469  14.194  -4.795
   86    HE1  HIS  11           HE1      HIS  11  47.292  13.665  -4.478
   87    H    ALA  12           HN       ALA  12  50.017   9.303  -1.501
   88    HA   ALA  12           HA       ALA  12  50.709   7.211  -0.866
   89    HB1  ALA  12           HB1      ALA  12  52.918   8.065  -1.788
   90    HB2  ALA  12           HB2      ALA  12  52.989   6.792  -0.543
   91    HB3  ALA  12           HB3      ALA  12  53.216   8.489  -0.111
   92    H    ALA  13           HN       ALA  13  51.689  10.084   0.933
   93    HA   ALA  13           HA       ALA  13  51.558   8.750   3.538
   94    HB1  ALA  13           HB1      ALA  13  52.451  11.116   3.322
   95    HB2  ALA  13           HB2      ALA  13  50.998  11.055   4.349
   96    HB3  ALA  13           HB3      ALA  13  50.876  11.622   2.667
   97    H    LYS  14           HN       LYS  14  50.317   8.880   0.615
   98    HA   LYS  14           HA       LYS  14  47.326   8.642   1.490
   99    HB2  LYS  14           HB2      LYS  14  48.245  10.381  -0.233
  100    HB3  LYS  14           HB1      LYS  14  48.586   8.941  -1.258
  101    HG2  LYS  14           HG2      LYS  14  46.336   8.670  -1.792
  102    HG3  LYS  14           HG1      LYS  14  45.769   9.128  -0.169
  103    HD2  LYS  14           HD2      LYS  14  46.078  11.497  -0.682
  104    HD3  LYS  14           HD1      LYS  14  46.818  11.095  -2.251
  105    HE2  LYS  14           HE2      LYS  14  44.707  10.033  -2.984
  106    HE3  LYS  14           HE1      LYS  14  43.963  10.420  -1.414
  107    HZ1  LYS  14           HZ1      LYS  14  44.212  12.741  -1.855
  108    HZ2  LYS  14           HZ2      LYS  14  43.453  12.038  -3.202
  109    HZ3  LYS  14           HZ3      LYS  14  45.101  12.449  -3.270
  110    H    HIS  15           HN       HIS  15  46.319   7.427  -0.605
  111    HA   HIS  15           HA       HIS  15  45.793   5.211  -1.169
  112    HB2  HIS  15           HB2      HIS  15  47.140   6.218  -3.027
  113    HB3  HIS  15           HB1      HIS  15  48.589   5.450  -2.333
  114    HD1  HIS  15           HD1      HIS  15  45.176   4.572  -3.823
  115    HD2  HIS  15           HD2      HIS  15  48.883   2.762  -3.007
  116    HE1  HIS  15           HE1      HIS  15  45.117   2.226  -4.834
  117    H    ILE  16           HN       ILE  16  47.412   5.556   1.400
  118    HA   ILE  16           HA       ILE  16  47.507   3.006   2.196
  119    HB   ILE  16           HB       ILE  16  49.247   2.267   0.756
  120   HG12  ILE  16          HG12      ILE  16  50.972   3.034   3.132
  121   HG13  ILE  16          HG11      ILE  16  49.580   1.969   3.398
  122   HG21  ILE  16          HG21      ILE  16  50.056   4.408  -0.142
  123   HG22  ILE  16          HG22      ILE  16  51.441   3.595   0.607
  124   HG23  ILE  16          HG23      ILE  16  50.620   4.896   1.467
  125   HD11  ILE  16           HD1      ILE  16  51.567   0.608   2.988
  126   HD12  ILE  16           HD2      ILE  16  51.891   1.469   1.466
  127   HD13  ILE  16           HD3      ILE  16  50.451   0.433   1.615
  128    H    GLY  17           HN       GLY  17  49.216   5.845   2.245
  129    HA2  GLY  17           HA1      GLY  17  49.568   5.799   5.163
  130    HA3  GLY  17           HA2      GLY  17  49.875   7.177   4.085
  131    H    HIS  18           HN       HIS  18  47.180   6.254   2.768
  132    HA   HIS  18           HA       HIS  18  45.482   8.003   4.531
  133    HB2  HIS  18           HB2      HIS  18  45.497   7.195   1.654
  134    HB3  HIS  18           HB1      HIS  18  43.878   7.269   2.373
  135    HD1  HIS  18           HD1      HIS  18  46.640   9.573   3.567
  136    HD2  HIS  18           HD2      HIS  18  43.296   9.720   1.020
  137    HE1  HIS  18           HE1      HIS  18  46.189  12.033   3.044
  138    H    ALA  19           HN       ALA  19  45.548   4.652   3.134
  139    HA   ALA  19           HA       ALA  19  44.141   3.652   5.490
  140    HB1  ALA  19           HB1      ALA  19  42.304   4.872   4.214
  141    HB2  ALA  19           HB2      ALA  19  42.000   3.157   4.574
  142    HB3  ALA  19           HB3      ALA  19  42.508   3.647   2.938
  143    H    ALA  20           HN       ALA  20  46.502   2.878   4.093
  144    HA   ALA  20           HA       ALA  20  47.489   0.905   3.390
  145    HB1  ALA  20           HB1      ALA  20  44.864  -0.576   3.620
  146    HB2  ALA  20           HB2      ALA  20  45.716  -0.024   5.079
  147    HB3  ALA  20           HB3      ALA  20  46.515  -1.146   3.953
  148    H    VAL  21           HN       VAL  21  44.655   2.207   1.883
  149    HA   VAL  21           HA       VAL  21  45.634   1.204  -0.744
  150    HB   VAL  21           HB       VAL  21  42.700   0.911   0.036
  151   HG11  VAL  21          HG11      VAL  21  42.623  -0.404  -2.066
  152   HG12  VAL  21          HG12      VAL  21  44.355  -0.090  -2.326
  153   HG13  VAL  21          HG13      VAL  21  43.190   1.255  -2.369
  154   HG21  VAL  21          HG21      VAL  21  43.948  -0.709   1.351
  155   HG22  VAL  21          HG22      VAL  21  44.945  -1.152  -0.054
  156   HG23  VAL  21          HG23      VAL  21  43.217  -1.570  -0.024
  157    H    ASN  22           HN       ASN  22  43.508   3.238   1.208
  158    HA   ASN  22           HA       ASN  22  43.936   5.705   0.214
  159    HB2  ASN  22           HB2      ASN  22  43.603   5.327  -2.096
  160    HB3  ASN  22           HB1      ASN  22  42.248   4.209  -1.820
  161   HD21  ASN  22          HD21      ASN  22  43.024   7.657  -0.899
  162   HD22  ASN  22          HD22      ASN  22  41.455   8.283  -1.416
  163    H    HIS  23           HN       HIS  23  41.217   3.413   0.548
  164    HA   HIS  23           HA       HIS  23  40.208   4.818   2.876
  165    HB2  HIS  23           HB2      HIS  23  39.444   6.364   1.056
  166    HB3  HIS  23           HB1      HIS  23  38.526   5.013   0.347
  167    HD1  HIS  23           HD1      HIS  23  38.484   4.593   3.937
  168    HD2  HIS  23           HD2      HIS  23  36.321   6.940   1.197
  169    HE1  HIS  23           HE1      HIS  23  36.345   5.358   5.109
  170    H    TYR  24           HN       TYR  24  39.694   3.112   4.074
  171    HA   TYR  24           HA       TYR  24  39.099   0.528   3.072
  172    HB2  TYR  24           HB2      TYR  24  38.190   0.083   5.353
  173    HB3  TYR  24           HB1      TYR  24  39.773   0.896   5.388
  174    HD1  TYR  24           HD1      TYR  24  39.946   3.309   5.941
  175    HD2  TYR  24           HD2      TYR  24  36.171   1.224   6.088
  176    HE1  TYR  24           HE1      TYR  24  38.964   5.180   7.262
  177    HE2  TYR  24           HE2      TYR  24  35.187   3.095   7.408
  178    HH   TYR  24           HH       TYR  24  37.152   5.612   8.767
  179    H    LEU  25           HN       LEU  25  37.261   3.334   2.840
  180    HA   LEU  25           HA       LEU  25  34.989   1.864   1.769
  181    HB2  LEU  25           HB2      LEU  25  34.632   1.752   4.298
  182    HB3  LEU  25           HB1      LEU  25  34.465   3.520   4.263
  183    HG   LEU  25           HG       LEU  25  32.669   3.058   2.364
  184   HD11  LEU  25          HD11      LEU  25  33.020   0.667   2.062
  185   HD12  LEU  25          HD12      LEU  25  31.431   0.898   2.820
  186   HD13  LEU  25          HD13      LEU  25  32.813   0.367   3.803
  187   HD21  LEU  25          HD21      LEU  25  32.125   2.373   5.289
  188   HD22  LEU  25          HD22      LEU  25  30.902   2.857   4.091
  189   HD23  LEU  25          HD23      LEU  25  32.160   4.011   4.594
  Start of MODEL   36
    1    H1   GLY   1           HT1      GLY   1  62.624  20.695   4.268
    2    H2   GLY   1           HT2      GLY   1  61.343  21.389   5.143
    3    H3   GLY   1           HT3      GLY   1  61.113  20.903   3.531
    4    HA2  GLY   1           HA1      GLY   1  62.007  18.923   5.455
    5    HA3  GLY   1           HA2      GLY   1  60.318  19.463   5.523
    6    H    TRP   2           HN       TRP   2  60.440  16.938   5.030
    7    HA   TRP   2           HA       TRP   2  60.019  15.257   3.486
    8    HB2  TRP   2           HB2      TRP   2  58.948  17.475   1.709
    9    HB3  TRP   2           HB1      TRP   2  58.413  15.779   1.796
   10    HD1  TRP   2           HD1      TRP   2  57.533  19.101   3.042
   11    HE1  TRP   2           HE1      TRP   2  55.894  18.985   5.057
   12    HE3  TRP   2           HE3      TRP   2  58.004  14.132   4.180
   13    HZ2  TRP   2           HZ2      TRP   2  54.937  16.986   6.895
   14    HZ3  TRP   2           HZ3      TRP   2  56.718  13.142   6.069
   15    HH2  TRP   2           HH2      TRP   2  55.187  14.564   7.427
   16    H    GLY   3           HN       GLY   3  59.850  16.386   0.478
   17    HA2  GLY   3           HA1      GLY   3  62.608  16.904  -0.194
   18    HA3  GLY   3           HA2      GLY   3  62.209  15.193  -0.452
   19    H    SER   4           HN       SER   4  59.527  17.282  -0.767
   20    HA   SER   4           HA       SER   4  59.936  18.017  -3.553
   21    HB2  SER   4           HB2      SER   4  58.104  15.668  -2.929
   22    HB3  SER   4           HB1      SER   4  58.150  16.539  -4.478
   23    HG   SER   4           HG       SER   4  60.099  15.718  -4.889
   24    H    ILE   5           HN       ILE   5  57.784  18.767  -4.541
   25    HA   ILE   5           HA       ILE   5  56.595  20.620  -2.664
   26    HB   ILE   5           HB       ILE   5  55.469  19.861  -5.392
   27   HG12  ILE   5          HG12      ILE   5  57.739  21.784  -4.696
   28   HG13  ILE   5          HG11      ILE   5  57.892  20.270  -5.618
   29   HG21  ILE   5          HG21      ILE   5  54.547  22.075  -5.371
   30   HG22  ILE   5          HG22      ILE   5  55.546  22.560  -3.980
   31   HG23  ILE   5          HG23      ILE   5  54.211  21.406  -3.759
   32   HD11  ILE   5           HD1      ILE   5  57.783  21.953  -7.289
   33   HD12  ILE   5           HD2      ILE   5  56.510  22.849  -6.430
   34   HD13  ILE   5           HD3      ILE   5  56.127  21.306  -7.231
   35    H    PHE   6           HN       PHE   6  55.600  17.522  -4.100
   36    HA   PHE   6           HA       PHE   6  53.759  17.041  -1.909
   37    HB2  PHE   6           HB2      PHE   6  51.668  17.024  -3.159
   38    HB3  PHE   6           HB1      PHE   6  52.401  18.642  -3.266
   39    HD1  PHE   6           HD1      PHE   6  53.100  19.551  -5.385
   40    HD2  PHE   6           HD2      PHE   6  51.916  15.410  -5.086
   41    HE1  PHE   6           HE1      PHE   6  53.097  19.372  -7.871
   42    HE2  PHE   6           HE2      PHE   6  51.914  15.232  -7.571
   43    HZ   PHE   6           HZ       PHE   6  52.405  17.240  -8.961
   44    H    LYS   7           HN       LYS   7  55.565  16.204  -4.651
   45    HA   LYS   7           HA       LYS   7  54.376  13.643  -5.261
   46    HB2  LYS   7           HB2      LYS   7  57.265  14.526  -5.617
   47    HB3  LYS   7           HB1      LYS   7  56.435  13.210  -6.481
   48    HG2  LYS   7           HG2      LYS   7  54.767  14.964  -7.306
   49    HG3  LYS   7           HG1      LYS   7  55.873  16.197  -6.655
   50    HD2  LYS   7           HD2      LYS   7  56.542  14.101  -8.769
   51    HD3  LYS   7           HD1      LYS   7  56.336  15.847  -9.042
   52    HE2  LYS   7           HE2      LYS   7  58.679  15.631  -8.887
   53    HE3  LYS   7           HE1      LYS   7  58.238  16.092  -7.225
   54    HZ1  LYS   7           HZ1      LYS   7  58.003  13.319  -7.421
   55    HZ2  LYS   7           HZ2      LYS   7  59.151  14.209  -6.540
   56    HZ3  LYS   7           HZ3      LYS   7  59.485  13.731  -8.136
   57    H    HIS   8           HN       HIS   8  56.110  14.806  -2.578
   58    HA   HIS   8           HA       HIS   8  56.307  12.062  -1.477
   59    HB2  HIS   8           HB2      HIS   8  58.501  12.525  -2.685
   60    HB3  HIS   8           HB1      HIS   8  58.768  13.853  -1.532
   61    HD1  HIS   8           HD1      HIS   8  58.509  10.072  -1.756
   62    HD2  HIS   8           HD2      HIS   8  59.515  13.028   1.062
   63    HE1  HIS   8           HE1      HIS   8  59.478   8.880   0.285
   64    H    GLY   9           HN       GLY   9  54.629  14.284  -0.929
   65    HA2  GLY   9           HA1      GLY   9  55.297  14.653   1.932
   66    HA3  GLY   9           HA2      GLY   9  55.180  16.133   0.956
   67    H    ARG  10           HN       ARG  10  53.189  13.914  -0.464
   68    HA   ARG  10           HA       ARG  10  50.862  14.318   1.336
   69    HB2  ARG  10           HB2      ARG  10  50.978  15.429  -1.499
   70    HB3  ARG  10           HB1      ARG  10  49.496  15.279  -0.525
   71    HG2  ARG  10           HG2      ARG  10  50.678  16.679   1.265
   72    HG3  ARG  10           HG1      ARG  10  51.939  17.002   0.050
   73    HD2  ARG  10           HD2      ARG  10  50.294  18.821   0.020
   74    HD3  ARG  10           HD1      ARG  10  50.176  17.890  -1.493
   75    HE   ARG  10           HE       ARG  10  48.323  16.711   0.249
   76   HH11  ARG  10          HH11      ARG  10  48.527  19.077  -2.092
   77   HH12  ARG  10          HH12      ARG  10  47.071  19.903  -1.650
   78   HH21  ARG  10          HH21      ARG  10  46.615  18.094   1.272
   79   HH22  ARG  10          HH22      ARG  10  45.988  19.346   0.254
   80    H    HIS  11           HN       HIS  11  52.717  12.493  -0.693
   81    HA   HIS  11           HA       HIS  11  50.410  10.691  -1.435
   82    HB2  HIS  11           HB2      HIS  11  51.831  11.634  -3.338
   83    HB3  HIS  11           HB1      HIS  11  53.199  10.721  -2.660
   84    HD1  HIS  11           HD1      HIS  11  52.691   8.026  -2.313
   85    HD2  HIS  11           HD2      HIS  11  50.338  10.120  -5.097
   86    HE1  HIS  11           HE1      HIS  11  51.567   6.293  -3.817
   87    H    ALA  12           HN       ALA  12  50.449   8.663  -1.121
   88    HA   ALA  12           HA       ALA  12  50.844   6.659  -0.103
   89    HB1  ALA  12           HB1      ALA  12  53.302   7.862   0.891
   90    HB2  ALA  12           HB2      ALA  12  53.227   7.203  -0.744
   91    HB3  ALA  12           HB3      ALA  12  52.995   6.152   0.673
   92    H    ALA  13           HN       ALA  13  51.710   9.709   1.410
   93    HA   ALA  13           HA       ALA  13  51.051   8.806   4.117
   94    HB1  ALA  13           HB1      ALA  13  50.280  11.342   4.190
   95    HB2  ALA  13           HB2      ALA  13  51.131  11.479   2.631
   96    HB3  ALA  13           HB3      ALA  13  52.027  11.012   4.097
   97    H    LYS  14           HN       LYS  14  50.346   8.493   1.042
   98    HA   LYS  14           HA       LYS  14  47.240   8.516   1.401
   99    HB2  LYS  14           HB2      LYS  14  48.534  10.007  -0.319
  100    HB3  LYS  14           HB1      LYS  14  48.975   8.441  -1.097
  101    HG2  LYS  14           HG2      LYS  14  46.852   8.214  -2.024
  102    HG3  LYS  14           HG1      LYS  14  46.021   8.794  -0.563
  103    HD2  LYS  14           HD2      LYS  14  46.574  11.130  -1.175
  104    HD3  LYS  14           HD1      LYS  14  47.420  10.550  -2.630
  105    HE2  LYS  14           HE2      LYS  14  45.370   9.652  -3.553
  106    HE3  LYS  14           HE1      LYS  14  44.493   9.956  -2.037
  107    HZ1  LYS  14           HZ1      LYS  14  45.271  12.385  -2.463
  108    HZ2  LYS  14           HZ2      LYS  14  43.918  11.774  -3.288
  109    HZ3  LYS  14           HZ3      LYS  14  45.421  11.872  -4.073
  110    H    HIS  15           HN       HIS  15  46.565   7.066  -0.738
  111    HA   HIS  15           HA       HIS  15  46.063   4.813  -1.129
  112    HB2  HIS  15           HB2      HIS  15  49.020   5.090  -1.761
  113    HB3  HIS  15           HB1      HIS  15  48.018   3.710  -2.275
  114    HD1  HIS  15           HD1      HIS  15  45.569   6.128  -2.458
  115    HD2  HIS  15           HD2      HIS  15  49.025   5.468  -4.760
  116    HE1  HIS  15           HE1      HIS  15  45.245   7.342  -4.683
  117    H    ILE  16           HN       ILE  16  47.042   5.432   1.680
  118    HA   ILE  16           HA       ILE  16  46.879   3.034   2.829
  119    HB   ILE  16           HB       ILE  16  48.839   2.070   1.784
  120   HG12  ILE  16          HG12      ILE  16  49.781   3.033   4.519
  121   HG13  ILE  16          HG11      ILE  16  48.593   1.734   4.286
  122   HG21  ILE  16          HG21      ILE  16  49.986   4.049   0.913
  123   HG22  ILE  16          HG22      ILE  16  51.101   3.299   2.072
  124   HG23  ILE  16          HG23      ILE  16  50.152   4.708   2.555
  125   HD11  ILE  16           HD1      ILE  16  50.540   0.456   4.422
  126   HD12  ILE  16           HD2      ILE  16  51.560   1.734   3.730
  127   HD13  ILE  16           HD3      ILE  16  50.524   0.751   2.670
  128    H    GLY  17           HN       GLY  17  48.488   5.925   2.725
  129    HA2  GLY  17           HA1      GLY  17  48.391   6.227   5.674
  130    HA3  GLY  17           HA2      GLY  17  48.965   7.432   4.509
  131    H    HIS  18           HN       HIS  18  46.522   6.330   2.839
  132    HA   HIS  18           HA       HIS  18  44.581   8.345   3.979
  133    HB2  HIS  18           HB2      HIS  18  45.011   8.525   1.580
  134    HB3  HIS  18           HB1      HIS  18  44.582   6.820   1.337
  135    HD1  HIS  18           HD1      HIS  18  42.446   8.419   3.862
  136    HD2  HIS  18           HD2      HIS  18  42.470   8.172  -0.335
  137    HE1  HIS  18           HE1      HIS  18  40.105   9.040   3.049
  138    H    ALA  19           HN       ALA  19  44.924   4.819   3.245
  139    HA   ALA  19           HA       ALA  19  42.598   4.405   5.111
  140    HB1  ALA  19           HB1      ALA  19  41.557   4.584   2.899
  141    HB2  ALA  19           HB2      ALA  19  41.416   2.939   3.559
  142    HB3  ALA  19           HB3      ALA  19  42.614   3.289   2.293
  143    H    ALA  20           HN       ALA  20  45.552   3.804   5.052
  144    HA   ALA  20           HA       ALA  20  46.876   2.065   5.829
  145    HB1  ALA  20           HB1      ALA  20  44.812   1.839   7.354
  146    HB2  ALA  20           HB2      ALA  20  45.910   0.444   7.232
  147    HB3  ALA  20           HB3      ALA  20  44.372   0.448   6.338
  148    H    VAL  21           HN       VAL  21  44.769   1.701   3.176
  149    HA   VAL  21           HA       VAL  21  46.493  -0.465   2.100
  150    HB   VAL  21           HB       VAL  21  43.456  -0.767   2.244
  151   HG11  VAL  21          HG11      VAL  21  45.682  -2.414   0.970
  152   HG12  VAL  21          HG12      VAL  21  44.271  -1.683   0.167
  153   HG13  VAL  21          HG13      VAL  21  44.052  -3.060   1.269
  154   HG21  VAL  21          HG21      VAL  21  45.749  -2.184   3.676
  155   HG22  VAL  21          HG22      VAL  21  44.098  -2.842   3.594
  156   HG23  VAL  21          HG23      VAL  21  44.394  -1.294   4.412
  157    H    ASN  22           HN       ASN  22  44.099   2.102   1.714
  158    HA   ASN  22           HA       ASN  22  45.096   2.686  -0.936
  159    HB2  ASN  22           HB2      ASN  22  43.814   0.720  -1.591
  160    HB3  ASN  22           HB1      ASN  22  42.372   1.342  -0.760
  161   HD21  ASN  22          HD21      ASN  22  41.382   1.136  -3.029
  162   HD22  ASN  22          HD22      ASN  22  41.627   2.489  -4.139
  163    H    HIS  23           HN       HIS  23  41.650   2.947  -0.363
  164    HA   HIS  23           HA       HIS  23  41.895   5.646   0.831
  165    HB2  HIS  23           HB2      HIS  23  40.621   6.725  -0.994
  166    HB3  HIS  23           HB1      HIS  23  42.191   6.110  -1.564
  167    HD1  HIS  23           HD1      HIS  23  40.387   6.419  -3.829
  168    HD2  HIS  23           HD2      HIS  23  40.134   3.014  -1.370
  169    HE1  HIS  23           HE1      HIS  23  39.213   4.592  -5.174
  170    H    TYR  24           HN       TYR  24  40.726   2.982   1.489
  171    HA   TYR  24           HA       TYR  24  37.825   3.310   1.229
  172    HB2  TYR  24           HB2      TYR  24  39.516   1.440   2.937
  173    HB3  TYR  24           HB1      TYR  24  37.748   1.342   2.754
  174    HD1  TYR  24           HD1      TYR  24  36.769   1.035   0.413
  175    HD2  TYR  24           HD2      TYR  24  40.965   0.507   1.276
  176    HE1  TYR  24           HE1      TYR  24  37.044  -0.246  -1.706
  177    HE2  TYR  24           HE2      TYR  24  41.239  -0.776  -0.841
  178    HH   TYR  24           HH       TYR  24  40.152  -0.805  -3.034
  179    H    LEU  25           HN       LEU  25  39.646   5.365   2.629
  180    HA   LEU  25           HA       LEU  25  39.490   6.761   4.464
  181    HB2  LEU  25           HB2      LEU  25  37.014   6.595   3.516
  182    HB3  LEU  25           HB1      LEU  25  36.697   5.732   5.036
  183    HG   LEU  25           HG       LEU  25  37.875   8.536   4.752
  184   HD11  LEU  25          HD11      LEU  25  35.779   9.298   5.681
  185   HD12  LEU  25          HD12      LEU  25  35.251   7.630   6.010
  186   HD13  LEU  25          HD13      LEU  25  35.385   8.208   4.331
  187   HD21  LEU  25          HD21      LEU  25  38.900   7.595   6.693
  188   HD22  LEU  25          HD22      LEU  25  37.420   6.721   7.156
  189   HD23  LEU  25          HD23      LEU  25  37.499   8.491   7.322
  Start of MODEL   37
    1    H1   GLY   1           HT1      GLY   1  68.152  13.346  -3.543
    2    H2   GLY   1           HT2      GLY   1  68.394  12.475  -4.983
    3    H3   GLY   1           HT3      GLY   1  68.435  11.676  -3.484
    4    HA2  GLY   1           HA1      GLY   1  66.395  11.169  -4.447
    5    HA3  GLY   1           HA2      GLY   1  66.112  12.327  -3.132
    6    H    TRP   2           HN       TRP   2  64.628  13.777  -3.626
    7    HA   TRP   2           HA       TRP   2  64.849  15.293  -6.148
    8    HB2  TRP   2           HB2      TRP   2  62.311  13.715  -5.563
    9    HB3  TRP   2           HB1      TRP   2  62.616  14.781  -6.955
   10    HD1  TRP   2           HD1      TRP   2  63.370  11.325  -5.585
   11    HE1  TRP   2           HE1      TRP   2  64.562   9.888  -7.394
   12    HE3  TRP   2           HE3      TRP   2  64.239  14.973  -9.070
   13    HZ2  TRP   2           HZ2      TRP   2  65.727  10.299  -9.995
   14    HZ3  TRP   2           HZ3      TRP   2  65.393  14.427 -11.209
   15    HH2  TRP   2           HH2      TRP   2  66.136  12.096 -11.674
   16    H    GLY   3           HN       GLY   3  64.286  15.050  -2.916
   17    HA2  GLY   3           HA1      GLY   3  63.701  16.727  -1.410
   18    HA3  GLY   3           HA2      GLY   3  63.292  17.791  -2.770
   19    H    SER   4           HN       SER   4  61.661  15.119  -3.547
   20    HA   SER   4           HA       SER   4  59.377  14.673  -3.533
   21    HB2  SER   4           HB2      SER   4  58.432  14.211  -1.329
   22    HB3  SER   4           HB1      SER   4  60.115  13.641  -1.387
   23    HG   SER   4           HG       SER   4  59.173  15.151   0.421
   24    H    ILE   5           HN       ILE   5  59.392  16.962  -4.604
   25    HA   ILE   5           HA       ILE   5  58.409  19.208  -3.131
   26    HB   ILE   5           HB       ILE   5  57.674  20.078  -5.356
   27   HG12  ILE   5          HG12      ILE   5  58.475  17.272  -6.262
   28   HG13  ILE   5          HG11      ILE   5  56.849  17.988  -6.339
   29   HG21  ILE   5          HG21      ILE   5  60.108  20.092  -4.522
   30   HG22  ILE   5          HG22      ILE   5  59.882  20.265  -6.278
   31   HG23  ILE   5          HG23      ILE   5  60.379  18.698  -5.595
   32   HD11  ILE   5           HD1      ILE   5  57.954  19.848  -7.793
   33   HD12  ILE   5           HD2      ILE   5  57.693  18.254  -8.541
   34   HD13  ILE   5           HD3      ILE   5  59.312  18.710  -7.961
   35    H    PHE   6           HN       PHE   6  56.887  16.275  -4.120
   36    HA   PHE   6           HA       PHE   6  54.409  17.068  -2.833
   37    HB2  PHE   6           HB2      PHE   6  52.932  17.262  -4.640
   38    HB3  PHE   6           HB1      PHE   6  54.366  18.126  -5.229
   39    HD1  PHE   6           HD1      PHE   6  51.952  16.456  -6.652
   40    HD2  PHE   6           HD2      PHE   6  56.152  15.754  -5.921
   41    HE1  PHE   6           HE1      PHE   6  52.047  14.936  -8.620
   42    HE2  PHE   6           HE2      PHE   6  56.240  14.236  -7.884
   43    HZ   PHE   6           HZ       PHE   6  54.207  13.887  -9.280
   44    H    LYS   7           HN       LYS   7  56.569  14.844  -4.250
   45    HA   LYS   7           HA       LYS   7  54.998  12.531  -4.598
   46    HB2  LYS   7           HB2      LYS   7  57.814  12.820  -3.480
   47    HB3  LYS   7           HB1      LYS   7  57.084  11.276  -3.981
   48    HG2  LYS   7           HG2      LYS   7  56.742  12.171  -6.264
   49    HG3  LYS   7           HG1      LYS   7  57.462  13.720  -5.767
   50    HD2  LYS   7           HD2      LYS   7  59.595  12.625  -5.280
   51    HD3  LYS   7           HD1      LYS   7  58.890  11.029  -5.636
   52    HE2  LYS   7           HE2      LYS   7  60.106  11.731  -7.605
   53    HE3  LYS   7           HE1      LYS   7  58.371  11.884  -7.972
   54    HZ1  LYS   7           HZ1      LYS   7  60.373  13.898  -7.913
   55    HZ2  LYS   7           HZ2      LYS   7  59.134  14.278  -6.815
   56    HZ3  LYS   7           HZ3      LYS   7  58.769  14.000  -8.451
   57    H    HIS   8           HN       HIS   8  57.149  12.631  -1.781
   58    HA   HIS   8           HA       HIS   8  55.139  11.184  -0.192
   59    HB2  HIS   8           HB2      HIS   8  57.555  10.649  -0.045
   60    HB3  HIS   8           HB1      HIS   8  57.872  12.284   0.582
   61    HD1  HIS   8           HD1      HIS   8  58.486  11.801   2.988
   62    HD2  HIS   8           HD2      HIS   8  54.938   9.876   1.806
   63    HE1  HIS   8           HE1      HIS   8  57.436  10.788   5.085
   64    H    GLY   9           HN       GLY   9  53.683  13.218  -0.615
   65    HA2  GLY   9           HA1      GLY   9  53.503  14.578   1.945
   66    HA3  GLY   9           HA2      GLY   9  54.049  15.667   0.654
   67    H    ARG  10           HN       ARG  10  52.387  13.706  -1.168
   68    HA   ARG  10           HA       ARG  10  49.638  14.605  -0.426
   69    HB2  ARG  10           HB2      ARG  10  51.008  15.296  -3.059
   70    HB3  ARG  10           HB1      ARG  10  49.273  15.505  -2.721
   71    HG2  ARG  10           HG2      ARG  10  49.927  16.945  -0.734
   72    HG3  ARG  10           HG1      ARG  10  51.606  16.876  -1.322
   73    HD2  ARG  10           HD2      ARG  10  50.954  17.902  -3.443
   74    HD3  ARG  10           HD1      ARG  10  49.240  17.871  -2.967
   75    HE   ARG  10           HE       ARG  10  50.433  19.318  -0.936
   76   HH11  ARG  10          HH11      ARG  10  52.173  19.712  -3.609
   77   HH12  ARG  10          HH12      ARG  10  51.644  21.311  -4.015
   78   HH21  ARG  10          HH21      ARG  10  48.994  21.288  -1.779
   79   HH22  ARG  10          HH22      ARG  10  49.844  22.202  -2.979
   80    H    HIS  11           HN       HIS  11  51.665  12.200  -1.210
   81    HA   HIS  11           HA       HIS  11  49.467  10.481  -2.114
   82    HB2  HIS  11           HB2      HIS  11  51.887  10.911  -3.915
   83    HB3  HIS  11           HB1      HIS  11  50.637   9.667  -4.142
   84    HD1  HIS  11           HD1      HIS  11  51.236  13.403  -4.351
   85    HD2  HIS  11           HD2      HIS  11  48.139  10.656  -5.095
   86    HE1  HIS  11           HE1      HIS  11  49.418  14.639  -5.653
   87    H    ALA  12           HN       ALA  12  49.706   8.458  -1.799
   88    HA   ALA  12           HA       ALA  12  50.468   6.493  -0.906
   89    HB1  ALA  12           HB1      ALA  12  52.779   6.143  -0.698
   90    HB2  ALA  12           HB2      ALA  12  52.998   7.886  -0.535
   91    HB3  ALA  12           HB3      ALA  12  52.579   7.204  -2.110
   92    H    ALA  13           HN       ALA  13  51.528   9.597   0.394
   93    HA   ALA  13           HA       ALA  13  51.612   8.644   3.160
   94    HB1  ALA  13           HB1      ALA  13  50.867  11.089   3.577
   95    HB2  ALA  13           HB2      ALA  13  51.009  11.343   1.820
   96    HB3  ALA  13           HB3      ALA  13  52.449  10.926   2.780
   97    H    LYS  14           HN       LYS  14  50.156   8.365   0.337
   98    HA   LYS  14           HA       LYS  14  47.242   8.222   1.463
   99    HB2  LYS  14           HB2      LYS  14  48.006   9.706  -0.554
  100    HB3  LYS  14           HB1      LYS  14  48.294   8.135  -1.386
  101    HG2  LYS  14           HG2      LYS  14  46.016   7.794  -1.721
  102    HG3  LYS  14           HG1      LYS  14  45.561   8.436  -0.127
  103    HD2  LYS  14           HD2      LYS  14  45.876  10.747  -0.972
  104    HD3  LYS  14           HD1      LYS  14  46.342  10.101  -2.563
  105    HE2  LYS  14           HE2      LYS  14  43.680   9.472  -1.223
  106    HE3  LYS  14           HE1      LYS  14  43.904  10.820  -2.365
  107    HZ1  LYS  14           HZ1      LYS  14  43.423   9.268  -3.891
  108    HZ2  LYS  14           HZ2      LYS  14  43.783   7.967  -2.861
  109    HZ3  LYS  14           HZ3      LYS  14  45.031   8.770  -3.688
  110    H    HIS  15           HN       HIS  15  46.109   6.705  -0.373
  111    HA   HIS  15           HA       HIS  15  45.588   4.423  -0.570
  112    HB2  HIS  15           HB2      HIS  15  48.299   4.461  -1.938
  113    HB3  HIS  15           HB1      HIS  15  46.899   3.432  -2.324
  114    HD1  HIS  15           HD1      HIS  15  48.511   6.539  -3.296
  115    HD2  HIS  15           HD2      HIS  15  44.530   5.195  -3.091
  116    HE1  HIS  15           HE1      HIS  15  47.113   8.070  -4.790
  117    H    ILE  16           HN       ILE  16  47.368   5.149   1.806
  118    HA   ILE  16           HA       ILE  16  47.574   2.741   2.948
  119    HB   ILE  16           HB       ILE  16  49.230   1.816   1.519
  120   HG12  ILE  16          HG12      ILE  16  51.088   2.972   3.625
  121   HG13  ILE  16          HG11      ILE  16  49.758   1.919   4.139
  122   HG21  ILE  16          HG21      ILE  16  49.917   3.812   0.253
  123   HG22  ILE  16          HG22      ILE  16  51.371   3.130   1.003
  124   HG23  ILE  16          HG23      ILE  16  50.594   4.536   1.724
  125   HD11  ILE  16           HD1      ILE  16  51.986   1.211   2.180
  126   HD12  ILE  16           HD2      ILE  16  50.578   0.174   2.506
  127   HD13  ILE  16           HD3      ILE  16  51.731   0.545   3.806
  128    H    GLY  17           HN       GLY  17  49.252   5.558   2.471
  129    HA2  GLY  17           HA1      GLY  17  49.788   5.947   5.329
  130    HA3  GLY  17           HA2      GLY  17  49.999   7.154   4.046
  131    H    HIS  18           HN       HIS  18  47.229   6.035   3.068
  132    HA   HIS  18           HA       HIS  18  45.636   8.014   4.676
  133    HB2  HIS  18           HB2      HIS  18  45.468   6.795   1.955
  134    HB3  HIS  18           HB1      HIS  18  43.902   6.930   2.771
  135    HD1  HIS  18           HD1      HIS  18  43.142   8.809   1.117
  136    HD2  HIS  18           HD2      HIS  18  46.545   9.784   3.388
  137    HE1  HIS  18           HE1      HIS  18  43.502  11.330   0.911
  138    H    ALA  19           HN       ALA  19  45.670   4.492   3.801
  139    HA   ALA  19           HA       ALA  19  44.467   3.848   6.380
  140    HB1  ALA  19           HB1      ALA  19  42.270   3.213   5.739
  141    HB2  ALA  19           HB2      ALA  19  42.636   3.415   4.007
  142    HB3  ALA  19           HB3      ALA  19  42.511   4.842   5.066
  143    H    ALA  20           HN       ALA  20  46.730   2.898   4.930
  144    HA   ALA  20           HA       ALA  20  47.705   0.851   4.460
  145    HB1  ALA  20           HB1      ALA  20  46.823  -1.101   5.402
  146    HB2  ALA  20           HB2      ALA  20  45.138  -0.604   5.122
  147    HB3  ALA  20           HB3      ALA  20  46.094   0.172   6.407
  148    H    VAL  21           HN       VAL  21  44.713   1.848   3.001
  149    HA   VAL  21           HA       VAL  21  45.538   0.488   0.487
  150    HB   VAL  21           HB       VAL  21  42.722   0.158   1.616
  151   HG11  VAL  21          HG11      VAL  21  44.129  -0.846  -0.897
  152   HG12  VAL  21          HG12      VAL  21  42.744   0.270  -0.816
  153   HG13  VAL  21          HG13      VAL  21  42.543  -1.433  -0.343
  154   HG21  VAL  21          HG21      VAL  21  45.074  -1.773   1.410
  155   HG22  VAL  21          HG22      VAL  21  43.396  -2.297   1.681
  156   HG23  VAL  21          HG23      VAL  21  44.212  -1.274   2.885
  157    H    ASN  22           HN       ASN  22  43.525   2.769   2.277
  158    HA   ASN  22           HA       ASN  22  43.736   5.012   0.781
  159    HB2  ASN  22           HB2      ASN  22  43.116   4.202  -1.347
  160    HB3  ASN  22           HB1      ASN  22  41.877   3.113  -0.683
  161   HD21  ASN  22          HD21      ASN  22  42.633   6.585  -1.329
  162   HD22  ASN  22          HD22      ASN  22  40.943   7.094  -1.392
  163    H    HIS  23           HN       HIS  23  41.100   2.824   1.846
  164    HA   HIS  23           HA       HIS  23  40.381   4.677   3.981
  165    HB2  HIS  23           HB2      HIS  23  39.325   5.709   1.902
  166    HB3  HIS  23           HB1      HIS  23  38.304   4.257   1.799
  167    HD1  HIS  23           HD1      HIS  23  39.342   5.908   5.072
  168    HD2  HIS  23           HD2      HIS  23  35.930   5.547   2.640
  169    HE1  HIS  23           HE1      HIS  23  37.356   6.797   6.411
  170    H    TYR  24           HN       TYR  24  37.482   3.446   3.341
  171    HA   TYR  24           HA       TYR  24  36.297   1.674   4.251
  172    HB2  TYR  24           HB2      TYR  24  38.772   0.103   3.427
  173    HB3  TYR  24           HB1      TYR  24  37.171  -0.582   3.794
  174    HD1  TYR  24           HD1      TYR  24  39.204   1.225   1.322
  175    HD2  TYR  24           HD2      TYR  24  35.212  -0.073   2.329
  176    HE1  TYR  24           HE1      TYR  24  38.473   1.652  -1.021
  177    HE2  TYR  24           HE2      TYR  24  34.482   0.355  -0.014
  178    HH   TYR  24           HH       TYR  24  35.567   2.093  -2.006
  179    H    LEU  25           HN       LEU  25  38.356   3.202   5.898
  180    HA   LEU  25           HA       LEU  25  39.270   3.092   8.030
  181    HB2  LEU  25           HB2      LEU  25  37.221   0.937   8.639
  182    HB3  LEU  25           HB1      LEU  25  37.831   2.231   9.699
  183    HG   LEU  25           HG       LEU  25  36.042   2.570   7.251
  184   HD11  LEU  25          HD11      LEU  25  34.405   3.377   8.907
  185   HD12  LEU  25          HD12      LEU  25  35.582   3.118  10.218
  186   HD13  LEU  25          HD13      LEU  25  34.932   1.727   9.317
  187   HD21  LEU  25          HD21      LEU  25  37.504   4.476   7.293
  188   HD22  LEU  25          HD22      LEU  25  37.433   4.584   9.068
  189   HD23  LEU  25          HD23      LEU  25  36.005   5.005   8.092
  Start of MODEL   38
    1    H1   GLY   1           HT1      GLY   1  62.423  14.813  10.333
    2    H2   GLY   1           HT2      GLY   1  63.290  14.258  11.686
    3    H3   GLY   1           HT3      GLY   1  61.999  13.344  11.064
    4    HA2  GLY   1           HA1      GLY   1  64.298  14.001   9.387
    5    HA3  GLY   1           HA2      GLY   1  64.383  12.662  10.549
    6    H    TRP   2           HN       TRP   2  61.228  13.294   9.398
    7    HA   TRP   2           HA       TRP   2  60.904  10.725   8.252
    8    HB2  TRP   2           HB2      TRP   2  59.362  13.244   7.518
    9    HB3  TRP   2           HB1      TRP   2  58.802  11.561   7.371
   10    HD1  TRP   2           HD1      TRP   2  58.383  10.212   9.672
   11    HE1  TRP   2           HE1      TRP   2  57.720  11.024  12.052
   12    HE3  TRP   2           HE3      TRP   2  59.601  15.162   9.204
   13    HZ2  TRP   2           HZ2      TRP   2  57.730  13.499  13.522
   14    HZ3  TRP   2           HZ3      TRP   2  59.267  16.731  11.109
   15    HH2  TRP   2           HH2      TRP   2  58.332  15.904  13.265
   16    H    GLY   3           HN       GLY   3  62.520  13.489   7.022
   17    HA2  GLY   3           HA1      GLY   3  63.639  13.794   5.017
   18    HA3  GLY   3           HA2      GLY   3  63.304  12.095   4.626
   19    H    SER   4           HN       SER   4  60.569  14.034   5.428
   20    HA   SER   4           HA       SER   4  60.061  14.999   2.714
   21    HB2  SER   4           HB2      SER   4  58.595  12.550   3.757
   22    HB3  SER   4           HB1      SER   4  57.972  13.573   2.443
   23    HG   SER   4           HG       SER   4  59.193  12.299   1.274
   24    H    ILE   5           HN       ILE   5  57.961  16.084   2.541
   25    HA   ILE   5           HA       ILE   5  56.496  16.555   5.070
   26    HB   ILE   5           HB       ILE   5  56.789  19.038   4.926
   27   HG12  ILE   5          HG12      ILE   5  58.905  18.261   2.866
   28   HG13  ILE   5          HG11      ILE   5  57.434  19.213   2.565
   29   HG21  ILE   5          HG21      ILE   5  58.214  17.484   6.404
   30   HG22  ILE   5          HG22      ILE   5  58.896  19.091   6.066
   31   HG23  ILE   5          HG23      ILE   5  59.496  17.667   5.183
   32   HD11  ILE   5           HD1      ILE   5  59.140  20.849   2.774
   33   HD12  ILE   5           HD2      ILE   5  59.909  20.001   4.136
   34   HD13  ILE   5           HD3      ILE   5  58.358  20.846   4.373
   35    H    PHE   6           HN       PHE   6  57.017  17.072   1.620
   36    HA   PHE   6           HA       PHE   6  54.401  18.326   1.200
   37    HB2  PHE   6           HB2      PHE   6  56.449  17.118  -0.701
   38    HB3  PHE   6           HB1      PHE   6  54.949  17.922  -1.226
   39    HD1  PHE   6           HD1      PHE   6  54.554  20.345  -0.632
   40    HD2  PHE   6           HD2      PHE   6  58.349  18.399   0.041
   41    HE1  PHE   6           HE1      PHE   6  55.657  22.569  -0.415
   42    HE2  PHE   6           HE2      PHE   6  59.451  20.623   0.258
   43    HZ   PHE   6           HZ       PHE   6  58.117  22.706  -0.043
   44    H    LYS   7           HN       LYS   7  54.007  16.030   2.699
   45    HA   LYS   7           HA       LYS   7  52.806  14.037   2.707
   46    HB2  LYS   7           HB2      LYS   7  51.678  15.392   0.230
   47    HB3  LYS   7           HB1      LYS   7  51.006  13.893   0.915
   48    HG2  LYS   7           HG2      LYS   7  50.536  14.997   3.031
   49    HG3  LYS   7           HG1      LYS   7  51.376  16.473   2.495
   50    HD2  LYS   7           HD2      LYS   7  49.715  16.800   0.707
   51    HD3  LYS   7           HD1      LYS   7  48.891  15.292   1.176
   52    HE2  LYS   7           HE2      LYS   7  48.522  16.273   3.465
   53    HE3  LYS   7           HE1      LYS   7  49.202  17.807   2.871
   54    HZ1  LYS   7           HZ1      LYS   7  46.870  17.954   2.641
   55    HZ2  LYS   7           HZ2      LYS   7  46.751  16.415   1.932
   56    HZ3  LYS   7           HZ3      LYS   7  47.471  17.693   1.076
   57    H    HIS   8           HN       HIS   8  55.332  13.608   1.880
   58    HA   HIS   8           HA       HIS   8  56.691  12.277   0.534
   59    HB2  HIS   8           HB2      HIS   8  55.273  10.641   1.840
   60    HB3  HIS   8           HB1      HIS   8  54.211  10.519   0.416
   61    HD1  HIS   8           HD1      HIS   8  57.584  11.076  -0.767
   62    HD2  HIS   8           HD2      HIS   8  55.497   7.726   0.680
   63    HE1  HIS   8           HE1      HIS   8  58.825   8.997  -1.579
   64    H    GLY   9           HN       GLY   9  55.248  14.334  -0.899
   65    HA2  GLY   9           HA1      GLY   9  55.323  14.895  -3.181
   66    HA3  GLY   9           HA2      GLY   9  55.508  13.184  -3.610
   67    H    ARG  10           HN       ARG  10  53.004  14.256  -1.392
   68    HA   ARG  10           HA       ARG  10  50.701  14.197  -1.566
   69    HB2  ARG  10           HB2      ARG  10  51.249  14.933  -4.477
   70    HB3  ARG  10           HB1      ARG  10  49.658  14.957  -3.700
   71    HG2  ARG  10           HG2      ARG  10  50.319  17.202  -3.474
   72    HG3  ARG  10           HG1      ARG  10  50.824  16.523  -1.914
   73    HD2  ARG  10           HD2      ARG  10  53.128  16.397  -2.620
   74    HD3  ARG  10           HD1      ARG  10  52.699  16.729  -4.314
   75    HE   ARG  10           HE       ARG  10  53.095  18.719  -2.252
   76   HH11  ARG  10          HH11      ARG  10  50.606  19.794  -2.485
   77   HH12  ARG  10          HH12      ARG  10  50.517  20.585  -4.022
   78   HH21  ARG  10          HH21      ARG  10  53.255  18.914  -5.340
   79   HH22  ARG  10          HH22      ARG  10  52.016  20.087  -5.638
   80    H    HIS  11           HN       HIS  11  52.127  11.813  -1.720
   81    HA   HIS  11           HA       HIS  11  50.059  10.071  -2.684
   82    HB2  HIS  11           HB2      HIS  11  51.272   8.916  -4.478
   83    HB3  HIS  11           HB1      HIS  11  51.073  10.633  -4.903
   84    HD1  HIS  11           HD1      HIS  11  53.154  11.775  -5.660
   85    HD2  HIS  11           HD2      HIS  11  53.977   8.475  -3.186
   86    HE1  HIS  11           HE1      HIS  11  55.695  11.563  -5.493
   87    H    ALA  12           HN       ALA  12  50.172   8.135  -1.995
   88    HA   ALA  12           HA       ALA  12  50.789   6.335  -0.720
   89    HB1  ALA  12           HB1      ALA  12  53.331   7.701  -0.346
   90    HB2  ALA  12           HB2      ALA  12  53.030   6.777  -1.820
   91    HB3  ALA  12           HB3      ALA  12  53.050   5.976  -0.229
   92    H    ALA  13           HN       ALA  13  51.823   9.626   0.086
   93    HA   ALA  13           HA       ALA  13  51.618   9.178   2.979
   94    HB1  ALA  13           HB1      ALA  13  52.508  11.355   2.444
   95    HB2  ALA  13           HB2      ALA  13  50.787  11.688   2.757
   96    HB3  ALA  13           HB3      ALA  13  51.380  11.563   1.084
   97    H    LYS  14           HN       LYS  14  50.431   8.381   0.140
   98    HA   LYS  14           HA       LYS  14  47.421   8.482   0.986
   99    HB2  LYS  14           HB2      LYS  14  48.400   9.578  -1.188
  100    HB3  LYS  14           HB1      LYS  14  48.715   7.881  -1.700
  101    HG2  LYS  14           HG2      LYS  14  46.464   7.499  -2.161
  102    HG3  LYS  14           HG1      LYS  14  45.892   8.425  -0.756
  103    HD2  LYS  14           HD2      LYS  14  45.144   9.574  -2.739
  104    HD3  LYS  14           HD1      LYS  14  46.465  10.547  -2.053
  105    HE2  LYS  14           HE2      LYS  14  46.884  10.395  -4.419
  106    HE3  LYS  14           HE1      LYS  14  48.039   9.293  -3.636
  107    HZ1  LYS  14           HZ1      LYS  14  45.466   8.556  -4.934
  108    HZ2  LYS  14           HZ2      LYS  14  46.434   7.476  -4.049
  109    HZ3  LYS  14           HZ3      LYS  14  47.029   8.179  -5.477
  110    H    HIS  15           HN       HIS  15  46.418   6.680  -0.638
  111    HA   HIS  15           HA       HIS  15  45.853   4.412  -0.475
  112    HB2  HIS  15           HB2      HIS  15  48.635   4.416  -1.700
  113    HB3  HIS  15           HB1      HIS  15  47.494   3.052  -1.779
  114    HD1  HIS  15           HD1      HIS  15  44.924   5.032  -2.058
  115    HD2  HIS  15           HD2      HIS  15  48.331   4.888  -4.520
  116    HE1  HIS  15           HE1      HIS  15  44.283   6.064  -4.306
  117    H    ILE  16           HN       ILE  16  47.467   5.530   1.870
  118    HA   ILE  16           HA       ILE  16  47.484   3.366   3.450
  119    HB   ILE  16           HB       ILE  16  49.218   2.185   2.330
  120   HG12  ILE  16          HG12      ILE  16  50.708   3.692   4.517
  121   HG13  ILE  16          HG11      ILE  16  49.460   2.479   4.876
  122   HG21  ILE  16          HG21      ILE  16  51.453   3.364   1.859
  123   HG22  ILE  16          HG22      ILE  16  50.638   4.879   2.252
  124   HG23  ILE  16          HG23      ILE  16  50.105   3.930   0.853
  125   HD11  ILE  16           HD1      ILE  16  51.410   1.173   4.948
  126   HD12  ILE  16           HD2      ILE  16  52.206   2.091   3.653
  127   HD13  ILE  16           HD3      ILE  16  50.913   0.934   3.258
  128    H    GLY  17           HN       GLY  17  49.188   6.080   2.610
  129    HA2  GLY  17           HA1      GLY  17  49.520   6.944   5.405
  130    HA3  GLY  17           HA2      GLY  17  49.869   7.907   3.955
  131    H    HIS  18           HN       HIS  18  47.176   6.627   2.950
  132    HA   HIS  18           HA       HIS  18  45.467   8.853   4.063
  133    HB2  HIS  18           HB2      HIS  18  45.520   7.214   1.553
  134    HB3  HIS  18           HB1      HIS  18  43.898   7.576   2.175
  135    HD1  HIS  18           HD1      HIS  18  46.739  10.017   2.709
  136    HD2  HIS  18           HD2      HIS  18  43.373   9.568   0.229
  137    HE1  HIS  18           HE1      HIS  18  46.431  12.212   1.439
  138    H    ALA  19           HN       ALA  19  45.492   5.259   3.636
  139    HA   ALA  19           HA       ALA  19  44.411   4.616   6.130
  140    HB1  ALA  19           HB1      ALA  19  42.365   5.738   5.952
  141    HB2  ALA  19           HB2      ALA  19  41.916   4.155   5.286
  142    HB3  ALA  19           HB3      ALA  19  42.277   5.509   4.188
  143    H    ALA  20           HN       ALA  20  45.711   3.849   3.338
  144    HA   ALA  20           HA       ALA  20  46.099   1.856   2.208
  145    HB1  ALA  20           HB1      ALA  20  46.090  -0.166   3.478
  146    HB2  ALA  20           HB2      ALA  20  44.870   0.464   4.609
  147    HB3  ALA  20           HB3      ALA  20  46.520   1.130   4.617
  148    H    VAL  21           HN       VAL  21  43.292   3.213   2.616
  149    HA   VAL  21           HA       VAL  21  41.854   1.318   0.827
  150    HB   VAL  21           HB       VAL  21  40.667   2.418   3.418
  151   HG11  VAL  21          HG11      VAL  21  38.888   2.365   1.847
  152   HG12  VAL  21          HG12      VAL  21  38.753   0.790   2.653
  153   HG13  VAL  21          HG13      VAL  21  39.508   0.904   1.045
  154   HG21  VAL  21          HG21      VAL  21  42.136   0.543   3.912
  155   HG22  VAL  21          HG22      VAL  21  41.472  -0.400   2.557
  156   HG23  VAL  21          HG23      VAL  21  40.466  -0.054   3.984
  157    H    ASN  22           HN       ASN  22  42.878   4.314   1.864
  158    HA   ASN  22           HA       ASN  22  42.742   6.299   0.553
  159    HB2  ASN  22           HB2      ASN  22  39.895   5.589  -0.229
  160    HB3  ASN  22           HB1      ASN  22  40.939   6.856  -0.905
  161   HD21  ASN  22          HD21      ASN  22  39.962   5.183  -2.812
  162   HD22  ASN  22          HD22      ASN  22  41.191   4.024  -3.330
  163    H    HIS  23           HN       HIS  23  40.069   4.995   2.453
  164    HA   HIS  23           HA       HIS  23  40.223   7.173   4.339
  165    HB2  HIS  23           HB2      HIS  23  37.946   8.126   3.913
  166    HB3  HIS  23           HB1      HIS  23  39.110   8.474   2.611
  167    HD1  HIS  23           HD1      HIS  23  38.920   7.015   0.393
  168    HD2  HIS  23           HD2      HIS  23  35.777   6.503   3.140
  169    HE1  HIS  23           HE1      HIS  23  37.005   5.862  -0.847
  170    H    TYR  24           HN       TYR  24  40.224   5.630   5.921
  171    HA   TYR  24           HA       TYR  24  38.227   3.493   5.966
  172    HB2  TYR  24           HB2      TYR  24  40.472   3.209   6.956
  173    HB3  TYR  24           HB1      TYR  24  40.120   4.500   8.130
  174    HD1  TYR  24           HD1      TYR  24  39.216   3.880  10.228
  175    HD2  TYR  24           HD2      TYR  24  38.642   1.279   6.829
  176    HE1  TYR  24           HE1      TYR  24  38.095   2.208  11.695
  177    HE2  TYR  24           HE2      TYR  24  37.522  -0.392   8.300
  178    HH   TYR  24           HH       TYR  24  37.499  -0.995  10.713
  179    H    LEU  25           HN       LEU  25  37.730   6.641   6.190
  180    HA   LEU  25           HA       LEU  25  36.371   6.952   8.722
  181    HB2  LEU  25           HB2      LEU  25  35.732   8.491   6.182
  182    HB3  LEU  25           HB1      LEU  25  35.625   9.041   7.872
  183    HG   LEU  25           HG       LEU  25  38.174   8.396   6.326
  184   HD11  LEU  25          HD11      LEU  25  37.133  10.560   5.750
  185   HD12  LEU  25          HD12      LEU  25  38.632  10.813   6.678
  186   HD13  LEU  25          HD13      LEU  25  37.050  10.989   7.475
  187   HD21  LEU  25          HD21      LEU  25  37.661   9.080   9.251
  188   HD22  LEU  25          HD22      LEU  25  39.238   9.371   8.477
  189   HD23  LEU  25          HD23      LEU  25  38.592   7.717   8.584
  Start of MODEL   39
    1    H1   GLY   1           HT1      GLY   1  63.197   9.401  12.472
    2    H2   GLY   1           HT2      GLY   1  62.980  10.351  13.864
    3    H3   GLY   1           HT3      GLY   1  64.533  10.143  13.206
    4    HA2  GLY   1           HA1      GLY   1  62.365  11.870  12.396
    5    HA3  GLY   1           HA2      GLY   1  64.119  12.139  12.363
    6    H    TRP   2           HN       TRP   2  61.336  11.335  10.571
    7    HA   TRP   2           HA       TRP   2  62.469   9.786   8.458
    8    HB2  TRP   2           HB2      TRP   2  60.175  11.789   8.462
    9    HB3  TRP   2           HB1      TRP   2  60.549  10.690   7.111
   10    HD1  TRP   2           HD1      TRP   2  59.492  10.622  10.816
   11    HE1  TRP   2           HE1      TRP   2  58.298   8.369  11.326
   12    HE3  TRP   2           HE3      TRP   2  60.224   8.286   6.320
   13    HZ2  TRP   2           HZ2      TRP   2  57.753   5.904   9.944
   14    HZ3  TRP   2           HZ3      TRP   2  59.359   5.983   5.938
   15    HH2  TRP   2           HH2      TRP   2  58.125   4.790   7.744
   16    H    GLY   3           HN       GLY   3  61.205  12.509   6.937
   17    HA2  GLY   3           HA1      GLY   3  63.359  14.314   6.800
   18    HA3  GLY   3           HA2      GLY   3  63.688  13.060   5.589
   19    H    SER   4           HN       SER   4  60.710  12.642   5.254
   20    HA   SER   4           HA       SER   4  60.399  14.515   3.059
   21    HB2  SER   4           HB2      SER   4  58.499  12.530   4.357
   22    HB3  SER   4           HB1      SER   4  58.094  13.488   2.916
   23    HG   SER   4           HG       SER   4  59.011  11.352   2.513
   24    H    ILE   5           HN       ILE   5  58.051  15.563   2.884
   25    HA   ILE   5           HA       ILE   5  57.018  16.689   5.359
   26    HB   ILE   5           HB       ILE   5  59.113  18.027   5.155
   27   HG12  ILE   5          HG12      ILE   5  56.601  19.645   4.508
   28   HG13  ILE   5          HG11      ILE   5  56.982  18.978   6.112
   29   HG21  ILE   5          HG21      ILE   5  57.919  19.182   2.604
   30   HG22  ILE   5          HG22      ILE   5  59.099  17.850   2.579
   31   HG23  ILE   5          HG23      ILE   5  59.551  19.424   3.269
   32   HD11  ILE   5           HD1      ILE   5  58.499  21.104   4.556
   33   HD12  ILE   5           HD2      ILE   5  59.217  20.250   5.942
   34   HD13  ILE   5           HD3      ILE   5  57.756  21.238   6.165
   35    H    PHE   6           HN       PHE   6  57.413  17.101   1.825
   36    HA   PHE   6           HA       PHE   6  54.788  18.377   1.555
   37    HB2  PHE   6           HB2      PHE   6  56.524  17.135  -0.612
   38    HB3  PHE   6           HB1      PHE   6  55.235  18.347  -0.815
   39    HD1  PHE   6           HD1      PHE   6  58.760  17.871  -0.317
   40    HD2  PHE   6           HD2      PHE   6  55.509  20.579   0.541
   41    HE1  PHE   6           HE1      PHE   6  60.396  19.708   0.079
   42    HE2  PHE   6           HE2      PHE   6  57.145  22.415   0.938
   43    HZ   PHE   6           HZ       PHE   6  59.590  21.966   0.758
   44    H    LYS   7           HN       LYS   7  54.320  16.099   2.977
   45    HA   LYS   7           HA       LYS   7  53.081  14.124   2.946
   46    HB2  LYS   7           HB2      LYS   7  52.018  15.582   0.509
   47    HB3  LYS   7           HB1      LYS   7  51.315  14.052   1.090
   48    HG2  LYS   7           HG2      LYS   7  50.790  15.042   3.247
   49    HG3  LYS   7           HG1      LYS   7  51.672  16.531   2.828
   50    HD2  LYS   7           HD2      LYS   7  50.069  16.908   0.940
   51    HD3  LYS   7           HD1      LYS   7  49.153  15.474   1.469
   52    HE2  LYS   7           HE2      LYS   7  48.652  16.501   3.610
   53    HE3  LYS   7           HE1      LYS   7  49.737  17.868   3.263
   54    HZ1  LYS   7           HZ1      LYS   7  47.610  18.644   2.759
   55    HZ2  LYS   7           HZ2      LYS   7  47.143  17.201   1.994
   56    HZ3  LYS   7           HZ3      LYS   7  48.257  18.242   1.244
   57    H    HIS   8           HN       HIS   8  55.600  13.657   2.167
   58    HA   HIS   8           HA       HIS   8  56.961  12.320   0.822
   59    HB2  HIS   8           HB2      HIS   8  55.514  10.716   2.143
   60    HB3  HIS   8           HB1      HIS   8  54.468  10.582   0.711
   61    HD1  HIS   8           HD1      HIS   8  57.983   9.817   1.946
   62    HD2  HIS   8           HD2      HIS   8  55.516   8.980  -1.356
   63    HE1  HIS   8           HE1      HIS   8  59.176   8.055   0.532
   64    H    GLY   9           HN       GLY   9  55.559  14.379  -0.616
   65    HA2  GLY   9           HA1      GLY   9  55.659  14.927  -2.905
   66    HA3  GLY   9           HA2      GLY   9  55.762  13.206  -3.327
   67    H    ARG  10           HN       ARG  10  53.332  14.401  -1.081
   68    HA   ARG  10           HA       ARG  10  51.019  14.385  -1.234
   69    HB2  ARG  10           HB2      ARG  10  51.668  15.267  -4.084
   70    HB3  ARG  10           HB1      ARG  10  50.024  15.198  -3.424
   71    HG2  ARG  10           HG2      ARG  10  50.546  17.433  -2.973
   72    HG3  ARG  10           HG1      ARG  10  51.090  16.688  -1.457
   73    HD2  ARG  10           HD2      ARG  10  52.861  18.146  -2.165
   74    HD3  ARG  10           HD1      ARG  10  53.413  16.502  -2.546
   75    HE   ARG  10           HE       ARG  10  52.163  17.320  -4.880
   76   HH11  ARG  10          HH11      ARG  10  52.627  19.683  -5.615
   77   HH12  ARG  10          HH12      ARG  10  54.320  20.043  -5.648
   78   HH21  ARG  10          HH21      ARG  10  55.211  17.313  -3.706
   79   HH22  ARG  10          HH22      ARG  10  55.782  18.703  -4.566
   80    H    HIS  11           HN       HIS  11  52.491  12.015  -1.552
   81    HA   HIS  11           HA       HIS  11  50.374  10.311  -2.592
   82    HB2  HIS  11           HB2      HIS  11  53.014  10.486  -4.104
   83    HB3  HIS  11           HB1      HIS  11  51.920   9.088  -4.216
   84    HD1  HIS  11           HD1      HIS  11  52.460  12.547  -5.466
   85    HD2  HIS  11           HD2      HIS  11  49.358   9.709  -5.442
   86    HE1  HIS  11           HE1      HIS  11  50.686  13.344  -7.122
   87    H    ALA  12           HN       ALA  12  50.448   8.340  -1.956
   88    HA   ALA  12           HA       ALA  12  50.968   6.523  -0.669
   89    HB1  ALA  12           HB1      ALA  12  53.479   7.876  -0.092
   90    HB2  ALA  12           HB2      ALA  12  53.278   6.986  -1.605
   91    HB3  ALA  12           HB3      ALA  12  53.190   6.148  -0.034
   92    H    ALA  13           HN       ALA  13  51.950   9.792   0.285
   93    HA   ALA  13           HA       ALA  13  51.552   9.278   3.144
   94    HB1  ALA  13           HB1      ALA  13  51.523  11.698   1.289
   95    HB2  ALA  13           HB2      ALA  13  52.452  11.465   2.790
   96    HB3  ALA  13           HB3      ALA  13  50.706  11.809   2.866
   97    H    LYS  14           HN       LYS  14  50.556   8.558   0.213
   98    HA   LYS  14           HA       LYS  14  47.495   8.644   0.856
   99    HB2  LYS  14           HB2      LYS  14  48.629   9.796  -1.210
  100    HB3  LYS  14           HB1      LYS  14  48.975   8.110  -1.746
  101    HG2  LYS  14           HG2      LYS  14  46.767   7.772  -2.396
  102    HG3  LYS  14           HG1      LYS  14  46.095   8.633  -0.992
  103    HD2  LYS  14           HD2      LYS  14  46.560  10.797  -2.061
  104    HD3  LYS  14           HD1      LYS  14  47.332   9.974  -3.438
  105    HE2  LYS  14           HE2      LYS  14  45.142   8.760  -3.832
  106    HE3  LYS  14           HE1      LYS  14  44.409   9.804  -2.591
  107    HZ1  LYS  14           HZ1      LYS  14  44.157  10.613  -4.920
  108    HZ2  LYS  14           HZ2      LYS  14  45.840  10.838  -4.986
  109    HZ3  LYS  14           HZ3      LYS  14  44.904  11.724  -3.879
  110    H    HIS  15           HN       HIS  15  46.608   6.885  -0.891
  111    HA   HIS  15           HA       HIS  15  46.041   4.614  -0.840
  112    HB2  HIS  15           HB2      HIS  15  47.622   5.031  -2.761
  113    HB3  HIS  15           HB1      HIS  15  48.940   4.421  -1.733
  114    HD1  HIS  15           HD1      HIS  15  45.354   3.085  -2.068
  115    HD2  HIS  15           HD2      HIS  15  49.327   1.846  -2.678
  116    HE1  HIS  15           HE1      HIS  15  45.288   0.621  -2.743
  117    H    ILE  16           HN       ILE  16  47.493   5.672   1.656
  118    HA   ILE  16           HA       ILE  16  47.372   3.465   3.178
  119    HB   ILE  16           HB       ILE  16  49.182   2.305   2.151
  120   HG12  ILE  16          HG12      ILE  16  50.636   3.684   4.437
  121   HG13  ILE  16          HG11      ILE  16  49.235   2.645   4.766
  122   HG21  ILE  16          HG21      ILE  16  50.601   4.999   2.252
  123   HG22  ILE  16          HG22      ILE  16  50.180   4.081   0.794
  124   HG23  ILE  16          HG23      ILE  16  51.451   3.497   1.884
  125   HD11  ILE  16           HD1      ILE  16  51.877   1.855   3.470
  126   HD12  ILE  16           HD2      ILE  16  50.434   0.818   3.408
  127   HD13  ILE  16           HD3      ILE  16  51.162   1.238   4.973
  128    H    GLY  17           HN       GLY  17  49.120   6.203   2.527
  129    HA2  GLY  17           HA1      GLY  17  49.265   6.989   5.365
  130    HA3  GLY  17           HA2      GLY  17  49.727   7.984   3.969
  131    H    HIS  18           HN       HIS  18  47.102   6.742   2.749
  132    HA   HIS  18           HA       HIS  18  45.333   8.961   3.774
  133    HB2  HIS  18           HB2      HIS  18  45.560   7.364   1.251
  134    HB3  HIS  18           HB1      HIS  18  43.893   7.705   1.760
  135    HD1  HIS  18           HD1      HIS  18  46.686  10.145   2.528
  136    HD2  HIS  18           HD2      HIS  18  43.592   9.685  -0.283
  137    HE1  HIS  18           HE1      HIS  18  46.449  12.366   1.287
  138    H    ALA  19           HN       ALA  19  45.425   5.380   3.355
  139    HA   ALA  19           HA       ALA  19  44.204   4.664   5.730
  140    HB1  ALA  19           HB1      ALA  19  42.155   5.685   3.767
  141    HB2  ALA  19           HB2      ALA  19  42.170   5.794   5.544
  142    HB3  ALA  19           HB3      ALA  19  41.731   4.266   4.754
  143    H    ALA  20           HN       ALA  20  45.601   3.990   2.970
  144    HA   ALA  20           HA       ALA  20  46.016   2.040   1.779
  145    HB1  ALA  20           HB1      ALA  20  46.338   1.221   4.171
  146    HB2  ALA  20           HB2      ALA  20  45.938  -0.030   2.971
  147    HB3  ALA  20           HB3      ALA  20  44.684   0.574   4.079
  148    H    VAL  21           HN       VAL  21  43.200   3.400   2.126
  149    HA   VAL  21           HA       VAL  21  41.825   1.559   0.227
  150    HB   VAL  21           HB       VAL  21  40.561   2.622   2.798
  151   HG11  VAL  21          HG11      VAL  21  38.846   2.719   1.158
  152   HG12  VAL  21          HG12      VAL  21  38.609   1.125   1.902
  153   HG13  VAL  21          HG13      VAL  21  39.427   1.257   0.327
  154   HG21  VAL  21          HG21      VAL  21  41.952   0.656   3.224
  155   HG22  VAL  21          HG22      VAL  21  41.236  -0.198   1.837
  156   HG23  VAL  21          HG23      VAL  21  40.248   0.161   3.273
  157    H    ASN  22           HN       ASN  22  42.831   4.541   1.362
  158    HA   ASN  22           HA       ASN  22  42.791   6.518   0.017
  159    HB2  ASN  22           HB2      ASN  22  41.316   5.333  -1.741
  160    HB3  ASN  22           HB1      ASN  22  39.923   5.929  -0.802
  161   HD21  ASN  22          HD21      ASN  22  42.033   6.724  -3.352
  162   HD22  ASN  22          HD22      ASN  22  41.770   8.471  -3.349
  163    H    HIS  23           HN       HIS  23  40.053   5.282   1.879
  164    HA   HIS  23           HA       HIS  23  40.241   7.474   3.756
  165    HB2  HIS  23           HB2      HIS  23  39.099   8.606   1.794
  166    HB3  HIS  23           HB1      HIS  23  37.741   7.478   2.020
  167    HD1  HIS  23           HD1      HIS  23  37.566   7.375   5.093
  168    HD2  HIS  23           HD2      HIS  23  38.161  10.942   2.949
  169    HE1  HIS  23           HE1      HIS  23  36.751   9.294   6.568
  170    H    TYR  24           HN       TYR  24  40.143   6.092   5.428
  171    HA   TYR  24           HA       TYR  24  37.553   4.996   6.139
  172    HB2  TYR  24           HB2      TYR  24  38.376   3.290   4.463
  173    HB3  TYR  24           HB1      TYR  24  39.743   2.965   5.556
  174    HD1  TYR  24           HD1      TYR  24  39.417   1.821   7.688
  175    HD2  TYR  24           HD2      TYR  24  36.061   2.732   5.129
  176    HE1  TYR  24           HE1      TYR  24  37.976   0.299   9.035
  177    HE2  TYR  24           HE2      TYR  24  34.621   1.210   6.477
  178    HH   TYR  24           HH       TYR  24  35.246   0.032   9.378
  179    H    LEU  25           HN       LEU  25  40.638   6.098   6.729
  180    HA   LEU  25           HA       LEU  25  40.279   5.934   9.598
  181    HB2  LEU  25           HB2      LEU  25  41.159   3.571   8.794
  182    HB3  LEU  25           HB1      LEU  25  42.723   4.401   8.657
  183    HG   LEU  25           HG       LEU  25  40.979   4.272  11.163
  184   HD11  LEU  25          HD11      LEU  25  42.093   2.127  10.547
  185   HD12  LEU  25          HD12      LEU  25  42.767   2.823  12.040
  186   HD13  LEU  25          HD13      LEU  25  43.660   2.970  10.506
  187   HD21  LEU  25          HD21      LEU  25  43.609   5.661  10.513
  188   HD22  LEU  25          HD22      LEU  25  43.201   5.194  12.181
  189   HD23  LEU  25          HD23      LEU  25  42.159   6.331  11.299
  Start of MODEL   40
    1    H1   GLY   1           HT1      GLY   1  65.908  22.207  -8.792
    2    H2   GLY   1           HT2      GLY   1  66.745  23.308  -7.804
    3    H3   GLY   1           HT3      GLY   1  65.329  23.789  -8.611
    4    HA2  GLY   1           HA1      GLY   1  65.581  22.768  -6.076
    5    HA3  GLY   1           HA2      GLY   1  64.095  23.166  -6.959
    6    H    TRP   2           HN       TRP   2  64.009  21.166  -5.128
    7    HA   TRP   2           HA       TRP   2  64.635  18.561  -6.120
    8    HB2  TRP   2           HB2      TRP   2  62.289  19.285  -4.330
    9    HB3  TRP   2           HB1      TRP   2  63.160  17.736  -4.409
   10    HD1  TRP   2           HD1      TRP   2  65.658  17.680  -3.435
   11    HE1  TRP   2           HE1      TRP   2  66.862  19.136  -1.648
   12    HE3  TRP   2           HE3      TRP   2  62.442  21.662  -3.338
   13    HZ2  TRP   2           HZ2      TRP   2  66.455  21.684  -0.369
   14    HZ3  TRP   2           HZ3      TRP   2  62.869  23.595  -1.827
   15    HH2  TRP   2           HH2      TRP   2  64.871  23.610  -0.344
   16    H    GLY   3           HN       GLY   3  61.984  20.780  -6.764
   17    HA2  GLY   3           HA1      GLY   3  60.322  20.676  -8.373
   18    HA3  GLY   3           HA2      GLY   3  61.186  19.309  -9.103
   19    H    SER   4           HN       SER   4  60.715  18.576  -5.900
   20    HA   SER   4           HA       SER   4  58.643  16.619  -6.557
   21    HB2  SER   4           HB2      SER   4  59.865  17.387  -3.878
   22    HB3  SER   4           HB1      SER   4  58.875  15.946  -4.203
   23    HG   SER   4           HG       SER   4  61.476  16.215  -4.493
   24    H    ILE   5           HN       ILE   5  56.567  17.135  -6.732
   25    HA   ILE   5           HA       ILE   5  55.483  19.540  -5.472
   26    HB   ILE   5           HB       ILE   5  53.894  17.262  -6.727
   27   HG12  ILE   5          HG12      ILE   5  55.287  19.625  -8.071
   28   HG13  ILE   5          HG11      ILE   5  55.707  17.908  -8.270
   29   HG21  ILE   5          HG21      ILE   5  52.768  19.190  -5.438
   30   HG22  ILE   5          HG22      ILE   5  52.228  18.941  -7.113
   31   HG23  ILE   5          HG23      ILE   5  53.359  20.262  -6.729
   32   HD11  ILE   5           HD1      ILE   5  54.361  18.392 -10.165
   33   HD12  ILE   5           HD2      ILE   5  53.218  19.370  -9.214
   34   HD13  ILE   5           HD3      ILE   5  53.235  17.596  -9.039
   35    H    PHE   6           HN       PHE   6  56.339  18.654  -3.293
   36    HA   PHE   6           HA       PHE   6  55.817  17.850  -1.183
   37    HB2  PHE   6           HB2      PHE   6  52.931  17.832  -2.134
   38    HB3  PHE   6           HB1      PHE   6  53.529  17.993  -0.466
   39    HD1  PHE   6           HD1      PHE   6  52.277  19.840  -3.197
   40    HD2  PHE   6           HD2      PHE   6  55.377  19.965  -0.192
   41    HE1  PHE   6           HE1      PHE   6  52.430  22.312  -3.457
   42    HE2  PHE   6           HE2      PHE   6  55.528  22.436  -0.454
   43    HZ   PHE   6           HZ       PHE   6  54.008  23.617  -2.037
   44    H    LYS   7           HN       LYS   7  55.747  16.042  -3.829
   45    HA   LYS   7           HA       LYS   7  54.207  13.734  -3.151
   46    HB2  LYS   7           HB2      LYS   7  56.762  14.048  -4.774
   47    HB3  LYS   7           HB1      LYS   7  55.826  12.536  -4.676
   48    HG2  LYS   7           HG2      LYS   7  53.803  13.808  -5.483
   49    HG3  LYS   7           HG1      LYS   7  54.850  15.227  -5.724
   50    HD2  LYS   7           HD2      LYS   7  56.235  13.987  -7.318
   51    HD3  LYS   7           HD1      LYS   7  55.299  12.503  -7.019
   52    HE2  LYS   7           HE2      LYS   7  54.438  13.463  -9.055
   53    HE3  LYS   7           HE1      LYS   7  53.231  13.787  -7.788
   54    HZ1  LYS   7           HZ1      LYS   7  53.516  15.960  -8.044
   55    HZ2  LYS   7           HZ2      LYS   7  54.473  15.637  -9.410
   56    HZ3  LYS   7           HZ3      LYS   7  55.201  15.842  -7.889
   57    H    HIS   8           HN       HIS   8  57.449  14.813  -2.212
   58    HA   HIS   8           HA       HIS   8  58.218  12.298  -0.991
   59    HB2  HIS   8           HB2      HIS   8  60.015  13.642   0.057
   60    HB3  HIS   8           HB1      HIS   8  59.878  13.977  -1.685
   61    HD1  HIS   8           HD1      HIS   8  58.288  16.154  -2.291
   62    HD2  HIS   8           HD2      HIS   8  59.779  15.910   1.634
   63    HE1  HIS   8           HE1      HIS   8  58.129  18.490  -1.270
   64    H    GLY   9           HN       GLY   9  55.703  14.223  -0.235
   65    HA2  GLY   9           HA1      GLY   9  55.502  13.143   2.453
   66    HA3  GLY   9           HA2      GLY   9  55.844  14.884   2.462
   67    H    ARG  10           HN       ARG  10  53.914  13.051   0.093
   68    HA   ARG  10           HA       ARG  10  51.377  13.868   1.263
   69    HB2  ARG  10           HB2      ARG  10  52.382  16.003   0.151
   70    HB3  ARG  10           HB1      ARG  10  52.018  15.200  -1.393
   71    HG2  ARG  10           HG2      ARG  10  49.631  14.912  -0.594
   72    HG3  ARG  10           HG1      ARG  10  50.045  15.900   0.827
   73    HD2  ARG  10           HD2      ARG  10  49.018  17.291  -0.943
   74    HD3  ARG  10           HD1      ARG  10  50.710  17.766  -0.661
   75    HE   ARG  10           HE       ARG  10  51.180  17.087  -2.870
   76   HH11  ARG  10          HH11      ARG  10  48.330  17.479  -3.627
   77   HH12  ARG  10          HH12      ARG  10  47.904  15.940  -4.295
   78   HH21  ARG  10          HH21      ARG  10  50.620  14.289  -2.907
   79   HH22  ARG  10          HH22      ARG  10  49.200  14.132  -3.886
   80    H    HIS  11           HN       HIS  11  52.482  11.420   0.528
   81    HA   HIS  11           HA       HIS  11  50.377  10.382  -1.126
   82    HB2  HIS  11           HB2      HIS  11  51.724  11.384  -2.962
   83    HB3  HIS  11           HB1      HIS  11  53.139  10.455  -2.412
   84    HD1  HIS  11           HD1      HIS  11  52.858   7.758  -2.444
   85    HD2  HIS  11           HD2      HIS  11  50.093   9.973  -4.706
   86    HE1  HIS  11           HE1      HIS  11  51.712   6.134  -4.049
   87    H    ALA  12           HN       ALA  12  50.151   8.333  -1.074
   88    HA   ALA  12           HA       ALA  12  50.344   6.156  -0.378
   89    HB1  ALA  12           HB1      ALA  12  52.966   6.919   0.630
   90    HB2  ALA  12           HB2      ALA  12  52.747   6.535  -1.080
   91    HB3  ALA  12           HB3      ALA  12  52.458   5.303   0.175
   92    H    ALA  13           HN       ALA  13  51.680   8.809   1.517
   93    HA   ALA  13           HA       ALA  13  51.037   7.578   4.093
   94    HB1  ALA  13           HB1      ALA  13  50.873   9.957   4.852
   95    HB2  ALA  13           HB2      ALA  13  51.004  10.514   3.166
   96    HB3  ALA  13           HB3      ALA  13  52.393   9.728   3.954
   97    H    LYS  14           HN       LYS  14  50.147   7.900   1.053
   98    HA   LYS  14           HA       LYS  14  47.090   8.256   1.620
   99    HB2  LYS  14           HB2      LYS  14  48.502   9.756   0.002
  100    HB3  LYS  14           HB1      LYS  14  48.652   8.258  -0.988
  101    HG2  LYS  14           HG2      LYS  14  46.466   8.447  -1.762
  102    HG3  LYS  14           HG1      LYS  14  45.827   8.975  -0.189
  103    HD2  LYS  14           HD2      LYS  14  46.744  11.255  -0.601
  104    HD3  LYS  14           HD1      LYS  14  47.340  10.714  -2.189
  105    HE2  LYS  14           HE2      LYS  14  44.418  10.502  -1.362
  106    HE3  LYS  14           HE1      LYS  14  45.082  11.917  -2.212
  107    HZ1  LYS  14           HZ1      LYS  14  44.979   9.103  -3.162
  108    HZ2  LYS  14           HZ2      LYS  14  45.926  10.297  -3.914
  109    HZ3  LYS  14           HZ3      LYS  14  44.236  10.464  -3.851
  110    H    HIS  15           HN       HIS  15  46.086   7.213  -0.575
  111    HA   HIS  15           HA       HIS  15  45.202   5.131  -1.190
  112    HB2  HIS  15           HB2      HIS  15  48.107   5.000  -2.073
  113    HB3  HIS  15           HB1      HIS  15  46.808   3.950  -2.690
  114    HD1  HIS  15           HD1      HIS  15  44.496   5.912  -3.021
  115    HD2  HIS  15           HD2      HIS  15  48.441   6.749  -4.211
  116    HE1  HIS  15           HE1      HIS  15  44.387   7.779  -4.762
  117    H    ILE  16           HN       ILE  16  46.641   5.206   1.532
  118    HA   ILE  16           HA       ILE  16  46.123   2.697   2.338
  119    HB   ILE  16           HB       ILE  16  47.813   1.620   1.061
  120   HG12  ILE  16          HG12      ILE  16  49.188   2.135   3.730
  121   HG13  ILE  16          HG11      ILE  16  47.756   1.095   3.576
  122   HG21  ILE  16          HG21      ILE  16  50.229   2.481   1.161
  123   HG22  ILE  16          HG22      ILE  16  49.595   3.926   1.952
  124   HG23  ILE  16          HG23      ILE  16  49.115   3.552   0.287
  125   HD11  ILE  16           HD1      ILE  16  50.569   0.641   2.545
  126   HD12  ILE  16           HD2      ILE  16  49.206  -0.107   1.681
  127   HD13  ILE  16           HD3      ILE  16  49.486  -0.481   3.394
  128    H    GLY  17           HN       GLY  17  48.314   5.174   2.563
  129    HA2  GLY  17           HA1      GLY  17  48.368   5.101   5.503
  130    HA3  GLY  17           HA2      GLY  17  49.035   6.380   4.468
  131    H    HIS  18           HN       HIS  18  46.377   5.958   2.876
  132    HA   HIS  18           HA       HIS  18  44.847   8.021   4.440
  133    HB2  HIS  18           HB2      HIS  18  45.022   7.133   1.593
  134    HB3  HIS  18           HB1      HIS  18  43.369   7.489   2.127
  135    HD1  HIS  18           HD1      HIS  18  43.340   9.616   0.583
  136    HD2  HIS  18           HD2      HIS  18  46.294   9.696   3.573
  137    HE1  HIS  18           HE1      HIS  18  44.167  12.025   0.773
  138    H    ALA  19           HN       ALA  19  44.412   4.745   2.983
  139    HA   ALA  19           HA       ALA  19  43.034   3.559   5.089
  140    HB1  ALA  19           HB1      ALA  19  41.210   5.040   5.195
  141    HB2  ALA  19           HB2      ALA  19  40.582   3.781   4.115
  142    HB3  ALA  19           HB3      ALA  19  41.200   5.305   3.436
  143    H    ALA  20           HN       ALA  20  44.455   3.494   2.273
  144    HA   ALA  20           HA       ALA  20  44.662   1.919   0.580
  145    HB1  ALA  20           HB1      ALA  20  44.667   0.410   2.649
  146    HB2  ALA  20           HB2      ALA  20  44.216  -0.359   1.109
  147    HB3  ALA  20           HB3      ALA  20  42.957   0.079   2.289
  148    H    VAL  21           HN       VAL  21  42.077   3.589   1.230
  149    HA   VAL  21           HA       VAL  21  40.530   2.525  -1.107
  150    HB   VAL  21           HB       VAL  21  39.346   3.296   1.602
  151   HG11  VAL  21          HG11      VAL  21  37.804   4.111  -0.013
  152   HG12  VAL  21          HG12      VAL  21  37.187   2.490   0.373
  153   HG13  VAL  21          HG13      VAL  21  38.110   2.758  -1.126
  154   HG21  VAL  21          HG21      VAL  21  38.527   0.946   1.586
  155   HG22  VAL  21          HG22      VAL  21  40.304   1.015   1.529
  156   HG23  VAL  21          HG23      VAL  21  39.380   0.665   0.050
  157    H    ASN  22           HN       ASN  22  42.015   4.980   0.637
  158    HA   ASN  22           HA       ASN  22  42.459   7.126  -0.390
  159    HB2  ASN  22           HB2      ASN  22  40.803   6.702  -2.282
  160    HB3  ASN  22           HB1      ASN  22  39.526   7.282  -1.175
  161   HD21  ASN  22          HD21      ASN  22  40.628   8.534  -3.735
  162   HD22  ASN  22          HD22      ASN  22  41.141  10.149  -3.234
  163    H    HIS  23           HN       HIS  23  39.552   6.181   1.354
  164    HA   HIS  23           HA       HIS  23  38.822   6.902   3.444
  165    HB2  HIS  23           HB2      HIS  23  41.367   7.639   3.725
  166    HB3  HIS  23           HB1      HIS  23  40.717   9.275   3.488
  167    HD1  HIS  23           HD1      HIS  23  39.727   6.178   5.571
  168    HD2  HIS  23           HD2      HIS  23  40.049  10.357   5.922
  169    HE1  HIS  23           HE1      HIS  23  39.018   6.801   7.946
  170    H    TYR  24           HN       TYR  24  37.836   7.706   0.857
  171    HA   TYR  24           HA       TYR  24  37.243  10.447   0.610
  172    HB2  TYR  24           HB2      TYR  24  36.702   8.614  -1.041
  173    HB3  TYR  24           HB1      TYR  24  35.326   8.167  -0.005
  174    HD1  TYR  24           HD1      TYR  24  36.716  10.722  -2.289
  175    HD2  TYR  24           HD2      TYR  24  33.393   9.668   0.256
  176    HE1  TYR  24           HE1      TYR  24  35.347  12.524  -3.332
  177    HE2  TYR  24           HE2      TYR  24  32.024  11.470  -0.787
  178    HH   TYR  24           HH       TYR  24  32.008  12.879  -2.870
  179    H    LEU  25           HN       LEU  25  35.860   8.006   2.755
  180    HA   LEU  25           HA       LEU  25  33.512   9.448   3.509
  181    HB2  LEU  25           HB2      LEU  25  33.733   7.110   4.073
  182    HB3  LEU  25           HB1      LEU  25  35.223   7.412   4.991
  183    HG   LEU  25           HG       LEU  25  34.010   8.621   6.710
  184   HD11  LEU  25          HD11      LEU  25  31.422   8.734   6.476
  185   HD12  LEU  25          HD12      LEU  25  31.696   8.445   4.740
  186   HD13  LEU  25          HD13      LEU  25  32.379   9.891   5.523
  187   HD21  LEU  25          HD21      LEU  25  32.383   6.166   5.916
  188   HD22  LEU  25          HD22      LEU  25  32.549   6.851   7.551
  189   HD23  LEU  25          HD23      LEU  25  33.955   6.111   6.749
  Start of MODEL   41
    1    H1   GLY   1           HT1      GLY   1  60.666  17.034   2.947
    2    H2   GLY   1           HT2      GLY   1  60.816  18.178   4.196
    3    H3   GLY   1           HT3      GLY   1  60.059  16.684   4.490
    4    HA2  GLY   1           HA1      GLY   1  62.866  17.361   4.271
    5    HA3  GLY   1           HA2      GLY   1  62.044  16.236   5.369
    6    H    TRP   2           HN       TRP   2  64.061  15.001   4.656
    7    HA   TRP   2           HA       TRP   2  64.948  13.222   3.467
    8    HB2  TRP   2           HB2      TRP   2  62.643  12.312   4.063
    9    HB3  TRP   2           HB1      TRP   2  62.123  12.783   2.429
   10    HD1  TRP   2           HD1      TRP   2  62.454  11.013   0.639
   11    HE1  TRP   2           HE1      TRP   2  63.893   8.868   0.335
   12    HE3  TRP   2           HE3      TRP   2  65.215  11.276   4.942
   13    HZ2  TRP   2           HZ2      TRP   2  65.959   7.482   1.784
   14    HZ3  TRP   2           HZ3      TRP   2  66.915   9.532   5.462
   15    HH2  TRP   2           HH2      TRP   2  67.289   7.637   3.888
   16    H    GLY   3           HN       GLY   3  64.126  15.978   2.117
   17    HA2  GLY   3           HA1      GLY   3  64.820  16.909   0.099
   18    HA3  GLY   3           HA2      GLY   3  65.381  15.311  -0.433
   19    H    SER   4           HN       SER   4  62.324  14.769   0.610
   20    HA   SER   4           HA       SER   4  61.253  14.286  -1.965
   21    HB2  SER   4           HB2      SER   4  59.170  13.916  -0.870
   22    HB3  SER   4           HB1      SER   4  60.416  13.454   0.310
   23    HG   SER   4           HG       SER   4  59.026  15.940   0.148
   24    H    ILE   5           HN       ILE   5  60.451  15.533  -3.524
   25    HA   ILE   5           HA       ILE   5  60.401  18.421  -3.169
   26    HB   ILE   5           HB       ILE   5  59.161  16.906  -5.504
   27   HG12  ILE   5          HG12      ILE   5  62.105  17.518  -4.969
   28   HG13  ILE   5          HG11      ILE   5  61.366  15.905  -5.088
   29   HG21  ILE   5          HG21      ILE   5  60.765  19.495  -5.493
   30   HG22  ILE   5          HG22      ILE   5  59.011  19.475  -5.193
   31   HG23  ILE   5          HG23      ILE   5  59.654  18.885  -6.744
   32   HD11  ILE   5           HD1      ILE   5  62.333  16.278  -7.229
   33   HD12  ILE   5           HD2      ILE   5  61.765  17.962  -7.286
   34   HD13  ILE   5           HD3      ILE   5  60.602  16.625  -7.459
   35    H    PHE   6           HN       PHE   6  57.879  15.947  -3.842
   36    HA   PHE   6           HA       PHE   6  55.958  17.404  -2.171
   37    HB2  PHE   6           HB2      PHE   6  55.700  17.380  -5.201
   38    HB3  PHE   6           HB1      PHE   6  54.280  17.540  -4.142
   39    HD1  PHE   6           HD1      PHE   6  54.583  19.331  -2.162
   40    HD2  PHE   6           HD2      PHE   6  56.754  19.383  -5.895
   41    HE1  PHE   6           HE1      PHE   6  55.035  21.761  -1.866
   42    HE2  PHE   6           HE2      PHE   6  57.208  21.814  -5.594
   43    HZ   PHE   6           HZ       PHE   6  56.366  22.998  -3.571
   44    H    LYS   7           HN       LYS   7  57.199  14.678  -3.727
   45    HA   LYS   7           HA       LYS   7  54.938  13.013  -4.046
   46    HB2  LYS   7           HB2      LYS   7  57.436  12.559  -4.590
   47    HB3  LYS   7           HB1      LYS   7  57.575  12.030  -2.900
   48    HG2  LYS   7           HG2      LYS   7  57.055   9.992  -3.936
   49    HG3  LYS   7           HG1      LYS   7  55.425  10.554  -3.503
   50    HD2  LYS   7           HD2      LYS   7  55.118  11.464  -5.785
   51    HD3  LYS   7           HD1      LYS   7  56.771  10.967  -6.216
   52    HE2  LYS   7           HE2      LYS   7  56.177   8.603  -5.786
   53    HE3  LYS   7           HE1      LYS   7  54.525   9.096  -5.342
   54    HZ1  LYS   7           HZ1      LYS   7  53.960   9.364  -7.474
   55    HZ2  LYS   7           HZ2      LYS   7  55.331   8.425  -7.833
   56    HZ3  LYS   7           HZ3      LYS   7  55.420  10.122  -7.889
   57    H    HIS   8           HN       HIS   8  57.170  12.858  -1.232
   58    HA   HIS   8           HA       HIS   8  55.015  11.692   0.414
   59    HB2  HIS   8           HB2      HIS   8  57.379  10.919   0.584
   60    HB3  HIS   8           HB1      HIS   8  57.842  12.535   1.172
   61    HD1  HIS   8           HD1      HIS   8  55.127   9.941   2.064
   62    HD2  HIS   8           HD2      HIS   8  57.861  12.542   3.922
   63    HE1  HIS   8           HE1      HIS   8  54.841   9.670   4.589
   64    H    GLY   9           HN       GLY   9  53.742  13.793  -0.062
   65    HA2  GLY   9           HA1      GLY   9  53.869  15.392   2.389
   66    HA3  GLY   9           HA2      GLY   9  54.297  16.301   0.926
   67    H    ARG  10           HN       ARG  10  52.445  14.467  -0.650
   68    HA   ARG  10           HA       ARG  10  49.776  15.194   0.400
   69    HB2  ARG  10           HB2      ARG  10  49.160  16.419  -1.690
   70    HB3  ARG  10           HB1      ARG  10  50.386  17.274  -0.724
   71    HG2  ARG  10           HG2      ARG  10  52.171  16.279  -2.171
   72    HG3  ARG  10           HG1      ARG  10  50.902  15.541  -3.179
   73    HD2  ARG  10           HD2      ARG  10  51.222  18.529  -2.655
   74    HD3  ARG  10           HD1      ARG  10  51.699  17.687  -4.148
   75    HE   ARG  10           HE       ARG  10  48.916  17.188  -3.516
   76   HH11  ARG  10          HH11      ARG  10  49.910  20.242  -3.496
   77   HH12  ARG  10          HH12      ARG  10  49.290  20.716  -5.043
   78   HH21  ARG  10          HH21      ARG  10  48.639  17.469  -6.072
   79   HH22  ARG  10          HH22      ARG  10  48.570  19.147  -6.501
   80    H    HIS  11           HN       HIS  11  51.649  12.919  -0.641
   81    HA   HIS  11           HA       HIS  11  49.481  11.343  -1.735
   82    HB2  HIS  11           HB2      HIS  11  50.107  12.608  -3.790
   83    HB3  HIS  11           HB1      HIS  11  51.775  12.009  -3.621
   84    HD1  HIS  11           HD1      HIS  11  52.300   9.741  -4.575
   85    HD2  HIS  11           HD2      HIS  11  48.167  10.357  -4.106
   86    HE1  HIS  11           HE1      HIS  11  51.106   7.766  -5.671
   87    H    ALA  12           HN       ALA  12  49.765   9.302  -1.751
   88    HA   ALA  12           HA       ALA  12  50.598   7.244  -1.207
   89    HB1  ALA  12           HB1      ALA  12  53.135   8.610  -0.789
   90    HB2  ALA  12           HB2      ALA  12  52.617   8.166  -2.419
   91    HB3  ALA  12           HB3      ALA  12  52.925   6.915  -1.189
   92    H    ALA  13           HN       ALA  13  51.711  10.136   0.481
   93    HA   ALA  13           HA       ALA  13  51.972   8.775   3.062
   94    HB1  ALA  13           HB1      ALA  13  52.749  11.042   3.189
   95    HB2  ALA  13           HB2      ALA  13  51.075  11.188   3.776
   96    HB3  ALA  13           HB3      ALA  13  51.473  11.629   2.097
   97    H    LYS  14           HN       LYS  14  50.350   8.899   0.325
   98    HA   LYS  14           HA       LYS  14  47.512   8.543   1.589
   99    HB2  LYS  14           HB2      LYS  14  48.143  10.330  -0.217
  100    HB3  LYS  14           HB1      LYS  14  48.390   8.907  -1.297
  101    HG2  LYS  14           HG2      LYS  14  46.097   8.599  -1.553
  102    HG3  LYS  14           HG1      LYS  14  45.737   8.955   0.150
  103    HD2  LYS  14           HD2      LYS  14  46.005  11.386  -0.315
  104    HD3  LYS  14           HD1      LYS  14  46.324  11.010  -2.026
  105    HE2  LYS  14           HE2      LYS  14  43.786  10.199  -0.546
  106    HE3  LYS  14           HE1      LYS  14  43.928  11.654  -1.562
  107    HZ1  LYS  14           HZ1      LYS  14  44.942   9.570  -3.066
  108    HZ2  LYS  14           HZ2      LYS  14  43.455  10.363  -3.284
  109    HZ3  LYS  14           HZ3      LYS  14  43.539   8.949  -2.346
  110    H    HIS  15           HN       HIS  15  46.283   7.304  -0.382
  111    HA   HIS  15           HA       HIS  15  45.766   5.074  -0.884
  112    HB2  HIS  15           HB2      HIS  15  48.313   5.664  -2.434
  113    HB3  HIS  15           HB1      HIS  15  47.226   4.296  -2.776
  114    HD1  HIS  15           HD1      HIS  15  47.836   7.685  -3.804
  115    HD2  HIS  15           HD2      HIS  15  44.351   5.466  -3.026
  116    HE1  HIS  15           HE1      HIS  15  45.907   8.848  -5.009
  117    H    ILE  16           HN       ILE  16  47.717   5.464   1.438
  118    HA   ILE  16           HA       ILE  16  47.990   2.909   2.197
  119    HB   ILE  16           HB       ILE  16  49.542   2.255   0.518
  120   HG12  ILE  16          HG12      ILE  16  51.384   3.051   2.807
  121   HG13  ILE  16          HG11      ILE  16  50.171   1.766   2.993
  122   HG21  ILE  16          HG21      ILE  16  51.669   3.649   0.143
  123   HG22  ILE  16          HG22      ILE  16  50.915   4.904   1.127
  124   HG23  ILE  16          HG23      ILE  16  50.175   4.433  -0.413
  125   HD11  ILE  16           HD1      ILE  16  52.105   0.572   2.359
  126   HD12  ILE  16           HD2      ILE  16  52.624   1.819   1.207
  127   HD13  ILE  16           HD3      ILE  16  51.253   0.757   0.811
  128    H    GLY  17           HN       GLY  17  49.547   5.831   2.067
  129    HA2  GLY  17           HA1      GLY  17  50.286   5.762   4.915
  130    HA3  GLY  17           HA2      GLY  17  50.404   7.162   3.829
  131    H    HIS  18           HN       HIS  18  47.611   6.138   2.841
  132    HA   HIS  18           HA       HIS  18  46.056   7.788   4.823
  133    HB2  HIS  18           HB2      HIS  18  45.774   7.001   1.951
  134    HB3  HIS  18           HB1      HIS  18  44.248   6.990   2.855
  135    HD1  HIS  18           HD1      HIS  18  43.442   9.086   1.479
  136    HD2  HIS  18           HD2      HIS  18  46.903   9.746   3.774
  137    HE1  HIS  18           HE1      HIS  18  43.783  11.612   1.636
  138    H    ALA  19           HN       ALA  19  46.040   4.518   3.284
  139    HA   ALA  19           HA       ALA  19  45.440   3.023   5.552
  140    HB1  ALA  19           HB1      ALA  19  42.839   2.711   5.109
  141    HB2  ALA  19           HB2      ALA  19  42.965   4.355   4.438
  142    HB3  ALA  19           HB3      ALA  19  43.408   4.045   6.135
  143    H    ALA  20           HN       ALA  20  46.221   3.299   2.516
  144    HA   ALA  20           HA       ALA  20  46.367   1.843   0.714
  145    HB1  ALA  20           HB1      ALA  20  45.577  -0.320   2.695
  146    HB2  ALA  20           HB2      ALA  20  47.222   0.346   2.562
  147    HB3  ALA  20           HB3      ALA  20  46.495  -0.514   1.185
  148    H    VAL  21           HN       VAL  21  43.691   2.868   2.001
  149    HA   VAL  21           HA       VAL  21  41.939   1.495  -0.005
  150    HB   VAL  21           HB       VAL  21  41.259   1.925   2.943
  151   HG11  VAL  21          HG11      VAL  21  39.104   0.672   2.160
  152   HG12  VAL  21          HG12      VAL  21  39.578   1.174   0.519
  153   HG13  VAL  21          HG13      VAL  21  39.247   2.400   1.769
  154   HG21  VAL  21          HG21      VAL  21  40.987  -0.552   2.934
  155   HG22  VAL  21          HG22      VAL  21  42.646  -0.077   2.501
  156   HG23  VAL  21          HG23      VAL  21  41.510  -0.595   1.233
  157    H    ASN  22           HN       ASN  22  43.186   4.207   1.538
  158    HA   ASN  22           HA       ASN  22  42.898   6.414   0.596
  159    HB2  ASN  22           HB2      ASN  22  41.015   5.631  -0.943
  160    HB3  ASN  22           HB1      ASN  22  39.906   5.893   0.432
  161   HD21  ASN  22          HD21      ASN  22  41.335   7.415  -2.271
  162   HD22  ASN  22          HD22      ASN  22  41.058   9.087  -1.774
  163    H    HIS  23           HN       HIS  23  40.713   4.779   2.823
  164    HA   HIS  23           HA       HIS  23  40.340   5.264   5.073
  165    HB2  HIS  23           HB2      HIS  23  42.601   6.653   4.844
  166    HB3  HIS  23           HB1      HIS  23  41.512   8.056   4.859
  167    HD1  HIS  23           HD1      HIS  23  39.511   6.114   6.816
  168    HD2  HIS  23           HD2      HIS  23  43.406   7.535   7.521
  169    HE1  HIS  23           HE1      HIS  23  39.861   6.156   9.347
  170    H    TYR  24           HN       TYR  24  39.227   6.735   2.351
  171    HA   TYR  24           HA       TYR  24  37.499   8.766   3.551
  172    HB2  TYR  24           HB2      TYR  24  38.246   8.914   1.204
  173    HB3  TYR  24           HB1      TYR  24  37.384   7.403   0.830
  174    HD1  TYR  24           HD1      TYR  24  34.989   7.369   0.525
  175    HD2  TYR  24           HD2      TYR  24  36.957  10.948   1.924
  176    HE1  TYR  24           HE1      TYR  24  32.888   8.663   0.174
  177    HE2  TYR  24           HE2      TYR  24  34.855  12.240   1.573
  178    HH   TYR  24           HH       TYR  24  32.746  12.170   0.747
  179    H    LEU  25           HN       LEU  25  37.488   5.398   3.556
  180    HA   LEU  25           HA       LEU  25  35.850   3.821   4.022
  181    HB2  LEU  25           HB2      LEU  25  34.224   6.083   5.232
  182    HB3  LEU  25           HB1      LEU  25  34.327   4.383   5.751
  183    HG   LEU  25           HG       LEU  25  36.541   6.475   5.922
  184   HD11  LEU  25          HD11      LEU  25  34.678   6.622   7.607
  185   HD12  LEU  25          HD12      LEU  25  36.256   6.232   8.335
  186   HD13  LEU  25          HD13      LEU  25  35.042   4.951   8.098
  187   HD21  LEU  25          HD21      LEU  25  37.691   4.563   7.231
  188   HD22  LEU  25          HD22      LEU  25  37.628   4.389   5.462
  189   HD23  LEU  25          HD23      LEU  25  36.489   3.480   6.487
  Start of MODEL   42
    1    H1   GLY   1           HT1      GLY   1  69.323  19.893  -6.474
    2    H2   GLY   1           HT2      GLY   1  68.146  20.468  -7.556
    3    H3   GLY   1           HT3      GLY   1  67.936  18.969  -6.783
    4    HA2  GLY   1           HA1      GLY   1  68.358  20.975  -4.875
    5    HA3  GLY   1           HA2      GLY   1  67.046  21.436  -5.978
    6    H    TRP   2           HN       TRP   2  65.100  20.853  -5.330
    7    HA   TRP   2           HA       TRP   2  64.707  18.997  -3.158
    8    HB2  TRP   2           HB2      TRP   2  62.785  20.205  -5.185
    9    HB3  TRP   2           HB1      TRP   2  62.274  19.221  -3.792
   10    HD1  TRP   2           HD1      TRP   2  62.766  20.217  -1.343
   11    HE1  TRP   2           HE1      TRP   2  63.040  22.659  -0.486
   12    HE3  TRP   2           HE3      TRP   2  63.637  22.550  -5.815
   13    HZ2  TRP   2           HZ2      TRP   2  63.567  25.253  -1.619
   14    HZ3  TRP   2           HZ3      TRP   2  64.024  25.009  -5.904
   15    HH2  TRP   2           HH2      TRP   2  63.988  26.361  -3.812
   16    H    GLY   3           HN       GLY   3  63.656  18.782  -6.595
   17    HA2  GLY   3           HA1      GLY   3  63.611  16.929  -7.998
   18    HA3  GLY   3           HA2      GLY   3  64.526  16.013  -6.785
   19    H    SER   4           HN       SER   4  61.694  17.585  -5.625
   20    HA   SER   4           HA       SER   4  59.817  15.458  -6.269
   21    HB2  SER   4           HB2      SER   4  59.568  14.653  -3.896
   22    HB3  SER   4           HB1      SER   4  61.094  14.169  -4.670
   23    HG   SER   4           HG       SER   4  60.817  15.452  -2.420
   24    H    ILE   5           HN       ILE   5  58.272  16.936  -6.735
   25    HA   ILE   5           HA       ILE   5  57.820  19.313  -5.167
   26    HB   ILE   5           HB       ILE   5  55.748  17.915  -6.912
   27   HG12  ILE   5          HG12      ILE   5  58.065  19.732  -7.726
   28   HG13  ILE   5          HG11      ILE   5  57.868  18.019  -8.160
   29   HG21  ILE   5          HG21      ILE   5  56.290  20.886  -6.509
   30   HG22  ILE   5          HG22      ILE   5  55.184  19.969  -5.458
   31   HG23  ILE   5          HG23      ILE   5  54.841  20.116  -7.196
   32   HD11  ILE   5           HD1      ILE   5  55.591  18.748  -9.197
   33   HD12  ILE   5           HD2      ILE   5  57.079  19.189 -10.068
   34   HD13  ILE   5           HD3      ILE   5  56.233  20.404  -9.084
   35    H    PHE   6           HN       PHE   6  57.883  18.281  -3.012
   36    HA   PHE   6           HA       PHE   6  56.822  17.468  -1.115
   37    HB2  PHE   6           HB2      PHE   6  54.421  18.579  -2.617
   38    HB3  PHE   6           HB1      PHE   6  54.385  18.055  -0.918
   39    HD1  PHE   6           HD1      PHE   6  55.245  20.749  -3.195
   40    HD2  PHE   6           HD2      PHE   6  56.024  19.136   0.733
   41    HE1  PHE   6           HE1      PHE   6  56.167  22.948  -2.475
   42    HE2  PHE   6           HE2      PHE   6  56.945  21.336   1.453
   43    HZ   PHE   6           HZ       PHE   6  56.951  23.261  -0.129
   44    H    LYS   7           HN       LYS   7  56.776  15.894  -3.879
   45    HA   LYS   7           HA       LYS   7  54.572  14.129  -3.864
   46    HB2  LYS   7           HB2      LYS   7  57.480  13.577  -4.582
   47    HB3  LYS   7           HB1      LYS   7  56.108  12.523  -5.000
   48    HG2  LYS   7           HG2      LYS   7  55.049  14.425  -6.224
   49    HG3  LYS   7           HG1      LYS   7  56.476  15.426  -5.861
   50    HD2  LYS   7           HD2      LYS   7  57.897  13.659  -7.000
   51    HD3  LYS   7           HD1      LYS   7  56.387  12.875  -7.522
   52    HE2  LYS   7           HE2      LYS   7  57.422  15.635  -8.260
   53    HE3  LYS   7           HE1      LYS   7  57.023  14.281  -9.345
   54    HZ1  LYS   7           HZ1      LYS   7  55.249  15.861  -9.403
   55    HZ2  LYS   7           HZ2      LYS   7  55.125  15.890  -7.708
   56    HZ3  LYS   7           HZ3      LYS   7  54.691  14.491  -8.571
   57    H    HIS   8           HN       HIS   8  57.750  13.776  -2.230
   58    HA   HIS   8           HA       HIS   8  56.883  11.345  -0.843
   59    HB2  HIS   8           HB2      HIS   8  59.063  11.523   0.296
   60    HB3  HIS   8           HB1      HIS   8  59.246  11.717  -1.463
   61    HD1  HIS   8           HD1      HIS   8  61.524  12.916  -0.062
   62    HD2  HIS   8           HD2      HIS   8  57.923  15.034  -0.549
   63    HE1  HIS   8           HE1      HIS   8  62.054  15.397   0.234
   64    H    GLY   9           HN       GLY   9  55.000  13.315  -0.362
   65    HA2  GLY   9           HA1      GLY   9  54.955  13.317   2.516
   66    HA3  GLY   9           HA2      GLY   9  55.382  14.930   1.910
   67    H    ARG  10           HN       ARG  10  53.499  13.234  -0.329
   68    HA   ARG  10           HA       ARG  10  50.893  14.125   0.816
   69    HB2  ARG  10           HB2      ARG  10  51.985  15.109  -1.855
   70    HB3  ARG  10           HB1      ARG  10  50.321  15.348  -1.269
   71    HG2  ARG  10           HG2      ARG  10  51.314  16.485   0.780
   72    HG3  ARG  10           HG1      ARG  10  52.892  16.427  -0.042
   73    HD2  ARG  10           HD2      ARG  10  51.898  18.594  -0.497
   74    HD3  ARG  10           HD1      ARG  10  51.834  17.636  -1.995
   75    HE   ARG  10           HE       ARG  10  49.403  17.309  -0.459
   76   HH11  ARG  10          HH11      ARG  10  48.070  19.350  -0.437
   77   HH12  ARG  10          HH12      ARG  10  48.012  20.185  -1.953
   78   HH21  ARG  10          HH21      ARG  10  50.670  18.427  -3.323
   79   HH22  ARG  10          HH22      ARG  10  49.485  19.663  -3.587
   80    H    HIS  11           HN       HIS  11  52.495  11.645  -0.094
   81    HA   HIS  11           HA       HIS  11  50.175  10.352  -1.382
   82    HB2  HIS  11           HB2      HIS  11  52.892  10.513  -2.745
   83    HB3  HIS  11           HB1      HIS  11  51.617   9.356  -3.194
   84    HD1  HIS  11           HD1      HIS  11  52.167  13.144  -2.874
   85    HD2  HIS  11           HD2      HIS  11  49.699  10.409  -4.904
   86    HE1  HIS  11           HE1      HIS  11  50.760  14.478  -4.537
   87    H    ALA  12           HN       ALA  12  50.048   8.292  -1.222
   88    HA   ALA  12           HA       ALA  12  50.308   6.192  -0.361
   89    HB1  ALA  12           HB1      ALA  12  52.887   7.123   0.614
   90    HB2  ALA  12           HB2      ALA  12  52.702   6.611  -1.067
   91    HB3  ALA  12           HB3      ALA  12  52.449   5.460   0.270
   92    H    ALA  13           HN       ALA  13  51.537   9.007   1.377
   93    HA   ALA  13           HA       ALA  13  50.911   7.910   4.018
   94    HB1  ALA  13           HB1      ALA  13  52.182  10.070   3.851
   95    HB2  ALA  13           HB2      ALA  13  50.586  10.360   4.583
   96    HB3  ALA  13           HB3      ALA  13  50.869  10.768   2.874
   97    H    LYS  14           HN       LYS  14  50.032   8.018   0.962
   98    HA   LYS  14           HA       LYS  14  46.962   8.305   1.490
   99    HB2  LYS  14           HB2      LYS  14  48.338   9.750  -0.205
  100    HB3  LYS  14           HB1      LYS  14  48.550   8.197  -1.098
  101    HG2  LYS  14           HG2      LYS  14  46.366   8.253  -1.896
  102    HG3  LYS  14           HG1      LYS  14  45.696   8.883  -0.375
  103    HD2  LYS  14           HD2      LYS  14  46.507  11.148  -0.946
  104    HD3  LYS  14           HD1      LYS  14  47.215  10.520  -2.454
  105    HE2  LYS  14           HE2      LYS  14  44.262  10.246  -1.765
  106    HE3  LYS  14           HE1      LYS  14  44.920  11.606  -2.706
  107    HZ1  LYS  14           HZ1      LYS  14  44.603   8.802  -3.451
  108    HZ2  LYS  14           HZ2      LYS  14  46.013   9.573  -4.003
  109    HZ3  LYS  14           HZ3      LYS  14  44.486  10.201  -4.403
  110    H    HIS  15           HN       HIS  15  46.011   7.104  -0.643
  111    HA   HIS  15           HA       HIS  15  45.195   4.958  -1.137
  112    HB2  HIS  15           HB2      HIS  15  46.873   5.609  -2.878
  113    HB3  HIS  15           HB1      HIS  15  48.105   4.695  -1.976
  114    HD1  HIS  15           HD1      HIS  15  44.665   4.148  -3.598
  115    HD2  HIS  15           HD2      HIS  15  48.179   2.029  -2.693
  116    HE1  HIS  15           HE1      HIS  15  44.390   1.785  -4.529
  117    H    ILE  16           HN       ILE  16  46.559   5.233   1.583
  118    HA   ILE  16           HA       ILE  16  46.162   2.763   2.524
  119    HB   ILE  16           HB       ILE  16  47.904   1.661   1.342
  120   HG12  ILE  16          HG12      ILE  16  49.463   2.333   3.859
  121   HG13  ILE  16          HG11      ILE  16  47.902   1.507   4.015
  122   HG21  ILE  16          HG21      ILE  16  49.596   4.095   2.058
  123   HG22  ILE  16          HG22      ILE  16  49.136   3.578   0.427
  124   HG23  ILE  16          HG23      ILE  16  50.287   2.622   1.378
  125   HD11  ILE  16           HD1      ILE  16  48.724  -0.260   2.419
  126   HD12  ILE  16           HD2      ILE  16  49.670  -0.167   3.922
  127   HD13  ILE  16           HD3      ILE  16  50.316   0.535   2.422
  128    H    GLY  17           HN       GLY  17  48.290   5.300   2.614
  129    HA2  GLY  17           HA1      GLY  17  48.310   5.422   5.550
  130    HA3  GLY  17           HA2      GLY  17  48.954   6.648   4.439
  131    H    HIS  18           HN       HIS  18  46.307   6.055   2.858
  132    HA   HIS  18           HA       HIS  18  44.734   8.182   4.283
  133    HB2  HIS  18           HB2      HIS  18  44.949   7.141   1.498
  134    HB3  HIS  18           HB1      HIS  18  43.281   7.464   1.999
  135    HD1  HIS  18           HD1      HIS  18  43.138   9.512   0.381
  136    HD2  HIS  18           HD2      HIS  18  46.125   9.853   3.319
  137    HE1  HIS  18           HE1      HIS  18  43.871  11.958   0.440
  138    H    ALA  19           HN       ALA  19  44.404   4.753   3.139
  139    HA   ALA  19           HA       ALA  19  42.634   4.175   5.387
  140    HB1  ALA  19           HB1      ALA  19  41.151   5.558   3.823
  141    HB2  ALA  19           HB2      ALA  19  40.534   3.957   4.295
  142    HB3  ALA  19           HB3      ALA  19  41.261   4.192   2.685
  143    H    ALA  20           HN       ALA  20  44.964   2.945   4.301
  144    HA   ALA  20           HA       ALA  20  45.679   0.786   3.860
  145    HB1  ALA  20           HB1      ALA  20  44.323  -1.031   4.417
  146    HB2  ALA  20           HB2      ALA  20  42.844  -0.257   3.803
  147    HB3  ALA  20           HB3      ALA  20  43.562   0.286   5.338
  148    H    VAL  21           HN       VAL  21  43.230   2.363   1.939
  149    HA   VAL  21           HA       VAL  21  44.398   1.098  -0.488
  150    HB   VAL  21           HB       VAL  21  41.385   1.104   0.006
  151   HG11  VAL  21          HG11      VAL  21  43.156   0.113  -2.272
  152   HG12  VAL  21          HG12      VAL  21  41.940   1.411  -2.344
  153   HG13  VAL  21          HG13      VAL  21  41.427  -0.276  -2.116
  154   HG21  VAL  21          HG21      VAL  21  41.710  -1.422  -0.072
  155   HG22  VAL  21          HG22      VAL  21  42.372  -0.634   1.378
  156   HG23  VAL  21          HG23      VAL  21  43.461  -1.131   0.060
  157    H    ASN  22           HN       ASN  22  42.374   3.519   1.094
  158    HA   ASN  22           HA       ASN  22  43.204   5.804  -0.103
  159    HB2  ASN  22           HB2      ASN  22  42.919   5.262  -2.380
  160    HB3  ASN  22           HB1      ASN  22  41.448   4.312  -2.076
  161   HD21  ASN  22          HD21      ASN  22  40.099   5.472  -3.581
  162   HD22  ASN  22          HD22      ASN  22  39.666   7.165  -3.327
  163    H    HIS  23           HN       HIS  23  40.117   3.997   0.188
  164    HA   HIS  23           HA       HIS  23  39.228   5.644   2.387
  165    HB2  HIS  23           HB2      HIS  23  38.912   7.314   0.593
  166    HB3  HIS  23           HB1      HIS  23  37.905   6.155  -0.308
  167    HD1  HIS  23           HD1      HIS  23  37.863   6.885   3.458
  168    HD2  HIS  23           HD2      HIS  23  35.350   7.156   0.096
  169    HE1  HIS  23           HE1      HIS  23  35.562   7.629   4.286
  170    H    TYR  24           HN       TYR  24  39.312   2.906   0.669
  171    HA   TYR  24           HA       TYR  24  36.542   2.026   0.824
  172    HB2  TYR  24           HB2      TYR  24  38.326   1.103  -0.730
  173    HB3  TYR  24           HB1      TYR  24  39.045   0.302   0.687
  174    HD1  TYR  24           HD1      TYR  24  38.075  -1.699   1.607
  175    HD2  TYR  24           HD2      TYR  24  35.946   0.560  -1.394
  176    HE1  TYR  24           HE1      TYR  24  36.427  -3.554   1.379
  177    HE2  TYR  24           HE2      TYR  24  34.299  -1.296  -1.621
  178    HH   TYR  24           HH       TYR  24  34.152  -3.611  -1.278
  179    H    LEU  25           HN       LEU  25  38.366   2.979   3.257
  180    HA   LEU  25           HA       LEU  25  36.973   1.315   5.193
  181    HB2  LEU  25           HB2      LEU  25  39.056  -0.049   4.315
  182    HB3  LEU  25           HB1      LEU  25  39.993   1.055   5.344
  183    HG   LEU  25           HG       LEU  25  37.661  -0.691   6.267
  184   HD11  LEU  25          HD11      LEU  25  39.751  -1.936   5.684
  185   HD12  LEU  25          HD12      LEU  25  39.384  -1.999   7.424
  186   HD13  LEU  25          HD13      LEU  25  40.653  -0.907   6.820
  187   HD21  LEU  25          HD21      LEU  25  38.677   0.022   8.570
  188   HD22  LEU  25          HD22      LEU  25  37.672   1.203   7.704
  189   HD23  LEU  25          HD23      LEU  25  39.446   1.345   7.660
  Start of MODEL   43
    1    H1   GLY   1           HT1      GLY   1  62.681  26.436   0.182
    2    H2   GLY   1           HT2      GLY   1  62.041  25.198  -0.789
    3    H3   GLY   1           HT3      GLY   1  62.470  24.882   0.825
    4    HA2  GLY   1           HA1      GLY   1  60.800  26.559   1.498
    5    HA3  GLY   1           HA2      GLY   1  60.257  26.527  -0.190
    6    H    TRP   2           HN       TRP   2  61.411  23.515   0.285
    7    HA   TRP   2           HA       TRP   2  59.147  22.385   1.798
    8    HB2  TRP   2           HB2      TRP   2  59.413  21.827  -1.185
    9    HB3  TRP   2           HB1      TRP   2  58.249  21.076  -0.067
   10    HD1  TRP   2           HD1      TRP   2  58.881  24.197  -2.087
   11    HE1  TRP   2           HE1      TRP   2  56.868  25.831  -1.883
   12    HE3  TRP   2           HE3      TRP   2  56.319  21.854   1.675
   13    HZ2  TRP   2           HZ2      TRP   2  54.481  26.060  -0.287
   14    HZ3  TRP   2           HZ3      TRP   2  54.177  22.799   2.522
   15    HH2  TRP   2           HH2      TRP   2  53.256  24.897   1.546
   16    H    GLY   3           HN       GLY   3  59.638  20.435   2.637
   17    HA2  GLY   3           HA1      GLY   3  62.377  19.499   2.320
   18    HA3  GLY   3           HA2      GLY   3  61.113  18.782   3.339
   19    H    SER   4           HN       SER   4  59.775  19.136   0.330
   20    HA   SER   4           HA       SER   4  60.983  16.809  -0.977
   21    HB2  SER   4           HB2      SER   4  58.250  16.553   0.334
   22    HB3  SER   4           HB1      SER   4  58.890  15.428  -0.885
   23    HG   SER   4           HG       SER   4  59.756  15.932   1.754
   24    H    ILE   5           HN       ILE   5  60.018  16.331  -3.037
   25    HA   ILE   5           HA       ILE   5  58.986  18.762  -4.311
   26    HB   ILE   5           HB       ILE   5  59.240  15.981  -5.536
   27   HG12  ILE   5          HG12      ILE   5  61.376  16.420  -4.521
   28   HG13  ILE   5          HG11      ILE   5  61.557  16.769  -6.250
   29   HG21  ILE   5          HG21      ILE   5  58.131  17.330  -7.105
   30   HG22  ILE   5          HG22      ILE   5  59.825  17.560  -7.580
   31   HG23  ILE   5          HG23      ILE   5  58.992  18.806  -6.627
   32   HD11  ILE   5           HD1      ILE   5  62.618  18.590  -5.137
   33   HD12  ILE   5           HD2      ILE   5  61.311  18.731  -3.941
   34   HD13  ILE   5           HD3      ILE   5  61.035  19.232  -5.624
   35    H    PHE   6           HN       PHE   6  57.125  18.349  -2.523
   36    HA   PHE   6           HA       PHE   6  54.923  17.723  -2.100
   37    HB2  PHE   6           HB2      PHE   6  53.378  18.240  -4.013
   38    HB3  PHE   6           HB1      PHE   6  54.543  19.533  -3.647
   39    HD1  PHE   6           HD1      PHE   6  56.282  20.141  -5.219
   40    HD2  PHE   6           HD2      PHE   6  53.728  16.746  -5.985
   41    HE1  PHE   6           HE1      PHE   6  57.123  20.036  -7.562
   42    HE2  PHE   6           HE2      PHE   6  54.572  16.640  -8.328
   43    HZ   PHE   6           HZ       PHE   6  56.219  18.327  -9.133
   44    H    LYS   7           HN       LYS   7  56.820  15.568  -3.216
   45    HA   LYS   7           HA       LYS   7  54.908  13.735  -4.554
   46    HB2  LYS   7           HB2      LYS   7  57.385  13.927  -5.134
   47    HB3  LYS   7           HB1      LYS   7  57.726  13.141  -3.576
   48    HG2  LYS   7           HG2      LYS   7  56.144  11.270  -4.311
   49    HG3  LYS   7           HG1      LYS   7  56.156  12.011  -5.928
   50    HD2  LYS   7           HD2      LYS   7  58.617  11.054  -4.396
   51    HD3  LYS   7           HD1      LYS   7  57.845  10.198  -5.750
   52    HE2  LYS   7           HE2      LYS   7  59.586  11.365  -6.826
   53    HE3  LYS   7           HE1      LYS   7  58.211  12.471  -7.053
   54    HZ1  LYS   7           HZ1      LYS   7  59.260  14.009  -5.871
   55    HZ2  LYS   7           HZ2      LYS   7  60.628  13.005  -5.800
   56    HZ3  LYS   7           HZ3      LYS   7  59.470  12.957  -4.557
   57    H    HIS   8           HN       HIS   8  56.993  13.654  -1.620
   58    HA   HIS   8           HA       HIS   8  55.115  11.636  -0.422
   59    HB2  HIS   8           HB2      HIS   8  57.585  11.143  -0.548
   60    HB3  HIS   8           HB1      HIS   8  57.863  12.524   0.540
   61    HD1  HIS   8           HD1      HIS   8  57.850  11.986   2.974
   62    HD2  HIS   8           HD2      HIS   8  55.620   9.209   0.736
   63    HE1  HIS   8           HE1      HIS   8  57.027  10.190   4.594
   64    H    GLY   9           HN       GLY   9  53.760  13.839  -0.401
   65    HA2  GLY   9           HA1      GLY   9  53.704  14.608   2.423
   66    HA3  GLY   9           HA2      GLY   9  54.186  15.929   1.339
   67    H    ARG  10           HN       ARG  10  52.456  14.537  -0.801
   68    HA   ARG  10           HA       ARG  10  49.742  15.266   0.267
   69    HB2  ARG  10           HB2      ARG  10  50.837  16.202  -2.417
   70    HB3  ARG  10           HB1      ARG  10  49.256  16.591  -1.700
   71    HG2  ARG  10           HG2      ARG  10  50.369  17.766   0.163
   72    HG3  ARG  10           HG1      ARG  10  51.961  17.350  -0.514
   73    HD2  ARG  10           HD2      ARG  10  51.512  19.588  -1.235
   74    HD3  ARG  10           HD1      ARG  10  51.222  18.557  -2.655
   75    HE   ARG  10           HE       ARG  10  49.133  19.931  -1.029
   76   HH11  ARG  10          HH11      ARG  10  47.166  18.429  -1.490
   77   HH12  ARG  10          HH12      ARG  10  46.871  18.228  -3.184
   78   HH21  ARG  10          HH21      ARG  10  49.988  19.411  -4.138
   79   HH22  ARG  10          HH22      ARG  10  48.468  18.784  -4.684
   80    H    HIS  11           HN       HIS  11  51.643  12.943  -0.910
   81    HA   HIS  11           HA       HIS  11  49.374  11.402  -1.914
   82    HB2  HIS  11           HB2      HIS  11  50.077  12.676  -3.968
   83    HB3  HIS  11           HB1      HIS  11  51.691  11.942  -3.814
   84    HD1  HIS  11           HD1      HIS  11  51.994   9.868  -5.151
   85    HD2  HIS  11           HD2      HIS  11  47.984  10.427  -4.008
   86    HE1  HIS  11           HE1      HIS  11  50.642   7.943  -6.149
   87    H    ALA  12           HN       ALA  12  49.592   9.357  -1.867
   88    HA   ALA  12           HA       ALA  12  50.383   7.283  -1.298
   89    HB1  ALA  12           HB1      ALA  12  52.959   8.586  -0.924
   90    HB2  ALA  12           HB2      ALA  12  52.419   8.129  -2.543
   91    HB3  ALA  12           HB3      ALA  12  52.696   6.891  -1.292
   92    H    ALA  13           HN       ALA  13  51.571  10.191   0.302
   93    HA   ALA  13           HA       ALA  13  51.822   8.902   2.919
   94    HB1  ALA  13           HB1      ALA  13  50.900  11.746   2.208
   95    HB2  ALA  13           HB2      ALA  13  52.615  11.314   2.418
   96    HB3  ALA  13           HB3      ALA  13  51.488  11.181   3.789
   97    H    LYS  14           HN       LYS  14  50.185   8.977   0.190
   98    HA   LYS  14           HA       LYS  14  47.346   8.717   1.477
   99    HB2  LYS  14           HB2      LYS  14  47.994  10.447  -0.379
  100    HB3  LYS  14           HB1      LYS  14  48.214   8.995  -1.423
  101    HG2  LYS  14           HG2      LYS  14  45.918   8.695  -1.646
  102    HG3  LYS  14           HG1      LYS  14  45.569   9.142   0.040
  103    HD2  LYS  14           HD2      LYS  14  45.760  11.517  -0.505
  104    HD3  LYS  14           HD1      LYS  14  46.279  11.130  -2.163
  105    HE2  LYS  14           HE2      LYS  14  44.073   9.919  -2.481
  106    HE3  LYS  14           HE1      LYS  14  43.564  10.561  -0.901
  107    HZ1  LYS  14           HZ1      LYS  14  43.317  12.621  -1.731
  108    HZ2  LYS  14           HZ2      LYS  14  43.191  11.826  -3.228
  109    HZ3  LYS  14           HZ3      LYS  14  44.670  12.512  -2.749
  110    H    HIS  15           HN       HIS  15  46.082   7.453  -0.458
  111    HA   HIS  15           HA       HIS  15  45.522   5.227  -0.928
  112    HB2  HIS  15           HB2      HIS  15  46.606   6.200  -2.956
  113    HB3  HIS  15           HB1      HIS  15  48.154   5.502  -2.424
  114    HD1  HIS  15           HD1      HIS  15  48.634   3.155  -3.139
  115    HD2  HIS  15           HD2      HIS  15  44.523   4.037  -3.257
  116    HE1  HIS  15           HE1      HIS  15  47.452   1.139  -4.172
  117    H    ILE  16           HN       ILE  16  47.489   5.644   1.401
  118    HA   ILE  16           HA       ILE  16  47.691   3.101   2.238
  119    HB   ILE  16           HB       ILE  16  49.228   2.376   0.562
  120   HG12  ILE  16          HG12      ILE  16  51.327   1.923   1.760
  121   HG13  ILE  16          HG11      ILE  16  50.920   3.144   2.983
  122   HG21  ILE  16          HG21      ILE  16  49.911   4.506  -0.426
  123   HG22  ILE  16          HG22      ILE  16  51.383   3.695   0.153
  124   HG23  ILE  16          HG23      ILE  16  50.668   5.001   1.101
  125   HD11  ILE  16           HD1      ILE  16  49.121   0.767   2.352
  126   HD12  ILE  16           HD2      ILE  16  49.029   1.860   3.753
  127   HD13  ILE  16           HD3      ILE  16  50.382   0.717   3.604
  128    H    GLY  17           HN       GLY  17  49.373   5.947   2.009
  129    HA2  GLY  17           HA1      GLY  17  50.097   5.975   4.852
  130    HA3  GLY  17           HA2      GLY  17  50.238   7.332   3.719
  131    H    HIS  18           HN       HIS  18  47.391   6.352   2.806
  132    HA   HIS  18           HA       HIS  18  45.936   8.115   4.772
  133    HB2  HIS  18           HB2      HIS  18  45.554   7.258   1.928
  134    HB3  HIS  18           HB1      HIS  18  44.055   7.347   2.873
  135    HD1  HIS  18           HD1      HIS  18  46.945   9.673   3.630
  136    HD2  HIS  18           HD2      HIS  18  43.279   9.770   1.570
  137    HE1  HIS  18           HE1      HIS  18  46.424  12.121   3.118
  138    H    ALA  19           HN       ALA  19  45.870   4.794   3.374
  139    HA   ALA  19           HA       ALA  19  45.258   3.373   5.657
  140    HB1  ALA  19           HB1      ALA  19  42.806   4.807   4.646
  141    HB2  ALA  19           HB2      ALA  19  43.275   4.413   6.319
  142    HB3  ALA  19           HB3      ALA  19  42.613   3.149   5.262
  143    H    ALA  20           HN       ALA  20  45.925   3.583   2.585
  144    HA   ALA  20           HA       ALA  20  46.000   2.076   0.820
  145    HB1  ALA  20           HB1      ALA  20  46.131  -0.243   1.335
  146    HB2  ALA  20           HB2      ALA  20  45.133  -0.056   2.797
  147    HB3  ALA  20           HB3      ALA  20  46.787   0.599   2.757
  148    H    VAL  21           HN       VAL  21  43.352   3.161   2.206
  149    HA   VAL  21           HA       VAL  21  41.547   1.914   0.177
  150    HB   VAL  21           HB       VAL  21  40.884   2.155   3.150
  151   HG11  VAL  21          HG11      VAL  21  38.780   0.856   2.292
  152   HG12  VAL  21          HG12      VAL  21  39.247   1.456   0.684
  153   HG13  VAL  21          HG13      VAL  21  38.863   2.603   1.988
  154   HG21  VAL  21          HG21      VAL  21  41.304  -0.262   1.329
  155   HG22  VAL  21          HG22      VAL  21  40.674  -0.348   2.992
  156   HG23  VAL  21          HG23      VAL  21  42.330   0.227   2.698
  157    H    ASN  22           HN       ASN  22  42.842   4.493   1.886
  158    HA   ASN  22           HA       ASN  22  42.534   6.767   1.160
  159    HB2  ASN  22           HB2      ASN  22  40.631   6.098  -0.426
  160    HB3  ASN  22           HB1      ASN  22  39.537   6.282   0.972
  161   HD21  ASN  22          HD21      ASN  22  38.643   8.324   1.180
  162   HD22  ASN  22          HD22      ASN  22  39.392   9.808   0.581
  163    H    HIS  23           HN       HIS  23  40.334   4.949   3.251
  164    HA   HIS  23           HA       HIS  23  41.077   6.556   5.541
  165    HB2  HIS  23           HB2      HIS  23  39.492   8.120   4.341
  166    HB3  HIS  23           HB1      HIS  23  38.210   6.907   4.579
  167    HD1  HIS  23           HD1      HIS  23  36.801   7.470   6.546
  168    HD2  HIS  23           HD2      HIS  23  40.833   8.496   7.166
  169    HE1  HIS  23           HE1      HIS  23  36.985   8.446   8.901
  170    H    TYR  24           HN       TYR  24  37.957   5.965   6.226
  171    HA   TYR  24           HA       TYR  24  36.961   4.323   7.532
  172    HB2  TYR  24           HB2      TYR  24  38.284   2.480   5.502
  173    HB3  TYR  24           HB1      TYR  24  36.892   2.084   6.538
  174    HD1  TYR  24           HD1      TYR  24  34.674   2.966   6.065
  175    HD2  TYR  24           HD2      TYR  24  38.068   4.150   3.678
  176    HE1  TYR  24           HE1      TYR  24  33.138   3.969   4.380
  177    HE2  TYR  24           HE2      TYR  24  36.532   5.154   1.993
  178    HH   TYR  24           HH       TYR  24  33.354   4.696   1.753
  179    H    LEU  25           HN       LEU  25  39.840   5.121   8.079
  180    HA   LEU  25           HA       LEU  25  41.363   2.904   8.942
  181    HB2  LEU  25           HB2      LEU  25  41.871   5.496   8.889
  182    HB3  LEU  25           HB1      LEU  25  41.271   5.469  10.560
  183    HG   LEU  25           HG       LEU  25  43.546   3.765   9.439
  184   HD11  LEU  25          HD11      LEU  25  44.011   6.224   9.769
  185   HD12  LEU  25          HD12      LEU  25  44.993   5.164  10.809
  186   HD13  LEU  25          HD13      LEU  25  43.590   6.025  11.486
  187   HD21  LEU  25          HD21      LEU  25  42.557   2.450  11.155
  188   HD22  LEU  25          HD22      LEU  25  42.161   3.873  12.149
  189   HD23  LEU  25          HD23      LEU  25  43.850   3.329  12.001
  Start of MODEL   44
    1    H1   GLY   1           HT1      GLY   1  64.478  24.248   0.276
    2    H2   GLY   1           HT2      GLY   1  66.158  24.461   0.413
    3    H3   GLY   1           HT3      GLY   1  65.514  22.915   0.125
    4    HA2  GLY   1           HA1      GLY   1  65.680  25.220  -1.677
    5    HA3  GLY   1           HA2      GLY   1  66.325  23.582  -1.902
    6    H    TRP   2           HN       TRP   2  65.281  22.501  -3.417
    7    HA   TRP   2           HA       TRP   2  62.718  23.260  -4.427
    8    HB2  TRP   2           HB2      TRP   2  64.094  20.549  -4.590
    9    HB3  TRP   2           HB1      TRP   2  62.791  21.137  -5.651
   10    HD1  TRP   2           HD1      TRP   2  66.512  21.409  -5.024
   11    HE1  TRP   2           HE1      TRP   2  67.635  22.839  -6.884
   12    HE3  TRP   2           HE3      TRP   2  62.301  23.190  -7.329
   13    HZ2  TRP   2           HZ2      TRP   2  66.789  24.518  -9.064
   14    HZ3  TRP   2           HZ3      TRP   2  62.483  24.705  -9.297
   15    HH2  TRP   2           HH2      TRP   2  64.722  25.370 -10.165
   16    H    GLY   3           HN       GLY   3  61.230  20.926  -4.644
   17    HA2  GLY   3           HA1      GLY   3  60.743  19.727  -2.055
   18    HA3  GLY   3           HA2      GLY   3  59.583  21.029  -2.387
   19    H    SER   4           HN       SER   4  60.709  19.573  -5.244
   20    HA   SER   4           HA       SER   4  59.562  18.300  -6.819
   21    HB2  SER   4           HB2      SER   4  60.347  16.559  -5.146
   22    HB3  SER   4           HB1      SER   4  58.721  16.623  -4.426
   23    HG   SER   4           HG       SER   4  59.593  15.483  -6.775
   24    H    ILE   5           HN       ILE   5  57.303  16.993  -7.103
   25    HA   ILE   5           HA       ILE   5  55.276  19.097  -6.829
   26    HB   ILE   5           HB       ILE   5  54.813  16.240  -7.789
   27   HG12  ILE   5          HG12      ILE   5  55.919  18.638  -9.323
   28   HG13  ILE   5          HG11      ILE   5  56.779  17.120  -8.974
   29   HG21  ILE   5          HG21      ILE   5  52.970  17.185  -8.985
   30   HG22  ILE   5          HG22      ILE   5  53.555  18.848  -8.735
   31   HG23  ILE   5          HG23      ILE   5  52.894  17.921  -7.367
   32   HD11  ILE   5           HD1      ILE   5  54.409  17.567 -10.821
   33   HD12  ILE   5           HD2      ILE   5  54.818  15.944 -10.212
   34   HD13  ILE   5           HD3      ILE   5  55.990  16.847 -11.199
   35    H    PHE   6           HN       PHE   6  55.856  18.731  -4.324
   36    HA   PHE   6           HA       PHE   6  55.011  18.144  -2.254
   37    HB2  PHE   6           HB2      PHE   6  52.485  17.469  -3.813
   38    HB3  PHE   6           HB1      PHE   6  52.601  17.790  -2.066
   39    HD1  PHE   6           HD1      PHE   6  53.205  20.062  -1.235
   40    HD2  PHE   6           HD2      PHE   6  52.558  19.278  -5.430
   41    HE1  PHE   6           HE1      PHE   6  52.993  22.508  -1.660
   42    HE2  PHE   6           HE2      PHE   6  52.344  21.725  -5.855
   43    HZ   PHE   6           HZ       PHE   6  52.630  23.341  -3.980
   44    H    LYS   7           HN       LYS   7  55.712  15.942  -4.570
   45    HA   LYS   7           HA       LYS   7  54.535  13.533  -3.494
   46    HB2  LYS   7           HB2      LYS   7  56.924  14.109  -5.281
   47    HB3  LYS   7           HB1      LYS   7  56.512  12.454  -4.782
   48    HG2  LYS   7           HG2      LYS   7  54.357  14.233  -5.971
   49    HG3  LYS   7           HG1      LYS   7  55.529  13.450  -7.050
   50    HD2  LYS   7           HD2      LYS   7  54.196  11.713  -4.955
   51    HD3  LYS   7           HD1      LYS   7  53.209  12.237  -6.335
   52    HE2  LYS   7           HE2      LYS   7  54.254  10.072  -6.829
   53    HE3  LYS   7           HE1      LYS   7  54.935  11.323  -7.894
   54    HZ1  LYS   7           HZ1      LYS   7  56.172  10.318  -5.378
   55    HZ2  LYS   7           HZ2      LYS   7  56.827  11.507  -6.399
   56    HZ3  LYS   7           HZ3      LYS   7  56.658   9.908  -6.949
   57    H    HIS   8           HN       HIS   8  57.128  15.591  -2.506
   58    HA   HIS   8           HA       HIS   8  58.641  13.560  -1.066
   59    HB2  HIS   8           HB2      HIS   8  59.628  15.703  -1.851
   60    HB3  HIS   8           HB1      HIS   8  58.594  16.580  -0.697
   61    HD1  HIS   8           HD1      HIS   8  59.155  16.423   1.825
   62    HD2  HIS   8           HD2      HIS   8  61.692  14.118  -0.610
   63    HE1  HIS   8           HE1      HIS   8  61.141  15.702   3.261
   64    H    GLY   9           HN       GLY   9  55.565  14.651  -0.570
   65    HA2  GLY   9           HA1      GLY   9  55.276  13.497   1.969
   66    HA3  GLY   9           HA2      GLY   9  55.626  15.209   2.264
   67    H    ARG  10           HN       ARG  10  53.624  13.336  -0.071
   68    HA   ARG  10           HA       ARG  10  51.151  14.327   1.017
   69    HB2  ARG  10           HB2      ARG  10  52.226  16.409  -0.170
   70    HB3  ARG  10           HB1      ARG  10  51.771  15.586  -1.677
   71    HG2  ARG  10           HG2      ARG  10  49.407  15.407  -0.763
   72    HG3  ARG  10           HG1      ARG  10  49.922  16.440   0.593
   73    HD2  ARG  10           HD2      ARG  10  50.529  18.237  -0.953
   74    HD3  ARG  10           HD1      ARG  10  50.154  17.202  -2.352
   75    HE   ARG  10           HE       ARG  10  48.234  18.737  -0.891
   76   HH11  ARG  10          HH11      ARG  10  47.822  17.438  -3.596
   77   HH12  ARG  10          HH12      ARG  10  46.565  16.300  -3.246
   78   HH21  ARG  10          HH21      ARG  10  47.009  16.465   0.190
   79   HH22  ARG  10          HH22      ARG  10  46.104  15.749  -1.102
   80    H    HIS  11           HN       HIS  11  52.349  11.855   0.176
   81    HA   HIS  11           HA       HIS  11  50.135  10.802  -1.329
   82    HB2  HIS  11           HB2      HIS  11  51.425  11.930  -3.194
   83    HB3  HIS  11           HB1      HIS  11  52.782  10.837  -2.828
   84    HD1  HIS  11           HD1      HIS  11  52.566   8.350  -3.479
   85    HD2  HIS  11           HD2      HIS  11  49.112  10.608  -4.295
   86    HE1  HIS  11           HE1      HIS  11  51.048   6.915  -4.950
   87    H    ALA  12           HN       ALA  12  49.974   8.747  -1.384
   88    HA   ALA  12           HA       ALA  12  50.243   6.558  -0.794
   89    HB1  ALA  12           HB1      ALA  12  52.906   7.332   0.090
   90    HB2  ALA  12           HB2      ALA  12  52.589   7.019  -1.619
   91    HB3  ALA  12           HB3      ALA  12  52.406   5.726  -0.406
   92    H    ALA  13           HN       ALA  13  51.652   9.133   1.163
   93    HA   ALA  13           HA       ALA  13  51.196   7.753   3.701
   94    HB1  ALA  13           HB1      ALA  13  50.871  10.181   4.501
   95    HB2  ALA  13           HB2      ALA  13  51.228  10.703   2.837
   96    HB3  ALA  13           HB3      ALA  13  52.473   9.865   3.795
   97    H    LYS  14           HN       LYS  14  50.103   8.221   0.747
   98    HA   LYS  14           HA       LYS  14  47.082   8.474   1.523
   99    HB2  LYS  14           HB2      LYS  14  48.377  10.100  -0.079
  100    HB3  LYS  14           HB1      LYS  14  48.487   8.665  -1.165
  101    HG2  LYS  14           HG2      LYS  14  46.248   8.846  -1.782
  102    HG3  LYS  14           HG1      LYS  14  45.709   9.317  -0.154
  103    HD2  LYS  14           HD2      LYS  14  46.421  11.610  -0.517
  104    HD3  LYS  14           HD1      LYS  14  47.209  11.174  -2.053
  105    HE2  LYS  14           HE2      LYS  14  45.095  10.681  -3.096
  106    HE3  LYS  14           HE1      LYS  14  44.234  10.781  -1.542
  107    HZ1  LYS  14           HZ1      LYS  14  45.442  13.177  -1.665
  108    HZ2  LYS  14           HZ2      LYS  14  43.852  12.879  -2.184
  109    HZ3  LYS  14           HZ3      LYS  14  45.127  12.899  -3.308
  110    H    HIS  15           HN       HIS  15  45.961   7.565  -0.656
  111    HA   HIS  15           HA       HIS  15  45.061   5.517  -1.353
  112    HB2  HIS  15           HB2      HIS  15  46.644   6.333  -3.119
  113    HB3  HIS  15           HB1      HIS  15  47.898   5.281  -2.421
  114    HD1  HIS  15           HD1      HIS  15  44.257   4.935  -3.642
  115    HD2  HIS  15           HD2      HIS  15  47.866   2.775  -3.566
  116    HE1  HIS  15           HE1      HIS  15  43.853   2.734  -4.874
  117    H    ILE  16           HN       ILE  16  46.654   5.446   1.268
  118    HA   ILE  16           HA       ILE  16  46.223   2.895   1.959
  119    HB   ILE  16           HB       ILE  16  47.835   1.908   0.502
  120   HG12  ILE  16          HG12      ILE  16  49.380   2.278   3.102
  121   HG13  ILE  16          HG11      ILE  16  47.947   1.234   2.980
  122   HG21  ILE  16          HG21      ILE  16  49.074   3.894  -0.237
  123   HG22  ILE  16          HG22      ILE  16  50.248   2.789   0.500
  124   HG23  ILE  16          HG23      ILE  16  49.658   4.179   1.413
  125   HD11  ILE  16           HD1      ILE  16  49.276   0.162   0.925
  126   HD12  ILE  16           HD2      ILE  16  49.670  -0.310   2.590
  127   HD13  ILE  16           HD3      ILE  16  50.689   0.871   1.742
  128    H    GLY  17           HN       GLY  17  48.412   5.372   2.175
  129    HA2  GLY  17           HA1      GLY  17  48.697   5.112   5.085
  130    HA3  GLY  17           HA2      GLY  17  49.269   6.461   4.087
  131    H    HIS  18           HN       HIS  18  46.455   6.116   2.709
  132    HA   HIS  18           HA       HIS  18  45.091   8.040   4.595
  133    HB2  HIS  18           HB2      HIS  18  44.968   7.417   1.663
  134    HB3  HIS  18           HB1      HIS  18  43.409   7.812   2.414
  135    HD1  HIS  18           HD1      HIS  18  46.506   9.392   3.838
  136    HD2  HIS  18           HD2      HIS  18  43.412  10.397   1.173
  137    HE1  HIS  18           HE1      HIS  18  46.658  11.907   3.409
  138    H    ALA  19           HN       ALA  19  44.641   4.874   2.956
  139    HA   ALA  19           HA       ALA  19  43.434   3.467   4.979
  140    HB1  ALA  19           HB1      ALA  19  40.878   3.781   4.238
  141    HB2  ALA  19           HB2      ALA  19  41.448   5.405   3.788
  142    HB3  ALA  19           HB3      ALA  19  41.604   4.839   5.468
  143    H    ALA  20           HN       ALA  20  44.518   3.789   2.003
  144    HA   ALA  20           HA       ALA  20  44.524   2.437   0.114
  145    HB1  ALA  20           HB1      ALA  20  44.911   0.703   1.944
  146    HB2  ALA  20           HB2      ALA  20  44.221   0.085   0.424
  147    HB3  ALA  20           HB3      ALA  20  43.173   0.337   1.841
  148    H    VAL  21           HN       VAL  21  42.026   3.880   1.317
  149    HA   VAL  21           HA       VAL  21  40.185   3.083  -0.892
  150    HB   VAL  21           HB       VAL  21  39.387   3.279   2.049
  151   HG11  VAL  21          HG11      VAL  21  37.110   2.499   0.985
  152   HG12  VAL  21          HG12      VAL  21  37.787   3.131  -0.535
  153   HG13  VAL  21          HG13      VAL  21  37.560   4.212   0.861
  154   HG21  VAL  21          HG21      VAL  21  39.407   0.955   0.066
  155   HG22  VAL  21          HG22      VAL  21  38.667   0.890   1.684
  156   HG23  VAL  21          HG23      VAL  21  40.422   1.122   1.518
  157    H    ASN  22           HN       ASN  22  41.820   5.266   1.034
  158    HA   ASN  22           HA       ASN  22  42.012   7.592   0.529
  159    HB2  ASN  22           HB2      ASN  22  39.043   7.695  -0.102
  160    HB3  ASN  22           HB1      ASN  22  40.272   8.940  -0.391
  161   HD21  ASN  22          HD21      ASN  22  42.387   7.331  -1.465
  162   HD22  ASN  22          HD22      ASN  22  41.842   6.691  -3.019
  163    H    HIS  23           HN       HIS  23  39.238   6.132   2.156
  164    HA   HIS  23           HA       HIS  23  39.924   7.505   4.632
  165    HB2  HIS  23           HB2      HIS  23  38.680   9.283   3.287
  166    HB3  HIS  23           HB1      HIS  23  37.243   8.242   3.397
  167    HD1  HIS  23           HD1      HIS  23  39.763   8.569   6.223
  168    HD2  HIS  23           HD2      HIS  23  35.923   9.968   5.237
  169    HE1  HIS  23           HE1      HIS  23  38.770   9.620   8.330
  170    H    TYR  24           HN       TYR  24  36.753   7.321   5.042
  171    HA   TYR  24           HA       TYR  24  35.438   5.769   6.166
  172    HB2  TYR  24           HB2      TYR  24  36.543   4.086   3.886
  173    HB3  TYR  24           HB1      TYR  24  35.252   3.530   4.979
  174    HD1  TYR  24           HD1      TYR  24  33.042   4.633   4.995
  175    HD2  TYR  24           HD2      TYR  24  36.142   5.860   2.254
  176    HE1  TYR  24           HE1      TYR  24  31.357   5.879   3.647
  177    HE2  TYR  24           HE2      TYR  24  34.457   7.107   0.907
  178    HH   TYR  24           HH       TYR  24  31.514   6.595   0.770
  179    H    LEU  25           HN       LEU  25  38.413   5.999   6.850
  180    HA   LEU  25           HA       LEU  25  39.927   4.928   8.251
  181    HB2  LEU  25           HB2      LEU  25  37.533   3.413   9.348
  182    HB3  LEU  25           HB1      LEU  25  39.005   3.926  10.206
  183    HG   LEU  25           HG       LEU  25  36.860   5.771   9.057
  184   HD11  LEU  25          HD11      LEU  25  36.194   4.535  11.112
  185   HD12  LEU  25          HD12      LEU  25  36.397   6.276  11.427
  186   HD13  LEU  25          HD13      LEU  25  37.659   5.127  11.931
  187   HD21  LEU  25          HD21      LEU  25  38.229   7.492  10.440
  188   HD22  LEU  25          HD22      LEU  25  38.930   6.957   8.896
  189   HD23  LEU  25          HD23      LEU  25  39.534   6.281  10.429
  Start of MODEL   45
    1    H1   GLY   1           HT1      GLY   1  66.726  21.089  -6.936
    2    H2   GLY   1           HT2      GLY   1  66.516  22.558  -6.109
    3    H3   GLY   1           HT3      GLY   1  65.232  21.451  -6.224
    4    HA2  GLY   1           HA1      GLY   1  67.779  21.020  -4.810
    5    HA3  GLY   1           HA2      GLY   1  66.226  21.425  -4.053
    6    H    TRP   2           HN       TRP   2  65.428  19.713  -3.050
    7    HA   TRP   2           HA       TRP   2  66.153  17.034  -3.485
    8    HB2  TRP   2           HB2      TRP   2  63.953  16.482  -2.372
    9    HB3  TRP   2           HB1      TRP   2  64.943  17.676  -1.497
   10    HD1  TRP   2           HD1      TRP   2  62.010  17.591  -4.029
   11    HE1  TRP   2           HE1      TRP   2  60.474  19.648  -3.614
   12    HE3  TRP   2           HE3      TRP   2  64.727  19.897  -0.351
   13    HZ2  TRP   2           HZ2      TRP   2  60.458  21.966  -1.904
   14    HZ3  TRP   2           HZ3      TRP   2  63.931  22.030   0.657
   15    HH2  TRP   2           HH2      TRP   2  61.801  23.065  -0.116
   16    H    GLY   3           HN       GLY   3  65.261  15.287  -4.593
   17    HA2  GLY   3           HA1      GLY   3  64.140  15.978  -7.191
   18    HA3  GLY   3           HA2      GLY   3  64.502  14.352  -6.583
   19    H    SER   4           HN       SER   4  62.867  14.955  -4.102
   20    HA   SER   4           HA       SER   4  60.380  13.872  -5.137
   21    HB2  SER   4           HB2      SER   4  61.115  14.963  -2.394
   22    HB3  SER   4           HB1      SER   4  59.611  14.097  -2.775
   23    HG   SER   4           HG       SER   4  61.428  12.569  -3.741
   24    H    ILE   5           HN       ILE   5  59.666  15.435  -6.663
   25    HA   ILE   5           HA       ILE   5  59.182  18.183  -5.931
   26    HB   ILE   5           HB       ILE   5  57.681  16.584  -8.045
   27   HG12  ILE   5          HG12      ILE   5  59.960  16.123  -8.551
   28   HG13  ILE   5          HG11      ILE   5  59.547  17.492  -9.599
   29   HG21  ILE   5          HG21      ILE   5  58.282  19.538  -7.624
   30   HG22  ILE   5          HG22      ILE   5  56.704  18.736  -7.752
   31   HG23  ILE   5          HG23      ILE   5  57.740  18.887  -9.186
   32   HD11  ILE   5           HD1      ILE   5  60.529  19.008  -7.757
   33   HD12  ILE   5           HD2      ILE   5  61.688  18.005  -8.654
   34   HD13  ILE   5           HD3      ILE   5  61.170  17.519  -7.023
   35    H    PHE   6           HN       PHE   6  58.165  18.053  -3.867
   36    HA   PHE   6           HA       PHE   6  56.326  17.971  -2.452
   37    HB2  PHE   6           HB2      PHE   6  54.941  18.474  -5.114
   38    HB3  PHE   6           HB1      PHE   6  54.115  18.547  -3.538
   39    HD1  PHE   6           HD1      PHE   6  54.733  20.270  -1.863
   40    HD2  PHE   6           HD2      PHE   6  56.526  20.195  -5.788
   41    HE1  PHE   6           HE1      PHE   6  55.559  22.598  -1.530
   42    HE2  PHE   6           HE2      PHE   6  57.352  22.523  -5.455
   43    HZ   PHE   6           HZ       PHE   6  56.863  23.725  -3.329
   44    H    LYS   7           HN       LYS   7  57.151  15.511  -4.304
   45    HA   LYS   7           HA       LYS   7  54.816  13.879  -4.536
   46    HB2  LYS   7           HB2      LYS   7  57.083  13.456  -5.585
   47    HB3  LYS   7           HB1      LYS   7  57.648  12.914  -3.986
   48    HG2  LYS   7           HG2      LYS   7  55.831  11.208  -3.942
   49    HG3  LYS   7           HG1      LYS   7  55.321  11.728  -5.566
   50    HD2  LYS   7           HD2      LYS   7  57.677  11.218  -6.367
   51    HD3  LYS   7           HD1      LYS   7  57.988  10.487  -4.774
   52    HE2  LYS   7           HE2      LYS   7  57.327   8.692  -6.243
   53    HE3  LYS   7           HE1      LYS   7  55.944   9.015  -5.170
   54    HZ1  LYS   7           HZ1      LYS   7  56.054   9.150  -7.978
   55    HZ2  LYS   7           HZ2      LYS   7  55.731  10.709  -7.384
   56    HZ3  LYS   7           HZ3      LYS   7  54.722   9.410  -6.959
   57    H    HIS   8           HN       HIS   8  57.457  13.556  -2.115
   58    HA   HIS   8           HA       HIS   8  55.801  11.943  -0.364
   59    HB2  HIS   8           HB2      HIS   8  58.271  11.778  -0.417
   60    HB3  HIS   8           HB1      HIS   8  58.390  13.440   0.208
   61    HD1  HIS   8           HD1      HIS   8  59.100  13.240   2.600
   62    HD2  HIS   8           HD2      HIS   8  56.050  10.520   1.608
   63    HE1  HIS   8           HE1      HIS   8  58.446  12.016   4.745
   64    H    GLY   9           HN       GLY   9  53.918  13.429  -0.328
   65    HA2  GLY   9           HA1      GLY   9  53.660  14.716   2.149
   66    HA3  GLY   9           HA2      GLY   9  54.133  15.982   0.999
   67    H    ARG  10           HN       ARG  10  52.772  14.518  -1.237
   68    HA   ARG  10           HA       ARG  10  49.904  15.056  -0.458
   69    HB2  ARG  10           HB2      ARG  10  51.340  15.840  -3.029
   70    HB3  ARG  10           HB1      ARG  10  49.592  16.007  -2.732
   71    HG2  ARG  10           HG2      ARG  10  50.029  17.516  -0.839
   72    HG3  ARG  10           HG1      ARG  10  51.784  17.313  -1.060
   73    HD2  ARG  10           HD2      ARG  10  51.484  18.196  -3.429
   74    HD3  ARG  10           HD1      ARG  10  49.809  18.606  -2.987
   75    HE   ARG  10           HE       ARG  10  52.182  20.081  -2.197
   76   HH11  ARG  10          HH11      ARG  10  52.071  21.004  -0.004
   77   HH12  ARG  10          HH12      ARG  10  50.496  21.473   0.543
   78   HH21  ARG  10          HH21      ARG  10  48.831  19.840  -2.022
   79   HH22  ARG  10          HH22      ARG  10  48.661  20.813  -0.599
   80    H    HIS  11           HN       HIS  11  51.898  12.660  -1.022
   81    HA   HIS  11           HA       HIS  11  49.813  10.961  -2.113
   82    HB2  HIS  11           HB2      HIS  11  50.790  12.055  -4.209
   83    HB3  HIS  11           HB1      HIS  11  52.320  11.236  -3.816
   84    HD1  HIS  11           HD1      HIS  11  48.732  10.561  -4.865
   85    HD2  HIS  11           HD2      HIS  11  52.308   8.431  -4.254
   86    HE1  HIS  11           HE1      HIS  11  48.394   8.216  -5.820
   87    H    ALA  12           HN       ALA  12  50.062   8.948  -1.858
   88    HA   ALA  12           HA       ALA  12  50.779   6.975  -0.983
   89    HB1  ALA  12           HB1      ALA  12  52.954   7.704  -2.052
   90    HB2  ALA  12           HB2      ALA  12  53.067   6.608  -0.652
   91    HB3  ALA  12           HB3      ALA  12  53.293   8.346  -0.455
   92    H    ALA  13           HN       ALA  13  51.727  10.051   0.440
   93    HA   ALA  13           HA       ALA  13  51.673   9.034   3.188
   94    HB1  ALA  13           HB1      ALA  13  52.505  11.388   2.623
   95    HB2  ALA  13           HB2      ALA  13  51.127  11.396   3.751
   96    HB3  ALA  13           HB3      ALA  13  50.872  11.770   2.029
   97    H    LYS  14           HN       LYS  14  50.393   8.761   0.293
   98    HA   LYS  14           HA       LYS  14  47.426   8.552   1.256
   99    HB2  LYS  14           HB2      LYS  14  48.262  10.155  -0.643
  100    HB3  LYS  14           HB1      LYS  14  48.632   8.630  -1.534
  101    HG2  LYS  14           HG2      LYS  14  46.383   8.269  -2.022
  102    HG3  LYS  14           HG1      LYS  14  45.827   8.803  -0.418
  103    HD2  LYS  14           HD2      LYS  14  46.164  11.173  -1.117
  104    HD3  LYS  14           HD1      LYS  14  46.666  10.611  -2.730
  105    HE2  LYS  14           HE2      LYS  14  44.250  11.278  -2.646
  106    HE3  LYS  14           HE1      LYS  14  44.478   9.571  -3.092
  107    HZ1  LYS  14           HZ1      LYS  14  42.914  10.508  -1.060
  108    HZ2  LYS  14           HZ2      LYS  14  44.308   9.962  -0.255
  109    HZ3  LYS  14           HZ3      LYS  14  43.433   8.905  -1.258
  110    H    HIS  15           HN       HIS  15  46.425   7.106  -0.732
  111    HA   HIS  15           HA       HIS  15  45.968   4.824  -1.051
  112    HB2  HIS  15           HB2      HIS  15  48.690   5.286  -2.320
  113    HB3  HIS  15           HB1      HIS  15  47.674   3.859  -2.635
  114    HD1  HIS  15           HD1      HIS  15  45.055   5.987  -2.254
  115    HD2  HIS  15           HD2      HIS  15  48.094   5.907  -5.160
  116    HE1  HIS  15           HE1      HIS  15  44.189   7.255  -4.295
  117    H    ILE  16           HN       ILE  16  47.502   5.481   1.463
  118    HA   ILE  16           HA       ILE  16  47.709   3.059   2.528
  119    HB   ILE  16           HB       ILE  16  49.494   2.212   1.185
  120   HG12  ILE  16          HG12      ILE  16  51.181   3.268   3.472
  121   HG13  ILE  16          HG11      ILE  16  49.792   2.235   3.864
  122   HG21  ILE  16          HG21      ILE  16  50.264   4.265   0.075
  123   HG22  ILE  16          HG22      ILE  16  51.654   3.590   0.946
  124   HG23  ILE  16          HG23      ILE  16  50.763   4.946   1.636
  125   HD11  ILE  16           HD1      ILE  16  50.653   0.458   2.394
  126   HD12  ILE  16           HD2      ILE  16  51.886   0.917   3.592
  127   HD13  ILE  16           HD3      ILE  16  52.020   1.490   1.914
  128    H    GLY  17           HN       GLY  17  49.270   5.969   2.277
  129    HA2  GLY  17           HA1      GLY  17  49.666   6.219   5.171
  130    HA3  GLY  17           HA2      GLY  17  49.843   7.512   3.972
  131    H    HIS  18           HN       HIS  18  47.191   6.323   2.788
  132    HA   HIS  18           HA       HIS  18  45.421   8.062   4.511
  133    HB2  HIS  18           HB2      HIS  18  45.354   8.360   2.045
  134    HB3  HIS  18           HB1      HIS  18  44.813   6.679   1.866
  135    HD1  HIS  18           HD1      HIS  18  42.719   6.421   4.055
  136    HD2  HIS  18           HD2      HIS  18  43.054   9.800   1.585
  137    HE1  HIS  18           HE1      HIS  18  40.474   7.631   4.118
  138    H    ALA  19           HN       ALA  19  45.659   4.662   3.263
  139    HA   ALA  19           HA       ALA  19  44.338   3.692   5.687
  140    HB1  ALA  19           HB1      ALA  19  42.239   2.972   4.779
  141    HB2  ALA  19           HB2      ALA  19  42.703   3.503   3.144
  142    HB3  ALA  19           HB3      ALA  19  42.405   4.706   4.425
  143    H    ALA  20           HN       ALA  20  46.725   2.930   4.446
  144    HA   ALA  20           HA       ALA  20  47.808   0.990   3.801
  145    HB1  ALA  20           HB1      ALA  20  45.231  -0.565   4.102
  146    HB2  ALA  20           HB2      ALA  20  46.106   0.052   5.523
  147    HB3  ALA  20           HB3      ALA  20  46.903  -1.088   4.412
  148    H    VAL  21           HN       VAL  21  44.887   2.036   2.185
  149    HA   VAL  21           HA       VAL  21  45.998   0.964  -0.364
  150    HB   VAL  21           HB       VAL  21  43.103   0.440   0.445
  151   HG11  VAL  21          HG11      VAL  21  43.391   0.753  -1.957
  152   HG12  VAL  21          HG12      VAL  21  43.183  -0.985  -1.638
  153   HG13  VAL  21          HG13      VAL  21  44.805  -0.328  -1.968
  154   HG21  VAL  21          HG21      VAL  21  44.515  -1.038   1.752
  155   HG22  VAL  21          HG22      VAL  21  45.537  -1.395   0.338
  156   HG23  VAL  21          HG23      VAL  21  43.859  -1.985   0.397
  157    H    ASN  22           HN       ASN  22  43.719   2.994   1.419
  158    HA   ASN  22           HA       ASN  22  43.981   5.360   0.098
  159    HB2  ASN  22           HB2      ASN  22  43.511   4.677  -2.110
  160    HB3  ASN  22           HB1      ASN  22  42.281   3.503  -1.591
  161   HD21  ASN  22          HD21      ASN  22  42.770   7.078  -1.051
  162   HD22  ASN  22          HD22      ASN  22  41.140   7.513  -1.576
  163    H    HIS  23           HN       HIS  23  41.322   3.055   0.782
  164    HA   HIS  23           HA       HIS  23  40.444   4.550   3.091
  165    HB2  HIS  23           HB2      HIS  23  39.638   6.127   1.361
  166    HB3  HIS  23           HB1      HIS  23  38.725   4.807   0.590
  167    HD1  HIS  23           HD1      HIS  23  36.319   5.251   1.113
  168    HD2  HIS  23           HD2      HIS  23  38.799   5.786   4.468
  169    HE1  HIS  23           HE1      HIS  23  34.800   5.708   3.117
  170    H    TYR  24           HN       TYR  24  41.010   2.074   3.254
  171    HA   TYR  24           HA       TYR  24  39.194   0.107   2.331
  172    HB2  TYR  24           HB2      TYR  24  41.370  -0.378   3.420
  173    HB3  TYR  24           HB1      TYR  24  40.699   0.167   4.977
  174    HD1  TYR  24           HD1      TYR  24  40.483  -2.422   2.310
  175    HD2  TYR  24           HD2      TYR  24  39.116  -1.196   6.217
  176    HE1  TYR  24           HE1      TYR  24  39.502  -4.682   2.676
  177    HE2  TYR  24           HE2      TYR  24  38.134  -3.458   6.582
  178    HH   TYR  24           HH       TYR  24  38.791  -5.939   5.485
  179    H    LEU  25           HN       LEU  25  38.851   2.527   4.825
  180    HA   LEU  25           HA       LEU  25  36.760   1.210   6.319
  181    HB2  LEU  25           HB2      LEU  25  37.049   4.218   6.029
  182    HB3  LEU  25           HB1      LEU  25  36.471   3.284   7.429
  183    HG   LEU  25           HG       LEU  25  39.321   3.402   6.350
  184   HD11  LEU  25          HD11      LEU  25  39.822   4.433   8.499
  185   HD12  LEU  25          HD12      LEU  25  38.152   4.173   9.059
  186   HD13  LEU  25          HD13      LEU  25  38.482   5.328   7.745
  187   HD21  LEU  25          HD21      LEU  25  38.023   1.642   8.474
  188   HD22  LEU  25          HD22      LEU  25  39.774   1.962   8.442
  189   HD23  LEU  25          HD23      LEU  25  38.996   1.135   7.073
  Start of MODEL   46
    1    H1   GLY   1           HT1      GLY   1  61.072  23.147  -3.242
    2    H2   GLY   1           HT2      GLY   1  61.233  24.203  -1.921
    3    H3   GLY   1           HT3      GLY   1  59.696  23.652  -2.392
    4    HA2  GLY   1           HA1      GLY   1  61.004  22.625  -0.398
    5    HA3  GLY   1           HA2      GLY   1  59.909  21.683  -1.430
    6    H    TRP   2           HN       TRP   2  61.513  20.071  -0.306
    7    HA   TRP   2           HA       TRP   2  64.178  19.834  -1.311
    8    HB2  TRP   2           HB2      TRP   2  62.343  17.544  -0.520
    9    HB3  TRP   2           HB1      TRP   2  64.121  17.585  -0.456
   10    HD1  TRP   2           HD1      TRP   2  65.082  19.720   1.170
   11    HE1  TRP   2           HE1      TRP   2  64.280  20.374   3.557
   12    HE3  TRP   2           HE3      TRP   2  60.466  17.509   1.104
   13    HZ2  TRP   2           HZ2      TRP   2  61.940  19.971   5.187
   14    HZ3  TRP   2           HZ3      TRP   2  58.965  17.656   3.085
   15    HH2  TRP   2           HH2      TRP   2  59.698  18.883   5.126
   16    H    GLY   3           HN       GLY   3  64.165  17.111  -2.243
   17    HA2  GLY   3           HA1      GLY   3  63.933  17.597  -5.055
   18    HA3  GLY   3           HA2      GLY   3  64.178  16.018  -4.281
   19    H    SER   4           HN       SER   4  61.793  16.049  -2.681
   20    HA   SER   4           HA       SER   4  59.951  14.984  -4.634
   21    HB2  SER   4           HB2      SER   4  58.431  14.721  -2.713
   22    HB3  SER   4           HB1      SER   4  60.070  14.172  -2.302
   23    HG   SER   4           HG       SER   4  59.114  16.804  -1.799
   24    H    ILE   5           HN       ILE   5  58.777  16.133  -6.011
   25    HA   ILE   5           HA       ILE   5  58.288  18.963  -5.617
   26    HB   ILE   5           HB       ILE   5  56.777  17.156  -7.549
   27   HG12  ILE   5          HG12      ILE   5  59.579  18.342  -7.815
   28   HG13  ILE   5          HG11      ILE   5  59.167  16.613  -7.741
   29   HG21  ILE   5          HG21      ILE   5  57.791  20.001  -7.937
   30   HG22  ILE   5          HG22      ILE   5  56.218  19.658  -7.182
   31   HG23  ILE   5          HG23      ILE   5  56.531  19.140  -8.853
   32   HD11  ILE   5           HD1      ILE   5  58.555  18.603  -9.952
   33   HD12  ILE   5           HD2      ILE   5  57.680  17.059  -9.817
   34   HD13  ILE   5           HD3      ILE   5  59.442  17.067 -10.062
   35    H    PHE   6           HN       PHE   6  56.316  16.002  -5.290
   36    HA   PHE   6           HA       PHE   6  54.552  17.381  -3.386
   37    HB2  PHE   6           HB2      PHE   6  53.517  16.479  -6.103
   38    HB3  PHE   6           HB1      PHE   6  52.469  16.790  -4.700
   39    HD1  PHE   6           HD1      PHE   6  53.890  18.280  -7.588
   40    HD2  PHE   6           HD2      PHE   6  52.960  19.125  -3.455
   41    HE1  PHE   6           HE1      PHE   6  53.885  20.721  -8.086
   42    HE2  PHE   6           HE2      PHE   6  52.968  21.563  -3.954
   43    HZ   PHE   6           HZ       PHE   6  53.353  22.357  -6.285
   44    H    LYS   7           HN       LYS   7  56.285  14.810  -4.322
   45    HA   LYS   7           HA       LYS   7  54.490  12.602  -3.858
   46    HB2  LYS   7           HB2      LYS   7  57.482  12.611  -3.321
   47    HB3  LYS   7           HB1      LYS   7  56.452  11.237  -3.783
   48    HG2  LYS   7           HG2      LYS   7  57.044  13.673  -5.527
   49    HG3  LYS   7           HG1      LYS   7  57.785  12.066  -5.705
   50    HD2  LYS   7           HD2      LYS   7  55.354  11.168  -5.912
   51    HD3  LYS   7           HD1      LYS   7  54.886  12.868  -6.157
   52    HE2  LYS   7           HE2      LYS   7  55.269  11.743  -8.323
   53    HE3  LYS   7           HE1      LYS   7  56.465  13.033  -8.059
   54    HZ1  LYS   7           HZ1      LYS   7  58.137  11.556  -7.846
   55    HZ2  LYS   7           HZ2      LYS   7  57.116  10.554  -8.762
   56    HZ3  LYS   7           HZ3      LYS   7  57.182  10.387  -7.073
   57    H    HIS   8           HN       HIS   8  57.251  13.499  -1.750
   58    HA   HIS   8           HA       HIS   8  55.788  12.435   0.583
   59    HB2  HIS   8           HB2      HIS   8  58.539  13.691   0.248
   60    HB3  HIS   8           HB1      HIS   8  57.904  13.074   1.790
   61    HD1  HIS   8           HD1      HIS   8  57.707  11.594  -1.758
   62    HD2  HIS   8           HD2      HIS   8  59.029  10.572   2.100
   63    HE1  HIS   8           HE1      HIS   8  58.571   9.192  -1.860
   64    H    GLY   9           HN       GLY   9  54.027  14.085   0.305
   65    HA2  GLY   9           HA1      GLY   9  54.402  16.167   2.265
   66    HA3  GLY   9           HA2      GLY   9  54.397  16.850   0.628
   67    H    ARG  10           HN       ARG  10  52.562  14.749  -0.387
   68    HA   ARG  10           HA       ARG  10  50.096  15.011   1.167
   69    HB2  ARG  10           HB2      ARG  10  48.874  16.296  -0.602
   70    HB3  ARG  10           HB1      ARG  10  50.121  17.258   0.228
   71    HG2  ARG  10           HG2      ARG  10  51.710  16.757  -1.637
   72    HG3  ARG  10           HG1      ARG  10  50.407  15.885  -2.481
   73    HD2  ARG  10           HD2      ARG  10  50.662  18.249  -3.274
   74    HD3  ARG  10           HD1      ARG  10  49.053  17.919  -2.584
   75    HE   ARG  10           HE       ARG  10  51.009  19.002  -0.663
   76   HH11  ARG  10          HH11      ARG  10  51.160  21.399  -1.748
   77   HH12  ARG  10          HH12      ARG  10  49.617  22.176  -1.658
   78   HH21  ARG  10          HH21      ARG  10  47.873  19.236  -1.074
   79   HH22  ARG  10          HH22      ARG  10  47.755  20.952  -1.276
   80    H    HIS  11           HN       HIS  11  51.742  12.918   0.021
   81    HA   HIS  11           HA       HIS  11  49.599  11.441  -1.288
   82    HB2  HIS  11           HB2      HIS  11  50.561  12.716  -3.229
   83    HB3  HIS  11           HB1      HIS  11  52.134  11.952  -2.891
   84    HD1  HIS  11           HD1      HIS  11  48.518  11.012  -3.765
   85    HD2  HIS  11           HD2      HIS  11  52.400   9.401  -3.969
   86    HE1  HIS  11           HE1      HIS  11  48.361   8.806  -5.046
   87    H    ALA  12           HN       ALA  12  49.781   9.386  -1.276
   88    HA   ALA  12           HA       ALA  12  50.457   7.294  -0.647
   89    HB1  ALA  12           HB1      ALA  12  53.000   8.537   0.048
   90    HB2  ALA  12           HB2      ALA  12  52.638   8.111  -1.626
   91    HB3  ALA  12           HB3      ALA  12  52.743   6.854  -0.369
   92    H    ALA  13           HN       ALA  13  51.402  10.164   1.149
   93    HA   ALA  13           HA       ALA  13  51.333   8.804   3.750
   94    HB1  ALA  13           HB1      ALA  13  50.666  11.112   4.553
   95    HB2  ALA  13           HB2      ALA  13  50.649  11.674   2.864
   96    HB3  ALA  13           HB3      ALA  13  52.180  11.171   3.621
   97    H    LYS  14           HN       LYS  14  50.103   8.936   0.820
   98    HA   LYS  14           HA       LYS  14  47.116   8.586   1.670
   99    HB2  LYS  14           HB2      LYS  14  48.056  10.412  -0.006
  100    HB3  LYS  14           HB1      LYS  14  48.311   8.993  -1.089
  101    HG2  LYS  14           HG2      LYS  14  45.593   8.774  -0.103
  102    HG3  LYS  14           HG1      LYS  14  45.806  10.500  -0.442
  103    HD2  LYS  14           HD2      LYS  14  46.570   9.982  -2.732
  104    HD3  LYS  14           HD1      LYS  14  46.397   8.244  -2.404
  105    HE2  LYS  14           HE2      LYS  14  44.003   8.472  -2.082
  106    HE3  LYS  14           HE1      LYS  14  44.114  10.245  -2.171
  107    HZ1  LYS  14           HZ1      LYS  14  45.199   9.715  -4.467
  108    HZ2  LYS  14           HZ2      LYS  14  43.508   9.719  -4.302
  109    HZ3  LYS  14           HZ3      LYS  14  44.359   8.248  -4.321
  110    H    HIS  15           HN       HIS  15  46.366   7.431  -0.762
  111    HA   HIS  15           HA       HIS  15  45.956   5.192  -1.371
  112    HB2  HIS  15           HB2      HIS  15  47.486   6.264  -3.052
  113    HB3  HIS  15           HB1      HIS  15  48.861   5.519  -2.204
  114    HD1  HIS  15           HD1      HIS  15  45.502   4.421  -3.740
  115    HD2  HIS  15           HD2      HIS  15  49.431   3.015  -3.208
  116    HE1  HIS  15           HE1      HIS  15  45.654   2.136  -4.875
  117    H    ILE  16           HN       ILE  16  47.228   5.504   1.382
  118    HA   ILE  16           HA       ILE  16  47.342   2.938   2.147
  119    HB   ILE  16           HB       ILE  16  49.255   2.325   0.857
  120   HG12  ILE  16          HG12      ILE  16  51.003   1.839   2.505
  121   HG13  ILE  16          HG11      ILE  16  50.298   3.008   3.639
  122   HG21  ILE  16          HG21      ILE  16  50.501   4.912   1.874
  123   HG22  ILE  16          HG22      ILE  16  50.088   4.553   0.184
  124   HG23  ILE  16          HG23      ILE  16  51.399   3.670   0.999
  125   HD11  ILE  16           HD1      ILE  16  48.309   1.679   3.905
  126   HD12  ILE  16           HD2      ILE  16  49.675   0.548   4.019
  127   HD13  ILE  16           HD3      ILE  16  48.730   0.652   2.516
  128    H    GLY  17           HN       GLY  17  49.012   5.786   2.444
  129    HA2  GLY  17           HA1      GLY  17  49.070   5.735   5.357
  130    HA3  GLY  17           HA2      GLY  17  49.410   7.140   4.324
  131    H    HIS  18           HN       HIS  18  46.843   6.144   2.816
  132    HA   HIS  18           HA       HIS  18  44.956   7.766   4.530
  133    HB2  HIS  18           HB2      HIS  18  45.230   7.161   1.603
  134    HB3  HIS  18           HB1      HIS  18  43.562   7.246   2.208
  135    HD1  HIS  18           HD1      HIS  18  46.222   9.371   3.831
  136    HD2  HIS  18           HD2      HIS  18  43.113   9.798   1.034
  137    HE1  HIS  18           HE1      HIS  18  45.911  11.873   3.415
  138    H    ALA  19           HN       ALA  19  45.260   4.586   2.846
  139    HA   ALA  19           HA       ALA  19  44.099   3.012   4.823
  140    HB1  ALA  19           HB1      ALA  19  41.674   2.804   3.701
  141    HB2  ALA  19           HB2      ALA  19  41.997   4.493   3.245
  142    HB3  ALA  19           HB3      ALA  19  41.994   4.015   4.961
  143    H    ALA  20           HN       ALA  20  45.508   3.449   1.986
  144    HA   ALA  20           HA       ALA  20  46.092   2.034   0.242
  145    HB1  ALA  20           HB1      ALA  20  44.822  -0.249   1.784
  146    HB2  ALA  20           HB2      ALA  20  46.380   0.460   2.265
  147    HB3  ALA  20           HB3      ALA  20  46.202  -0.295   0.664
  148    H    VAL  21           HN       VAL  21  43.154   2.969   1.005
  149    HA   VAL  21           HA       VAL  21  41.937   1.880  -1.491
  150    HB   VAL  21           HB       VAL  21  40.521   1.876   1.217
  151   HG11  VAL  21          HG11      VAL  21  38.881   2.299  -0.458
  152   HG12  VAL  21          HG12      VAL  21  38.806   0.541  -0.219
  153   HG13  VAL  21          HG13      VAL  21  39.665   1.211  -1.628
  154   HG21  VAL  21          HG21      VAL  21  41.581  -0.405  -0.516
  155   HG22  VAL  21          HG22      VAL  21  40.517  -0.624   0.893
  156   HG23  VAL  21          HG23      VAL  21  42.147   0.048   1.108
  157    H    ASN  22           HN       ASN  22  42.713   4.288   0.693
  158    HA   ASN  22           HA       ASN  22  42.534   6.610   0.177
  159    HB2  ASN  22           HB2      ASN  22  41.168   6.068  -1.946
  160    HB3  ASN  22           HB1      ASN  22  39.726   6.191  -0.907
  161   HD21  ASN  22          HD21      ASN  22  38.842   8.181  -1.602
  162   HD22  ASN  22          HD22      ASN  22  39.733   9.705  -1.529
  163    H    HIS  23           HN       HIS  23  39.857   4.614   1.354
  164    HA   HIS  23           HA       HIS  23  39.872   5.898   3.928
  165    HB2  HIS  23           HB2      HIS  23  38.780   7.734   2.615
  166    HB3  HIS  23           HB1      HIS  23  37.487   6.597   2.169
  167    HD1  HIS  23           HD1      HIS  23  38.971   8.454   5.131
  168    HD2  HIS  23           HD2      HIS  23  35.685   5.972   4.277
  169    HE1  HIS  23           HE1      HIS  23  37.386   8.573   7.131
  170    H    TYR  24           HN       TYR  24  40.068   3.534   4.198
  171    HA   TYR  24           HA       TYR  24  37.787   1.848   3.546
  172    HB2  TYR  24           HB2      TYR  24  40.131   1.007   3.846
  173    HB3  TYR  24           HB1      TYR  24  39.993   1.361   5.585
  174    HD1  TYR  24           HD1      TYR  24  38.865  -0.819   2.821
  175    HD2  TYR  24           HD2      TYR  24  38.458   0.077   7.023
  176    HE1  TYR  24           HE1      TYR  24  37.705  -2.996   3.173
  177    HE2  TYR  24           HE2      TYR  24  37.298  -2.100   7.375
  178    HH   TYR  24           HH       TYR  24  35.890  -3.672   5.874
  179    H    LEU  25           HN       LEU  25  38.539   4.086   6.065
  180    HA   LEU  25           HA       LEU  25  36.882   2.867   8.124
  181    HB2  LEU  25           HB2      LEU  25  37.576   5.817   7.925
  182    HB3  LEU  25           HB1      LEU  25  37.312   4.831   9.383
  183    HG   LEU  25           HG       LEU  25  39.644   4.602   7.430
  184   HD11  LEU  25          HD11      LEU  25  39.785   6.527   8.962
  185   HD12  LEU  25          HD12      LEU  25  40.971   5.283   9.425
  186   HD13  LEU  25          HD13      LEU  25  39.462   5.463  10.351
  187   HD21  LEU  25          HD21      LEU  25  40.480   2.963   9.248
  188   HD22  LEU  25          HD22      LEU  25  39.185   2.373   8.182
  189   HD23  LEU  25          HD23      LEU  25  38.799   2.924   9.831
  Start of MODEL   47
    1    H1   GLY   1           HT1      GLY   1  68.396  23.189  -6.255
    2    H2   GLY   1           HT2      GLY   1  68.448  23.325  -4.563
    3    H3   GLY   1           HT3      GLY   1  68.487  24.719  -5.533
    4    HA2  GLY   1           HA1      GLY   1  66.349  24.599  -4.692
    5    HA3  GLY   1           HA2      GLY   1  66.278  24.092  -6.391
    6    H    TRP   2           HN       TRP   2  65.041  22.394  -6.754
    7    HA   TRP   2           HA       TRP   2  65.320  19.944  -5.256
    8    HB2  TRP   2           HB2      TRP   2  62.802  20.044  -4.454
    9    HB3  TRP   2           HB1      TRP   2  64.070  20.807  -3.465
   10    HD1  TRP   2           HD1      TRP   2  62.055  22.031  -6.564
   11    HE1  TRP   2           HE1      TRP   2  61.141  24.413  -6.068
   12    HE3  TRP   2           HE3      TRP   2  63.843  22.608  -1.801
   13    HZ2  TRP   2           HZ2      TRP   2  61.196  26.290  -3.886
   14    HZ3  TRP   2           HZ3      TRP   2  63.400  24.703  -0.531
   15    HH2  TRP   2           HH2      TRP   2  62.078  26.543  -1.567
   16    H    GLY   3           HN       GLY   3  63.070  18.607  -5.720
   17    HA2  GLY   3           HA1      GLY   3  61.950  19.200  -8.355
   18    HA3  GLY   3           HA2      GLY   3  63.124  17.868  -8.373
   19    H    SER   4           HN       SER   4  60.831  18.782  -5.801
   20    HA   SER   4           HA       SER   4  59.077  16.482  -6.448
   21    HB2  SER   4           HB2      SER   4  60.723  16.610  -3.891
   22    HB3  SER   4           HB1      SER   4  59.334  15.528  -4.142
   23    HG   SER   4           HG       SER   4  61.766  15.634  -5.625
   24    H    ILE   5           HN       ILE   5  57.337  17.824  -6.622
   25    HA   ILE   5           HA       ILE   5  56.789  19.963  -4.771
   26    HB   ILE   5           HB       ILE   5  54.702  18.452  -6.399
   27   HG12  ILE   5          HG12      ILE   5  56.604  20.669  -7.294
   28   HG13  ILE   5          HG11      ILE   5  56.642  18.981  -7.850
   29   HG21  ILE   5          HG21      ILE   5  54.071  20.264  -4.681
   30   HG22  ILE   5          HG22      ILE   5  53.493  20.520  -6.342
   31   HG23  ILE   5          HG23      ILE   5  54.909  21.419  -5.744
   32   HD11  ILE   5           HD1      ILE   5  54.534  21.101  -8.381
   33   HD12  ILE   5           HD2      ILE   5  54.164  19.368  -8.562
   34   HD13  ILE   5           HD3      ILE   5  55.440  20.117  -9.552
   35    H    PHE   6           HN       PHE   6  57.251  18.800  -2.755
   36    HA   PHE   6           HA       PHE   6  56.559  17.715  -0.828
   37    HB2  PHE   6           HB2      PHE   6  53.865  18.545  -1.971
   38    HB3  PHE   6           HB1      PHE   6  54.076  17.852  -0.345
   39    HD1  PHE   6           HD1      PHE   6  55.222  20.650  -2.576
   40    HD2  PHE   6           HD2      PHE   6  54.769  19.230   1.476
   41    HE1  PHE   6           HE1      PHE   6  55.875  22.894  -1.716
   42    HE2  PHE   6           HE2      PHE   6  55.420  21.476   2.335
   43    HZ   PHE   6           HZ       PHE   6  55.992  23.302   0.740
   44    H    LYS   7           HN       LYS   7  56.419  16.328  -3.698
   45    HA   LYS   7           HA       LYS   7  54.545  14.197  -3.504
   46    HB2  LYS   7           HB2      LYS   7  57.344  14.097  -4.698
   47    HB3  LYS   7           HB1      LYS   7  55.991  13.011  -5.085
   48    HG2  LYS   7           HG2      LYS   7  55.900  16.036  -5.484
   49    HG3  LYS   7           HG1      LYS   7  56.371  14.890  -6.760
   50    HD2  LYS   7           HD2      LYS   7  54.084  13.709  -6.234
   51    HD3  LYS   7           HD1      LYS   7  53.666  15.232  -5.414
   52    HE2  LYS   7           HE2      LYS   7  52.861  15.458  -7.656
   53    HE3  LYS   7           HE1      LYS   7  54.351  16.426  -7.581
   54    HZ1  LYS   7           HZ1      LYS   7  53.877  14.583  -9.446
   55    HZ2  LYS   7           HZ2      LYS   7  54.682  13.624  -8.298
   56    HZ3  LYS   7           HZ3      LYS   7  55.437  15.008  -8.932
   57    H    HIS   8           HN       HIS   8  57.834  14.570  -2.194
   58    HA   HIS   8           HA       HIS   8  57.934  11.855  -1.141
   59    HB2  HIS   8           HB2      HIS   8  59.944  12.662   0.050
   60    HB3  HIS   8           HB1      HIS   8  59.979  13.126  -1.668
   61    HD1  HIS   8           HD1      HIS   8  60.004  15.598  -2.246
   62    HD2  HIS   8           HD2      HIS   8  59.160  14.888   1.811
   63    HE1  HIS   8           HE1      HIS   8  60.077  17.853  -1.047
   64    H    GLY   9           HN       GLY   9  55.760  14.038  -0.419
   65    HA2  GLY   9           HA1      GLY   9  55.388  13.041   2.298
   66    HA3  GLY   9           HA2      GLY   9  55.840  14.757   2.247
   67    H    ARG  10           HN       ARG  10  53.902  12.996  -0.156
   68    HA   ARG  10           HA       ARG  10  51.371  14.010   0.893
   69    HB2  ARG  10           HB2      ARG  10  52.579  16.006  -0.297
   70    HB3  ARG  10           HB1      ARG  10  52.182  15.152  -1.804
   71    HG2  ARG  10           HG2      ARG  10  49.781  15.160  -1.182
   72    HG3  ARG  10           HG1      ARG  10  50.176  15.986   0.344
   73    HD2  ARG  10           HD2      ARG  10  51.105  17.898  -0.933
   74    HD3  ARG  10           HD1      ARG  10  50.699  17.073  -2.458
   75    HE   ARG  10           HE       ARG  10  48.541  17.958  -2.163
   76   HH11  ARG  10          HH11      ARG  10  50.186  18.426   0.738
   77   HH12  ARG  10          HH12      ARG  10  48.768  18.463   1.734
   78   HH21  ARG  10          HH21      ARG  10  46.624  17.525  -0.824
   79   HH22  ARG  10          HH22      ARG  10  46.752  17.953   0.849
   80    H    HIS  11           HN       HIS  11  52.569  11.479   0.152
   81    HA   HIS  11           HA       HIS  11  50.369  10.459  -1.413
   82    HB2  HIS  11           HB2      HIS  11  51.855  11.449  -3.231
   83    HB3  HIS  11           HB1      HIS  11  53.095  10.268  -2.750
   84    HD1  HIS  11           HD1      HIS  11  51.921   7.655  -2.532
   85    HD2  HIS  11           HD2      HIS  11  50.273  10.423  -5.236
   86    HE1  HIS  11           HE1      HIS  11  50.607   6.327  -4.275
   87    H    ALA  12           HN       ALA  12  50.068   8.432  -1.309
   88    HA   ALA  12           HA       ALA  12  50.196   6.263  -0.574
   89    HB1  ALA  12           HB1      ALA  12  52.619   6.530  -1.286
   90    HB2  ALA  12           HB2      ALA  12  52.269   5.339  -0.008
   91    HB3  ALA  12           HB3      ALA  12  52.853   6.952   0.400
   92    H    ALA  13           HN       ALA  13  51.623   8.926   1.224
   93    HA   ALA  13           HA       ALA  13  50.966   7.807   3.846
   94    HB1  ALA  13           HB1      ALA  13  50.740  10.303   4.414
   95    HB2  ALA  13           HB2      ALA  13  51.185  10.664   2.728
   96    HB3  ALA  13           HB3      ALA  13  52.352   9.859   3.806
   97    H    LYS  14           HN       LYS  14  50.059   8.023   0.808
   98    HA   LYS  14           HA       LYS  14  47.018   8.479   1.390
   99    HB2  LYS  14           HB2      LYS  14  48.444   9.914  -0.291
  100    HB3  LYS  14           HB1      LYS  14  48.553   8.388  -1.237
  101    HG2  LYS  14           HG2      LYS  14  46.361   8.588  -1.995
  102    HG3  LYS  14           HG1      LYS  14  45.745   9.145  -0.430
  103    HD2  LYS  14           HD2      LYS  14  45.390  11.013  -1.811
  104    HD3  LYS  14           HD1      LYS  14  46.930  11.425  -1.037
  105    HE2  LYS  14           HE2      LYS  14  46.633  10.112  -3.779
  106    HE3  LYS  14           HE1      LYS  14  46.961  11.837  -3.498
  107    HZ1  LYS  14           HZ1      LYS  14  48.998  11.227  -2.358
  108    HZ2  LYS  14           HZ2      LYS  14  48.988  10.596  -3.936
  109    HZ3  LYS  14           HZ3      LYS  14  48.684   9.580  -2.609
  110    H    HIS  15           HN       HIS  15  45.972   7.406  -0.775
  111    HA   HIS  15           HA       HIS  15  45.054   5.328  -1.334
  112    HB2  HIS  15           HB2      HIS  15  46.742   5.956  -3.067
  113    HB3  HIS  15           HB1      HIS  15  47.935   4.951  -2.209
  114    HD1  HIS  15           HD1      HIS  15  47.958   2.493  -2.726
  115    HD2  HIS  15           HD2      HIS  15  44.404   4.361  -3.979
  116    HE1  HIS  15           HE1      HIS  15  46.609   0.761  -4.033
  117    H    ILE  16           HN       ILE  16  46.399   5.431   1.405
  118    HA   ILE  16           HA       ILE  16  45.916   2.962   2.293
  119    HB   ILE  16           HB       ILE  16  47.562   1.833   0.951
  120   HG12  ILE  16          HG12      ILE  16  48.947   2.294   3.624
  121   HG13  ILE  16          HG11      ILE  16  47.523   1.252   3.424
  122   HG21  ILE  16          HG21      ILE  16  50.020   2.630   1.075
  123   HG22  ILE  16          HG22      ILE  16  49.395   4.107   1.815
  124   HG23  ILE  16          HG23      ILE  16  48.938   3.694   0.153
  125   HD11  ILE  16           HD1      ILE  16  49.039   0.138   1.494
  126   HD12  ILE  16           HD2      ILE  16  49.213  -0.340   3.196
  127   HD13  ILE  16           HD3      ILE  16  50.357   0.812   2.482
  128    H    GLY  17           HN       GLY  17  48.029   5.509   2.336
  129    HA2  GLY  17           HA1      GLY  17  48.212   5.467   5.297
  130    HA3  GLY  17           HA2      GLY  17  48.930   6.672   4.212
  131    H    HIS  18           HN       HIS  18  46.193   6.242   2.684
  132    HA   HIS  18           HA       HIS  18  44.792   8.449   4.188
  133    HB2  HIS  18           HB2      HIS  18  44.896   7.509   1.356
  134    HB3  HIS  18           HB1      HIS  18  43.273   7.968   1.901
  135    HD1  HIS  18           HD1      HIS  18  46.357   9.670   3.302
  136    HD2  HIS  18           HD2      HIS  18  43.236  10.470   0.603
  137    HE1  HIS  18           HE1      HIS  18  46.509  12.141   2.673
  138    H    ALA  19           HN       ALA  19  44.386   5.008   3.159
  139    HA   ALA  19           HA       ALA  19  42.209   4.854   5.216
  140    HB1  ALA  19           HB1      ALA  19  40.584   3.850   3.660
  141    HB2  ALA  19           HB2      ALA  19  41.673   4.212   2.303
  142    HB3  ALA  19           HB3      ALA  19  40.958   5.539   3.248
  143    H    ALA  20           HN       ALA  20  44.919   3.682   4.698
  144    HA   ALA  20           HA       ALA  20  45.914   1.621   5.059
  145    HB1  ALA  20           HB1      ALA  20  43.189   0.512   5.760
  146    HB2  ALA  20           HB2      ALA  20  44.074   1.607   6.848
  147    HB3  ALA  20           HB3      ALA  20  44.784   0.040   6.391
  148    H    VAL  21           HN       VAL  21  43.495   2.075   2.709
  149    HA   VAL  21           HA       VAL  21  44.541  -0.242   1.177
  150    HB   VAL  21           HB       VAL  21  41.552   0.087   1.721
  151   HG11  VAL  21          HG11      VAL  21  43.177  -1.793  -0.043
  152   HG12  VAL  21          HG12      VAL  21  41.881  -0.679  -0.541
  153   HG13  VAL  21          HG13      VAL  21  41.492  -2.121   0.422
  154   HG21  VAL  21          HG21      VAL  21  41.856  -2.245   2.721
  155   HG22  VAL  21          HG22      VAL  21  42.592  -0.927   3.657
  156   HG23  VAL  21          HG23      VAL  21  43.612  -1.969   2.635
  157    H    ASN  22           HN       ASN  22  42.783   2.813   1.406
  158    HA   ASN  22           HA       ASN  22  43.581   3.514  -1.282
  159    HB2  ASN  22           HB2      ASN  22  41.808   1.977  -1.949
  160    HB3  ASN  22           HB1      ASN  22  40.653   2.794  -0.874
  161   HD21  ASN  22          HD21      ASN  22  42.473   3.068  -3.929
  162   HD22  ASN  22          HD22      ASN  22  41.593   4.482  -4.519
  163    H    HIS  23           HN       HIS  23  40.375   4.437  -0.215
  164    HA   HIS  23           HA       HIS  23  41.307   6.787   1.288
  165    HB2  HIS  23           HB2      HIS  23  41.673   7.502  -1.063
  166    HB3  HIS  23           HB1      HIS  23  39.964   7.158  -1.418
  167    HD1  HIS  23           HD1      HIS  23  39.252   9.583  -1.861
  168    HD2  HIS  23           HD2      HIS  23  41.148   9.078   1.856
  169    HE1  HIS  23           HE1      HIS  23  38.875  11.721  -0.515
  170    H    TYR  24           HN       TYR  24  39.386   4.341   1.220
  171    HA   TYR  24           HA       TYR  24  36.721   5.484   1.304
  172    HB2  TYR  24           HB2      TYR  24  37.823   2.894   2.468
  173    HB3  TYR  24           HB1      TYR  24  36.097   3.310   2.336
  174    HD1  TYR  24           HD1      TYR  24  35.185   3.917  -0.014
  175    HD2  TYR  24           HD2      TYR  24  38.946   1.896   0.621
  176    HE1  TYR  24           HE1      TYR  24  35.151   3.111  -2.371
  177    HE2  TYR  24           HE2      TYR  24  38.912   1.090  -1.736
  178    HH   TYR  24           HH       TYR  24  36.302   0.847  -3.505
  179    H    LEU  25           HN       LEU  25  39.206   6.291   3.169
  180    HA   LEU  25           HA       LEU  25  37.501   7.194   5.339
  181    HB2  LEU  25           HB2      LEU  25  37.714   4.940   6.169
  182    HB3  LEU  25           HB1      LEU  25  39.460   4.917   5.841
  183    HG   LEU  25           HG       LEU  25  39.891   6.529   7.601
  184   HD11  LEU  25          HD11      LEU  25  38.088   8.084   7.438
  185   HD12  LEU  25          HD12      LEU  25  37.866   7.310   9.024
  186   HD13  LEU  25          HD13      LEU  25  36.861   6.812   7.641
  187   HD21  LEU  25          HD21      LEU  25  37.799   4.570   8.642
  188   HD22  LEU  25          HD22      LEU  25  39.166   5.266   9.544
  189   HD23  LEU  25          HD23      LEU  25  39.467   4.112   8.223
  Start of MODEL   48
    1    H1   GLY   1           HT1      GLY   1  66.939  17.037  -0.544
    2    H2   GLY   1           HT2      GLY   1  65.422  17.302  -1.263
    3    H3   GLY   1           HT3      GLY   1  66.639  18.483  -1.375
    4    HA2  GLY   1           HA1      GLY   1  66.829  17.575  -3.395
    5    HA3  GLY   1           HA2      GLY   1  67.974  16.591  -2.464
    6    H    TRP   2           HN       TRP   2  67.850  14.507  -2.865
    7    HA   TRP   2           HA       TRP   2  66.978  12.441  -3.429
    8    HB2  TRP   2           HB2      TRP   2  65.705  12.855  -1.301
    9    HB3  TRP   2           HB1      TRP   2  64.368  13.505  -2.278
   10    HD1  TRP   2           HD1      TRP   2  62.656  11.801  -3.066
   11    HE1  TRP   2           HE1      TRP   2  62.529   9.214  -3.307
   12    HE3  TRP   2           HE3      TRP   2  67.481  10.638  -1.811
   13    HZ2  TRP   2           HZ2      TRP   2  64.306   6.971  -2.990
   14    HZ3  TRP   2           HZ3      TRP   2  68.243   8.267  -1.788
   15    HH2  TRP   2           HH2      TRP   2  66.662   6.435  -2.375
   16    H    GLY   3           HN       GLY   3  63.936  14.283  -3.850
   17    HA2  GLY   3           HA1      GLY   3  64.003  14.826  -6.562
   18    HA3  GLY   3           HA2      GLY   3  63.562  13.107  -6.490
   19    H    SER   4           HN       SER   4  62.201  13.509  -3.859
   20    HA   SER   4           HA       SER   4  59.579  14.176  -4.974
   21    HB2  SER   4           HB2      SER   4  60.500  13.483  -2.161
   22    HB3  SER   4           HB1      SER   4  58.802  13.712  -2.635
   23    HG   SER   4           HG       SER   4  59.041  11.619  -3.012
   24    H    ILE   5           HN       ILE   5  59.600  16.349  -5.557
   25    HA   ILE   5           HA       ILE   5  60.545  18.459  -3.874
   26    HB   ILE   5           HB       ILE   5  59.060  19.934  -5.271
   27   HG12  ILE   5          HG12      ILE   5  58.185  17.231  -6.395
   28   HG13  ILE   5          HG11      ILE   5  57.159  18.419  -5.557
   29   HG21  ILE   5          HG21      ILE   5  60.507  17.874  -6.987
   30   HG22  ILE   5          HG22      ILE   5  61.371  19.071  -5.992
   31   HG23  ILE   5          HG23      ILE   5  60.300  19.613  -7.303
   32   HD11  ILE   5           HD1      ILE   5  56.706  18.798  -7.854
   33   HD12  ILE   5           HD2      ILE   5  58.415  18.614  -8.315
   34   HD13  ILE   5           HD3      ILE   5  57.879  20.071  -7.441
   35    H    PHE   6           HN       PHE   6  57.456  16.743  -4.075
   36    HA   PHE   6           HA       PHE   6  56.720  17.709  -1.407
   37    HB2  PHE   6           HB2      PHE   6  55.203  18.645  -3.874
   38    HB3  PHE   6           HB1      PHE   6  54.480  18.621  -2.249
   39    HD1  PHE   6           HD1      PHE   6  55.744  19.844  -0.350
   40    HD2  PHE   6           HD2      PHE   6  56.569  20.482  -4.539
   41    HE1  PHE   6           HE1      PHE   6  56.839  22.014   0.195
   42    HE2  PHE   6           HE2      PHE   6  57.664  22.653  -3.994
   43    HZ   PHE   6           HZ       PHE   6  57.715  23.459  -1.636
   44    H    LYS   7           HN       LYS   7  56.708  15.534  -3.950
   45    HA   LYS   7           HA       LYS   7  54.259  14.192  -3.850
   46    HB2  LYS   7           HB2      LYS   7  56.229  13.624  -5.309
   47    HB3  LYS   7           HB1      LYS   7  56.985  12.843  -3.899
   48    HG2  LYS   7           HG2      LYS   7  55.127  11.274  -3.705
   49    HG3  LYS   7           HG1      LYS   7  54.237  12.113  -4.999
   50    HD2  LYS   7           HD2      LYS   7  56.111  11.583  -6.578
   51    HD3  LYS   7           HD1      LYS   7  56.896  10.647  -5.282
   52    HE2  LYS   7           HE2      LYS   7  54.214  10.098  -6.612
   53    HE3  LYS   7           HE1      LYS   7  55.663   9.064  -6.610
   54    HZ1  LYS   7           HZ1      LYS   7  54.039   8.284  -5.008
   55    HZ2  LYS   7           HZ2      LYS   7  54.025   9.794  -4.230
   56    HZ3  LYS   7           HZ3      LYS   7  55.427   8.834  -4.204
   57    H    HIS   8           HN       HIS   8  57.127  13.525  -1.780
   58    HA   HIS   8           HA       HIS   8  55.606  11.720  -0.069
   59    HB2  HIS   8           HB2      HIS   8  58.046  11.487  -0.402
   60    HB3  HIS   8           HB1      HIS   8  58.300  13.067   0.376
   61    HD1  HIS   8           HD1      HIS   8  56.397   9.823   1.241
   62    HD2  HIS   8           HD2      HIS   8  58.899  12.690   3.033
   63    HE1  HIS   8           HE1      HIS   8  56.696   9.151   3.689
   64    H    GLY   9           HN       GLY   9  53.827  13.398   0.197
   65    HA2  GLY   9           HA1      GLY   9  53.892  14.378   2.866
   66    HA3  GLY   9           HA2      GLY   9  54.247  15.735   1.778
   67    H    ARG  10           HN       ARG  10  52.660  15.023  -0.423
   68    HA   ARG  10           HA       ARG  10  49.891  15.308   0.754
   69    HB2  ARG  10           HB2      ARG  10  49.345  16.607  -1.258
   70    HB3  ARG  10           HB1      ARG  10  50.720  17.341  -0.399
   71    HG2  ARG  10           HG2      ARG  10  52.259  16.048  -1.958
   72    HG3  ARG  10           HG1      ARG  10  50.816  15.599  -2.897
   73    HD2  ARG  10           HD2      ARG  10  51.846  18.415  -2.351
   74    HD3  ARG  10           HD1      ARG  10  51.794  17.575  -3.920
   75    HE   ARG  10           HE       ARG  10  49.145  17.593  -3.024
   76   HH11  ARG  10          HH11      ARG  10  49.400  20.120  -1.719
   77   HH12  ARG  10          HH12      ARG  10  49.291  21.289  -2.991
   78   HH21  ARG  10          HH21      ARG  10  49.963  19.003  -5.509
   79   HH22  ARG  10          HH22      ARG  10  49.608  20.656  -5.138
   80    H    HIS  11           HN       HIS  11  51.875  13.107  -0.635
   81    HA   HIS  11           HA       HIS  11  49.578  11.561  -1.665
   82    HB2  HIS  11           HB2      HIS  11  50.369  12.883  -3.658
   83    HB3  HIS  11           HB1      HIS  11  51.969  12.127  -3.466
   84    HD1  HIS  11           HD1      HIS  11  48.337  10.822  -3.521
   85    HD2  HIS  11           HD2      HIS  11  52.101   9.996  -5.200
   86    HE1  HIS  11           HE1      HIS  11  48.080   8.739  -4.976
   87    H    ALA  12           HN       ALA  12  49.789   9.514  -1.723
   88    HA   ALA  12           HA       ALA  12  50.531   7.414  -1.204
   89    HB1  ALA  12           HB1      ALA  12  52.835   6.996  -1.107
   90    HB2  ALA  12           HB2      ALA  12  53.094   8.678  -0.647
   91    HB3  ALA  12           HB3      ALA  12  52.635   8.291  -2.308
   92    H    ALA  13           HN       ALA  13  51.672  10.228   0.595
   93    HA   ALA  13           HA       ALA  13  51.790   8.804   3.151
   94    HB1  ALA  13           HB1      ALA  13  51.277  11.084   4.085
   95    HB2  ALA  13           HB2      ALA  13  51.044  11.703   2.432
   96    HB3  ALA  13           HB3      ALA  13  52.657  11.171   2.964
   97    H    LYS  14           HN       LYS  14  50.277   9.035   0.359
   98    HA   LYS  14           HA       LYS  14  47.382   8.747   1.504
   99    HB2  LYS  14           HB2      LYS  14  48.134  10.553  -0.233
  100    HB3  LYS  14           HB1      LYS  14  48.382   9.150  -1.337
  101    HG2  LYS  14           HG2      LYS  14  46.096   8.911  -1.690
  102    HG3  LYS  14           HG1      LYS  14  45.676   9.248   0.003
  103    HD2  LYS  14           HD2      LYS  14  46.049  11.681  -0.415
  104    HD3  LYS  14           HD1      LYS  14  46.401  11.313  -2.122
  105    HE2  LYS  14           HE2      LYS  14  43.789  10.705  -0.666
  106    HE3  LYS  14           HE1      LYS  14  44.044  12.011  -1.848
  107    HZ1  LYS  14           HZ1      LYS  14  44.735  10.221  -3.441
  108    HZ2  LYS  14           HZ2      LYS  14  43.094  10.199  -3.005
  109    HZ3  LYS  14           HZ3      LYS  14  44.171   9.080  -2.321
  110    H    HIS  15           HN       HIS  15  46.190   7.595  -0.547
  111    HA   HIS  15           HA       HIS  15  45.622   5.393  -1.129
  112    HB2  HIS  15           HB2      HIS  15  46.849   6.517  -3.046
  113    HB3  HIS  15           HB1      HIS  15  48.304   5.628  -2.539
  114    HD1  HIS  15           HD1      HIS  15  44.636   4.879  -3.441
  115    HD2  HIS  15           HD2      HIS  15  48.459   3.163  -3.764
  116    HE1  HIS  15           HE1      HIS  15  44.374   2.663  -4.685
  117    H    ILE  16           HN       ILE  16  47.454   5.655   1.296
  118    HA   ILE  16           HA       ILE  16  47.646   3.080   1.991
  119    HB   ILE  16           HB       ILE  16  49.254   2.401   0.382
  120   HG12  ILE  16          HG12      ILE  16  51.172   3.140   2.618
  121   HG13  ILE  16          HG11      ILE  16  49.839   2.026   2.962
  122   HG21  ILE  16          HG21      ILE  16  49.954   4.577  -0.527
  123   HG22  ILE  16          HG22      ILE  16  51.409   3.754   0.055
  124   HG23  ILE  16          HG23      ILE  16  50.672   5.022   1.032
  125   HD11  ILE  16           HD1      ILE  16  51.775   0.706   2.349
  126   HD12  ILE  16           HD2      ILE  16  52.029   1.660   0.873
  127   HD13  ILE  16           HD3      ILE  16  50.608   0.601   1.014
  128    H    GLY  17           HN       GLY  17  49.364   5.914   1.976
  129    HA2  GLY  17           HA1      GLY  17  49.967   5.786   4.845
  130    HA3  GLY  17           HA2      GLY  17  50.175   7.197   3.787
  131    H    HIS  18           HN       HIS  18  47.371   6.307   2.691
  132    HA   HIS  18           HA       HIS  18  45.840   8.005   4.641
  133    HB2  HIS  18           HB2      HIS  18  45.608   7.261   1.761
  134    HB3  HIS  18           HB1      HIS  18  44.056   7.258   2.615
  135    HD1  HIS  18           HD1      HIS  18  43.295   9.385   1.287
  136    HD2  HIS  18           HD2      HIS  18  46.731   9.965   3.637
  137    HE1  HIS  18           HE1      HIS  18  43.659  11.904   1.495
  138    H    ALA  19           HN       ALA  19  45.795   4.678   3.190
  139    HA   ALA  19           HA       ALA  19  44.628   3.634   5.655
  140    HB1  ALA  19           HB1      ALA  19  42.750   3.629   3.277
  141    HB2  ALA  19           HB2      ALA  19  42.670   4.860   4.562
  142    HB3  ALA  19           HB3      ALA  19  42.410   3.145   4.956
  143    H    ALA  20           HN       ALA  20  46.847   2.916   4.006
  144    HA   ALA  20           HA       ALA  20  47.782   0.955   3.204
  145    HB1  ALA  20           HB1      ALA  20  45.204  -0.564   3.619
  146    HB2  ALA  20           HB2      ALA  20  46.145  -0.007   5.021
  147    HB3  ALA  20           HB3      ALA  20  46.884  -1.106   3.834
  148    H    VAL  21           HN       VAL  21  44.786   2.225   1.985
  149    HA   VAL  21           HA       VAL  21  45.561   1.313  -0.742
  150    HB   VAL  21           HB       VAL  21  42.725   0.899   0.296
  151   HG11  VAL  21          HG11      VAL  21  42.914   1.325  -2.117
  152   HG12  VAL  21          HG12      VAL  21  42.522  -0.388  -1.837
  153   HG13  VAL  21          HG13      VAL  21  44.185   0.088  -2.258
  154   HG21  VAL  21          HG21      VAL  21  45.019  -1.076  -0.080
  155   HG22  VAL  21          HG22      VAL  21  43.315  -1.560   0.093
  156   HG23  VAL  21          HG23      VAL  21  44.140  -0.720   1.426
  157    H    ASN  22           HN       ASN  22  43.599   3.271   1.443
  158    HA   ASN  22           HA       ASN  22  43.860   5.749   0.406
  159    HB2  ASN  22           HB2      ASN  22  43.255   5.356  -1.846
  160    HB3  ASN  22           HB1      ASN  22  41.961   4.218  -1.403
  161   HD21  ASN  22          HD21      ASN  22  39.865   5.065  -1.405
  162   HD22  ASN  22          HD22      ASN  22  39.497   6.793  -1.375
  163    H    HIS  23           HN       HIS  23  41.209   3.428   1.045
  164    HA   HIS  23           HA       HIS  23  40.479   4.880   3.471
  165    HB2  HIS  23           HB2      HIS  23  38.181   5.464   2.770
  166    HB3  HIS  23           HB1      HIS  23  39.395   6.341   1.808
  167    HD1  HIS  23           HD1      HIS  23  39.732   3.112   0.488
  168    HD2  HIS  23           HD2      HIS  23  36.656   5.966   0.199
  169    HE1  HIS  23           HE1      HIS  23  38.376   2.560  -1.606
  170    H    TYR  24           HN       TYR  24  41.236   2.495   3.719
  171    HA   TYR  24           HA       TYR  24  39.653   0.298   2.995
  172    HB2  TYR  24           HB2      TYR  24  41.836   0.194   4.207
  173    HB3  TYR  24           HB1      TYR  24  41.007   0.730   5.688
  174    HD1  TYR  24           HD1      TYR  24  41.370  -2.024   3.227
  175    HD2  TYR  24           HD2      TYR  24  39.474  -0.746   6.887
  176    HE1  TYR  24           HE1      TYR  24  40.680  -4.374   3.690
  177    HE2  TYR  24           HE2      TYR  24  38.783  -3.094   7.349
  178    HH   TYR  24           HH       TYR  24  39.012  -5.223   6.742
  179    H    LEU  25           HN       LEU  25  38.800   2.965   4.966
  180    HA   LEU  25           HA       LEU  25  36.914   1.633   6.712
  181    HB2  LEU  25           HB2      LEU  25  36.727   4.514   5.768
  182    HB3  LEU  25           HB1      LEU  25  36.192   3.819   7.316
  183    HG   LEU  25           HG       LEU  25  39.075   4.108   6.360
  184   HD11  LEU  25          HD11      LEU  25  38.035   6.218   7.101
  185   HD12  LEU  25          HD12      LEU  25  39.235   5.667   8.294
  186   HD13  LEU  25          HD13      LEU  25  37.498   5.440   8.608
  187   HD21  LEU  25          HD21      LEU  25  39.015   2.101   7.658
  188   HD22  LEU  25          HD22      LEU  25  37.830   2.776   8.801
  189   HD23  LEU  25          HD23      LEU  25  39.511   3.362   8.808
  Start of MODEL   49
    1    H1   GLY   1           HT1      GLY   1  67.160  19.921  -6.646
    2    H2   GLY   1           HT2      GLY   1  66.016  18.668  -6.735
    3    H3   GLY   1           HT3      GLY   1  67.502  18.527  -7.548
    4    HA2  GLY   1           HA1      GLY   1  68.426  17.615  -5.830
    5    HA3  GLY   1           HA2      GLY   1  68.018  19.052  -4.872
    6    H    TRP   2           HN       TRP   2  65.257  18.988  -4.890
    7    HA   TRP   2           HA       TRP   2  64.758  17.028  -2.837
    8    HB2  TRP   2           HB2      TRP   2  62.774  18.652  -4.480
    9    HB3  TRP   2           HB1      TRP   2  62.442  17.833  -2.935
   10    HD1  TRP   2           HD1      TRP   2  63.961  20.950  -4.406
   11    HE1  TRP   2           HE1      TRP   2  64.767  22.547  -2.519
   12    HE3  TRP   2           HE3      TRP   2  63.467  17.788  -0.410
   13    HZ2  TRP   2           HZ2      TRP   2  65.136  22.434   0.335
   14    HZ3  TRP   2           HZ3      TRP   2  64.052  18.554   1.885
   15    HH2  TRP   2           HH2      TRP   2  64.886  20.871   2.262
   16    H    GLY   3           HN       GLY   3  63.271  17.381  -6.097
   17    HA2  GLY   3           HA1      GLY   3  62.479  15.771  -7.556
   18    HA3  GLY   3           HA2      GLY   3  63.604  14.631  -6.791
   19    H    SER   4           HN       SER   4  61.425  16.145  -4.619
   20    HA   SER   4           HA       SER   4  59.214  14.281  -4.961
   21    HB2  SER   4           HB2      SER   4  59.548  12.934  -2.978
   22    HB3  SER   4           HB1      SER   4  60.999  12.788  -3.994
   23    HG   SER   4           HG       SER   4  60.712  13.799  -1.483
   24    H    ILE   5           HN       ILE   5  58.981  16.900  -4.939
   25    HA   ILE   5           HA       ILE   5  58.633  17.946  -2.207
   26    HB   ILE   5           HB       ILE   5  59.364  19.430  -4.054
   27   HG12  ILE   5          HG12      ILE   5  56.568  20.164  -3.058
   28   HG13  ILE   5          HG11      ILE   5  58.039  20.274  -2.064
   29   HG21  ILE   5          HG21      ILE   5  57.963  19.961  -5.914
   30   HG22  ILE   5          HG22      ILE   5  56.552  19.160  -5.187
   31   HG23  ILE   5          HG23      ILE   5  57.917  18.188  -5.785
   32   HD11  ILE   5           HD1      ILE   5  57.704  22.465  -2.968
   33   HD12  ILE   5           HD2      ILE   5  57.367  21.826  -4.593
   34   HD13  ILE   5           HD3      ILE   5  59.018  21.752  -3.930
   35    H    PHE   6           HN       PHE   6  56.537  16.935  -4.942
   36    HA   PHE   6           HA       PHE   6  54.123  17.355  -3.247
   37    HB2  PHE   6           HB2      PHE   6  52.865  16.836  -5.261
   38    HB3  PHE   6           HB1      PHE   6  54.127  18.027  -5.651
   39    HD1  PHE   6           HD1      PHE   6  56.051  17.426  -7.035
   40    HD2  PHE   6           HD2      PHE   6  53.065  14.489  -5.997
   41    HE1  PHE   6           HE1      PHE   6  56.964  15.886  -8.768
   42    HE2  PHE   6           HE2      PHE   6  53.976  12.950  -7.730
   43    HZ   PHE   6           HZ       PHE   6  55.861  13.691  -9.182
   44    H    LYS   7           HN       LYS   7  56.072  14.742  -4.670
   45    HA   LYS   7           HA       LYS   7  54.343  12.565  -4.261
   46    HB2  LYS   7           HB2      LYS   7  57.360  12.734  -3.884
   47    HB3  LYS   7           HB1      LYS   7  56.439  11.212  -3.948
   48    HG2  LYS   7           HG2      LYS   7  55.539  11.956  -6.204
   49    HG3  LYS   7           HG1      LYS   7  56.693  13.311  -6.142
   50    HD2  LYS   7           HD2      LYS   7  58.564  11.683  -5.899
   51    HD3  LYS   7           HD1      LYS   7  57.397  10.345  -6.023
   52    HE2  LYS   7           HE2      LYS   7  58.347  10.680  -8.224
   53    HE3  LYS   7           HE1      LYS   7  56.679  11.298  -8.264
   54    HZ1  LYS   7           HZ1      LYS   7  58.407  12.786  -9.269
   55    HZ2  LYS   7           HZ2      LYS   7  59.040  13.018  -7.709
   56    HZ3  LYS   7           HZ3      LYS   7  57.454  13.509  -8.067
   57    H    HIS   8           HN       HIS   8  57.111  12.892  -2.057
   58    HA   HIS   8           HA       HIS   8  55.501  11.810   0.143
   59    HB2  HIS   8           HB2      HIS   8  57.916  11.256  -0.190
   60    HB3  HIS   8           HB1      HIS   8  58.324  12.950   0.173
   61    HD1  HIS   8           HD1      HIS   8  55.588  12.581   2.285
   62    HD2  HIS   8           HD2      HIS   8  59.412  10.833   2.374
   63    HE1  HIS   8           HE1      HIS   8  56.039  11.858   4.693
   64    H    GLY   9           HN       GLY   9  53.967  13.769  -0.239
   65    HA2  GLY   9           HA1      GLY   9  54.415  15.573   2.012
   66    HA3  GLY   9           HA2      GLY   9  54.518  16.389   0.440
   67    H    ARG  10           HN       ARG  10  52.569  14.561  -0.817
   68    HA   ARG  10           HA       ARG  10  50.064  15.005   0.697
   69    HB2  ARG  10           HB2      ARG  10  49.044  16.269  -1.241
   70    HB3  ARG  10           HB1      ARG  10  50.265  17.185  -0.324
   71    HG2  ARG  10           HG2      ARG  10  51.979  16.617  -2.006
   72    HG3  ARG  10           HG1      ARG  10  50.783  15.665  -2.918
   73    HD2  ARG  10           HD2      ARG  10  51.110  17.983  -3.839
   74    HD3  ARG  10           HD1      ARG  10  49.436  17.662  -3.329
   75    HE   ARG  10           HE       ARG  10  50.742  18.802  -1.102
   76   HH11  ARG  10          HH11      ARG  10  50.337  20.988  -0.661
   77   HH12  ARG  10          HH12      ARG  10  50.043  22.078  -1.974
   78   HH21  ARG  10          HH21      ARG  10  50.199  19.611  -4.406
   79   HH22  ARG  10          HH22      ARG  10  49.963  21.298  -4.093
   80    H    HIS  11           HN       HIS  11  51.690  12.785  -0.430
   81    HA   HIS  11           HA       HIS  11  49.464  11.319  -1.569
   82    HB2  HIS  11           HB2      HIS  11  50.289  12.610  -3.589
   83    HB3  HIS  11           HB1      HIS  11  51.845  11.764  -3.410
   84    HD1  HIS  11           HD1      HIS  11  48.109  10.853  -3.656
   85    HD2  HIS  11           HD2      HIS  11  51.881   9.298  -4.669
   86    HE1  HIS  11           HE1      HIS  11  47.717   8.715  -4.997
   87    H    ALA  12           HN       ALA  12  49.659   9.262  -1.622
   88    HA   ALA  12           HA       ALA  12  50.377   7.165  -1.073
   89    HB1  ALA  12           HB1      ALA  12  52.954   8.405  -0.528
   90    HB2  ALA  12           HB2      ALA  12  52.487   8.005  -2.185
   91    HB3  ALA  12           HB3      ALA  12  52.680   6.727  -0.958
   92    H    ALA  13           HN       ALA  13  51.534   9.986   0.700
   93    HA   ALA  13           HA       ALA  13  51.627   8.587   3.271
   94    HB1  ALA  13           HB1      ALA  13  52.524  10.875   3.269
   95    HB2  ALA  13           HB2      ALA  13  50.949  10.953   4.092
   96    HB3  ALA  13           HB3      ALA  13  51.098  11.486   2.400
   97    H    LYS  14           HN       LYS  14  50.136   8.797   0.470
   98    HA   LYS  14           HA       LYS  14  47.234   8.540   1.608
   99    HB2  LYS  14           HB2      LYS  14  48.005  10.335  -0.137
  100    HB3  LYS  14           HB1      LYS  14  48.245   8.922  -1.232
  101    HG2  LYS  14           HG2      LYS  14  45.956   8.694  -1.583
  102    HG3  LYS  14           HG1      LYS  14  45.537   9.052   0.107
  103    HD2  LYS  14           HD2      LYS  14  45.796  11.450  -0.292
  104    HD3  LYS  14           HD1      LYS  14  46.377  11.145  -1.947
  105    HE2  LYS  14           HE2      LYS  14  44.185  10.037  -2.464
  106    HE3  LYS  14           HE1      LYS  14  43.610  10.491  -0.842
  107    HZ1  LYS  14           HZ1      LYS  14  44.765  12.613  -2.488
  108    HZ2  LYS  14           HZ2      LYS  14  43.456  12.663  -1.407
  109    HZ3  LYS  14           HZ3      LYS  14  43.250  12.020  -2.966
  110    H    HIS  15           HN       HIS  15  46.042   7.387  -0.434
  111    HA   HIS  15           HA       HIS  15  45.456   5.190  -0.996
  112    HB2  HIS  15           HB2      HIS  15  46.642   6.246  -2.945
  113    HB3  HIS  15           HB1      HIS  15  48.133   5.429  -2.416
  114    HD1  HIS  15           HD1      HIS  15  44.590   3.976  -2.362
  115    HD2  HIS  15           HD2      HIS  15  48.290   3.351  -4.261
  116    HE1  HIS  15           HE1      HIS  15  44.378   1.851  -3.764
  117    H    ILE  16           HN       ILE  16  47.319   5.462   1.412
  118    HA   ILE  16           HA       ILE  16  47.458   2.883   2.139
  119    HB   ILE  16           HB       ILE  16  49.050   2.200   0.511
  120   HG12  ILE  16          HG12      ILE  16  50.813   2.871   2.899
  121   HG13  ILE  16          HG11      ILE  16  49.549   1.627   2.992
  122   HG21  ILE  16          HG21      ILE  16  49.816   4.362  -0.348
  123   HG22  ILE  16          HG22      ILE  16  51.248   3.515   0.265
  124   HG23  ILE  16          HG23      ILE  16  50.495   4.781   1.237
  125   HD11  ILE  16           HD1      ILE  16  52.092   1.634   1.337
  126   HD12  ILE  16           HD2      ILE  16  50.704   0.644   0.829
  127   HD13  ILE  16           HD3      ILE  16  51.459   0.373   2.414
  128    H    GLY  17           HN       GLY  17  49.089   5.766   2.124
  129    HA2  GLY  17           HA1      GLY  17  49.709   5.617   5.002
  130    HA3  GLY  17           HA2      GLY  17  49.933   7.027   3.946
  131    H    HIS  18           HN       HIS  18  47.141   6.113   2.815
  132    HA   HIS  18           HA       HIS  18  45.570   7.782   4.779
  133    HB2  HIS  18           HB2      HIS  18  45.375   7.127   1.860
  134    HB3  HIS  18           HB1      HIS  18  43.820   7.221   2.710
  135    HD1  HIS  18           HD1      HIS  18  46.741   9.367   3.802
  136    HD2  HIS  18           HD2      HIS  18  43.200   9.755   1.564
  137    HE1  HIS  18           HE1      HIS  18  46.348  11.864   3.424
  138    H    ALA  19           HN       ALA  19  45.485   4.562   3.109
  139    HA   ALA  19           HA       ALA  19  44.585   3.110   5.343
  140    HB1  ALA  19           HB1      ALA  19  42.534   4.214   5.626
  141    HB2  ALA  19           HB2      ALA  19  42.056   2.886   4.552
  142    HB3  ALA  19           HB3      ALA  19  42.337   4.512   3.883
  143    H    ALA  20           HN       ALA  20  45.680   3.334   2.343
  144    HA   ALA  20           HA       ALA  20  45.993   1.813   0.611
  145    HB1  ALA  20           HB1      ALA  20  46.117  -0.503   1.165
  146    HB2  ALA  20           HB2      ALA  20  44.972  -0.320   2.516
  147    HB3  ALA  20           HB3      ALA  20  46.609   0.371   2.632
  148    H    VAL  21           HN       VAL  21  43.244   2.889   1.650
  149    HA   VAL  21           HA       VAL  21  41.651   1.653  -0.533
  150    HB   VAL  21           HB       VAL  21  40.698   1.786   2.368
  151   HG11  VAL  21          HG11      VAL  21  38.712   0.472   1.265
  152   HG12  VAL  21          HG12      VAL  21  39.326   1.130  -0.268
  153   HG13  VAL  21          HG13      VAL  21  38.791   2.229   1.025
  154   HG21  VAL  21          HG21      VAL  21  42.187  -0.111   2.082
  155   HG22  VAL  21          HG22      VAL  21  41.417  -0.552   0.540
  156   HG23  VAL  21          HG23      VAL  21  40.526  -0.739   2.069
  157    H    ASN  22           HN       ASN  22  42.776   4.150   1.369
  158    HA   ASN  22           HA       ASN  22  42.535   6.457   0.875
  159    HB2  ASN  22           HB2      ASN  22  39.662   6.005   0.000
  160    HB3  ASN  22           HB1      ASN  22  40.691   7.425  -0.270
  161   HD21  ASN  22          HD21      ASN  22  43.062   5.487  -0.830
  162   HD22  ASN  22          HD22      ASN  22  42.773   4.978  -2.497
  163    H    HIS  23           HN       HIS  23  39.971   4.493   2.277
  164    HA   HIS  23           HA       HIS  23  40.152   5.852   4.812
  165    HB2  HIS  23           HB2      HIS  23  38.936   7.628   3.569
  166    HB3  HIS  23           HB1      HIS  23  37.658   6.455   3.171
  167    HD1  HIS  23           HD1      HIS  23  39.365   8.026   6.227
  168    HD2  HIS  23           HD2      HIS  23  35.785   6.075   5.201
  169    HE1  HIS  23           HE1      HIS  23  37.802   8.195   8.242
  170    H    TYR  24           HN       TYR  24  40.303   3.760   5.590
  171    HA   TYR  24           HA       TYR  24  37.747   2.475   6.125
  172    HB2  TYR  24           HB2      TYR  24  38.286   1.681   3.773
  173    HB3  TYR  24           HB1      TYR  24  39.731   0.890   4.446
  174    HD1  TYR  24           HD1      TYR  24  39.544  -1.290   5.372
  175    HD2  TYR  24           HD2      TYR  24  36.002   1.138   4.921
  176    HE1  TYR  24           HE1      TYR  24  38.133  -3.217   6.082
  177    HE2  TYR  24           HE2      TYR  24  34.593  -0.790   5.633
  178    HH   TYR  24           HH       TYR  24  36.073  -3.916   6.557
  179    H    LEU  25           HN       LEU  25  40.608   3.476   7.057
  180    HA   LEU  25           HA       LEU  25  42.079   1.436   8.230
  181    HB2  LEU  25           HB2      LEU  25  42.370   3.185  10.197
  182    HB3  LEU  25           HB1      LEU  25  42.962   3.578   8.568
  183    HG   LEU  25           HG       LEU  25  40.963   4.889   8.090
  184   HD11  LEU  25          HD11      LEU  25  40.027   3.812  10.779
  185   HD12  LEU  25          HD12      LEU  25  39.210   3.695   9.201
  186   HD13  LEU  25          HD13      LEU  25  39.310   5.260  10.036
  187   HD21  LEU  25          HD21      LEU  25  41.230   6.661   9.804
  188   HD22  LEU  25          HD22      LEU  25  42.807   5.994   9.313
  189   HD23  LEU  25          HD23      LEU  25  42.076   5.508  10.862
  Start of MODEL   50
    1    H1   GLY   1           HT1      GLY   1  65.945  10.496  -1.577
    2    H2   GLY   1           HT2      GLY   1  67.071   9.367  -0.987
    3    H3   GLY   1           HT3      GLY   1  65.599   8.837  -1.652
    4    HA2  GLY   1           HA1      GLY   1  68.051   9.579  -2.916
    5    HA3  GLY   1           HA2      GLY   1  66.750   8.511  -3.475
    6    H    TRP   2           HN       TRP   2  65.172   9.267  -4.815
    7    HA   TRP   2           HA       TRP   2  65.724  11.470  -6.472
    8    HB2  TRP   2           HB2      TRP   2  62.965  10.380  -5.792
    9    HB3  TRP   2           HB1      TRP   2  63.429  11.266  -7.264
   10    HD1  TRP   2           HD1      TRP   2  63.676   7.865  -5.587
   11    HE1  TRP   2           HE1      TRP   2  64.617   6.114  -7.265
   12    HE3  TRP   2           HE3      TRP   2  65.010  11.024  -9.389
   13    HZ2  TRP   2           HZ2      TRP   2  65.784   6.119  -9.896
   14    HZ3  TRP   2           HZ3      TRP   2  66.036  10.129 -11.474
   15    HH2  TRP   2           HH2      TRP   2  66.423   7.682 -11.731
   16    H    GLY   3           HN       GLY   3  64.064  13.344  -6.787
   17    HA2  GLY   3           HA1      GLY   3  64.333  15.029  -4.445
   18    HA3  GLY   3           HA2      GLY   3  63.523  15.447  -5.967
   19    H    SER   4           HN       SER   4  61.998  12.743  -5.444
   20    HA   SER   4           HA       SER   4  59.832  12.299  -4.730
   21    HB2  SER   4           HB2      SER   4  59.450  12.620  -2.299
   22    HB3  SER   4           HB1      SER   4  61.036  11.894  -2.636
   23    HG   SER   4           HG       SER   4  61.064  13.674  -1.118
   24    H    ILE   5           HN       ILE   5  59.020  13.871  -6.311
   25    HA   ILE   5           HA       ILE   5  58.434  16.580  -5.620
   26    HB   ILE   5           HB       ILE   5  56.754  14.805  -7.439
   27   HG12  ILE   5          HG12      ILE   5  58.989  14.436  -8.190
   28   HG13  ILE   5          HG11      ILE   5  58.344  15.685  -9.269
   29   HG21  ILE   5          HG21      ILE   5  57.207  17.803  -7.187
   30   HG22  ILE   5          HG22      ILE   5  55.681  16.899  -7.172
   31   HG23  ILE   5          HG23      ILE   5  56.589  17.077  -8.689
   32   HD11  ILE   5           HD1      ILE   5  59.435  17.400  -7.667
   33   HD12  ILE   5           HD2      ILE   5  60.532  16.430  -8.669
   34   HD13  ILE   5           HD3      ILE   5  60.294  16.014  -6.957
   35    H    PHE   6           HN       PHE   6  57.758  16.349  -3.377
   36    HA   PHE   6           HA       PHE   6  56.132  16.232  -1.727
   37    HB2  PHE   6           HB2      PHE   6  54.161  16.616  -4.009
   38    HB3  PHE   6           HB1      PHE   6  53.947  17.067  -2.301
   39    HD1  PHE   6           HD1      PHE   6  55.970  18.580  -1.335
   40    HD2  PHE   6           HD2      PHE   6  54.794  18.354  -5.484
   41    HE1  PHE   6           HE1      PHE   6  57.029  20.795  -1.759
   42    HE2  PHE   6           HE2      PHE   6  55.852  20.568  -5.904
   43    HZ   PHE   6           HZ       PHE   6  56.981  21.782  -4.046
   44    H    LYS   7           HN       LYS   7  56.673  13.823  -3.749
   45    HA   LYS   7           HA       LYS   7  54.320  12.205  -3.693
   46    HB2  LYS   7           HB2      LYS   7  56.395  11.797  -5.073
   47    HB3  LYS   7           HB1      LYS   7  57.200  11.231  -3.588
   48    HG2  LYS   7           HG2      LYS   7  55.534   9.465  -3.302
   49    HG3  LYS   7           HG1      LYS   7  54.603  10.072  -4.694
   50    HD2  LYS   7           HD2      LYS   7  56.459   9.568  -6.209
   51    HD3  LYS   7           HD1      LYS   7  57.481   9.071  -4.838
   52    HE2  LYS   7           HE2      LYS   7  54.849   7.749  -5.630
   53    HE3  LYS   7           HE1      LYS   7  56.467   7.114  -6.011
   54    HZ1  LYS   7           HZ1      LYS   7  56.571   6.226  -3.998
   55    HZ2  LYS   7           HZ2      LYS   7  54.995   6.767  -3.666
   56    HZ3  LYS   7           HZ3      LYS   7  56.330   7.737  -3.266
   57    H    HIS   8           HN       HIS   8  56.980  12.656  -1.371
   58    HA   HIS   8           HA       HIS   8  56.196  10.522   0.393
   59    HB2  HIS   8           HB2      HIS   8  58.418  11.742   0.396
   60    HB3  HIS   8           HB1      HIS   8  57.587  13.118   1.160
   61    HD1  HIS   8           HD1      HIS   8  58.182   9.366   1.741
   62    HD2  HIS   8           HD2      HIS   8  57.402  12.882   3.913
   63    HE1  HIS   8           HE1      HIS   8  58.276   8.765   4.222
   64    H    GLY   9           HN       GLY   9  54.482  13.160  -0.550
   65    HA2  GLY   9           HA1      GLY   9  52.795  13.067   1.913
   66    HA3  GLY   9           HA2      GLY   9  53.375  14.643   1.334
   67    H    ARG  10           HN       ARG  10  51.010  15.064   1.216
   68    HA   ARG  10           HA       ARG  10  49.038  15.222  -0.009
   69    HB2  ARG  10           HB2      ARG  10  51.023  14.854  -2.285
   70    HB3  ARG  10           HB1      ARG  10  49.346  15.419  -2.479
   71    HG2  ARG  10           HG2      ARG  10  49.831  17.328  -0.953
   72    HG3  ARG  10           HG1      ARG  10  51.522  16.780  -0.830
   73    HD2  ARG  10           HD2      ARG  10  51.778  17.026  -3.285
   74    HD3  ARG  10           HD1      ARG  10  50.095  17.592  -3.401
   75    HE   ARG  10           HE       ARG  10  51.581  19.200  -1.515
   76   HH11  ARG  10          HH11      ARG  10  51.925  21.344  -2.170
   77   HH12  ARG  10          HH12      ARG  10  51.997  21.712  -3.861
   78   HH21  ARG  10          HH21      ARG  10  51.317  18.465  -4.870
   79   HH22  ARG  10          HH22      ARG  10  51.654  20.083  -5.389
   80    H    HIS  11           HN       HIS  11  49.592  13.583  -2.821
   81    HA   HIS  11           HA       HIS  11  47.832  11.408  -1.967
   82    HB2  HIS  11           HB2      HIS  11  48.025  10.691  -4.380
   83    HB3  HIS  11           HB1      HIS  11  47.433  12.356  -4.170
   84    HD1  HIS  11           HD1      HIS  11  51.061  11.819  -3.504
   85    HD2  HIS  11           HD2      HIS  11  48.658  12.874  -6.790
   86    HE1  HIS  11           HE1      HIS  11  52.601  12.810  -5.287
   87    H    ALA  12           HN       ALA  12  49.255  10.775  -0.380
   88    HA   ALA  12           HA       ALA  12  50.430   8.281  -0.957
   89    HB1  ALA  12           HB1      ALA  12  52.780   9.035  -0.435
   90    HB2  ALA  12           HB2      ALA  12  52.079  10.671  -0.493
   91    HB3  ALA  12           HB3      ALA  12  52.170   9.693  -1.972
   92    H    ALA  13           HN       ALA  13  50.328  11.329   0.721
   93    HA   ALA  13           HA       ALA  13  50.734  10.215   3.410
   94    HB1  ALA  13           HB1      ALA  13  48.922  12.527   2.505
   95    HB2  ALA  13           HB2      ALA  13  50.645  12.753   2.891
   96    HB3  ALA  13           HB3      ALA  13  49.511  12.218   4.155
   97    H    LYS  14           HN       LYS  14  49.396   9.847   0.500
   98    HA   LYS  14           HA       LYS  14  46.769   8.504   1.496
   99    HB2  LYS  14           HB2      LYS  14  46.968  10.407  -0.263
  100    HB3  LYS  14           HB1      LYS  14  47.827   9.163  -1.271
  101    HG2  LYS  14           HG2      LYS  14  45.818   8.092  -1.788
  102    HG3  LYS  14           HG1      LYS  14  45.135   8.317  -0.161
  103    HD2  LYS  14           HD2      LYS  14  44.499  10.602  -0.674
  104    HD3  LYS  14           HD1      LYS  14  45.372  10.549  -2.225
  105    HE2  LYS  14           HE2      LYS  14  43.080   8.665  -1.538
  106    HE3  LYS  14           HE1      LYS  14  42.852  10.208  -2.396
  107    HZ1  LYS  14           HZ1      LYS  14  44.261   7.772  -3.282
  108    HZ2  LYS  14           HZ2      LYS  14  44.717   9.282  -3.913
  109    HZ3  LYS  14           HZ3      LYS  14  43.126   8.721  -4.113
  110    H    HIS  15           HN       HIS  15  46.252   6.951  -0.569
  111    HA   HIS  15           HA       HIS  15  46.545   4.684  -1.088
  112    HB2  HIS  15           HB2      HIS  15  49.035   5.937  -2.300
  113    HB3  HIS  15           HB1      HIS  15  48.236   4.441  -2.837
  114    HD1  HIS  15           HD1      HIS  15  48.252   8.072  -3.344
  115    HD2  HIS  15           HD2      HIS  15  45.495   4.941  -3.848
  116    HE1  HIS  15           HE1      HIS  15  46.353   8.956  -4.806
  117    H    ILE  16           HN       ILE  16  47.975   5.646   1.446
  118    HA   ILE  16           HA       ILE  16  48.978   3.315   2.280
  119    HB   ILE  16           HB       ILE  16  50.844   3.195   0.831
  120   HG12  ILE  16          HG12      ILE  16  51.299   3.148   3.486
  121   HG13  ILE  16          HG11      ILE  16  52.611   2.966   2.315
  122   HG21  ILE  16          HG21      ILE  16  52.417   5.155   0.497
  123   HG22  ILE  16          HG22      ILE  16  51.265   6.165   1.376
  124   HG23  ILE  16          HG23      ILE  16  50.799   5.433  -0.161
  125   HD11  ILE  16           HD1      ILE  16  53.303   5.268   2.614
  126   HD12  ILE  16           HD2      ILE  16  53.075   4.570   4.227
  127   HD13  ILE  16           HD3      ILE  16  51.847   5.655   3.555
  128    H    GLY  17           HN       GLY  17  49.609   6.567   2.249
  129    HA2  GLY  17           HA1      GLY  17  49.963   6.719   5.153
  130    HA3  GLY  17           HA2      GLY  17  49.753   8.090   4.046
  131    H    HIS  18           HN       HIS  18  47.526   6.248   2.799
  132    HA   HIS  18           HA       HIS  18  45.353   7.328   4.579
  133    HB2  HIS  18           HB2      HIS  18  45.596   6.502   1.718
  134    HB3  HIS  18           HB1      HIS  18  44.075   6.005   2.481
  135    HD1  HIS  18           HD1      HIS  18  45.797   9.171   3.615
  136    HD2  HIS  18           HD2      HIS  18  42.662   8.054   1.046
  137    HE1  HIS  18           HE1      HIS  18  44.484  11.289   3.050
  138    H    ALA  19           HN       ALA  19  46.573   4.190   3.238
  139    HA   ALA  19           HA       ALA  19  45.666   2.807   5.646
  140    HB1  ALA  19           HB1      ALA  19  43.493   3.256   4.400
  141    HB2  ALA  19           HB2      ALA  19  43.831   1.552   4.786
  142    HB3  ALA  19           HB3      ALA  19  44.101   2.163   3.133
  143    H    ALA  20           HN       ALA  20  48.129   2.889   4.230
  144    HA   ALA  20           HA       ALA  20  49.743   1.391   3.515
  145    HB1  ALA  20           HB1      ALA  20  49.581  -0.869   4.125
  146    HB2  ALA  20           HB2      ALA  20  47.820  -0.915   3.881
  147    HB3  ALA  20           HB3      ALA  20  48.502  -0.061   5.285
  148    H    VAL  21           HN       VAL  21  46.611   1.566   2.063
  149    HA   VAL  21           HA       VAL  21  47.823   0.876  -0.565
  150    HB   VAL  21           HB       VAL  21  45.201  -0.403   0.325
  151   HG11  VAL  21          HG11      VAL  21  47.026  -0.803  -2.088
  152   HG12  VAL  21          HG12      VAL  21  45.442   0.010  -2.097
  153   HG13  VAL  21          HG13      VAL  21  45.548  -1.733  -1.750
  154   HG21  VAL  21          HG21      VAL  21  46.553  -2.546   0.282
  155   HG22  VAL  21          HG22      VAL  21  46.975  -1.448   1.616
  156   HG23  VAL  21          HG23      VAL  21  48.023  -1.550   0.181
  157    H    ASN  22           HN       ASN  22  45.140   2.083   1.396
  158    HA   ASN  22           HA       ASN  22  44.652   4.511   0.327
  159    HB2  ASN  22           HB2      ASN  22  44.434   3.963  -1.960
  160    HB3  ASN  22           HB1      ASN  22  43.579   2.442  -1.618
  161   HD21  ASN  22          HD21      ASN  22  41.477   2.634  -2.405
  162   HD22  ASN  22          HD22      ASN  22  40.466   4.069  -2.208
  163    H    HIS  23           HN       HIS  23  42.925   1.417   0.799
  164    HA   HIS  23           HA       HIS  23  41.530   2.460   3.117
  165    HB2  HIS  23           HB2      HIS  23  40.231   3.587   1.306
  166    HB3  HIS  23           HB1      HIS  23  39.850   1.989   0.622
  167    HD1  HIS  23           HD1      HIS  23  40.031   1.899   4.293
  168    HD2  HIS  23           HD2      HIS  23  37.087   2.825   1.435
  169    HE1  HIS  23           HE1      HIS  23  37.766   1.792   5.470
  170    H    TYR  24           HN       TYR  24  43.143   0.298   2.894
  171    HA   TYR  24           HA       TYR  24  41.803  -2.143   2.185
  172    HB2  TYR  24           HB2      TYR  24  44.270  -1.905   2.501
  173    HB3  TYR  24           HB1      TYR  24  43.998  -1.721   4.251
  174    HD1  TYR  24           HD1      TYR  24  43.151  -3.605   5.609
  175    HD2  TYR  24           HD2      TYR  24  43.965  -4.060   1.395
  176    HE1  TYR  24           HE1      TYR  24  43.066  -6.082   5.861
  177    HE2  TYR  24           HE2      TYR  24  43.880  -6.538   1.646
  178    HH   TYR  24           HH       TYR  24  44.204  -8.164   4.269
  179    H    LEU  25           HN       LEU  25  41.740  -0.086   5.026
  180    HA   LEU  25           HA       LEU  25  40.819  -1.903   6.971
  181    HB2  LEU  25           HB2      LEU  25  41.393   0.366   7.572
  182    HB3  LEU  25           HB1      LEU  25  40.145   1.028   6.495
  183    HG   LEU  25           HG       LEU  25  38.367   0.166   7.903
  184   HD11  LEU  25          HD11      LEU  25  40.634  -1.302   9.304
  185   HD12  LEU  25          HD12      LEU  25  39.136  -1.974   8.613
  186   HD13  LEU  25          HD13      LEU  25  39.072  -1.016  10.110
  187   HD21  LEU  25          HD21      LEU  25  40.540   1.310   9.710
  188   HD22  LEU  25          HD22      LEU  25  38.780   1.422   9.949
  189   HD23  LEU  25          HD23      LEU  25  39.551   2.282   8.595
  Start of MODEL   51
    1    H1   GLY   1           HT1      GLY   1  64.755  19.114  -4.747
    2    H2   GLY   1           HT2      GLY   1  65.082  19.275  -6.408
    3    H3   GLY   1           HT3      GLY   1  65.673  20.425  -5.306
    4    HA2  GLY   1           HA1      GLY   1  67.419  18.992  -5.999
    5    HA3  GLY   1           HA2      GLY   1  67.053  18.780  -4.275
    6    H    TRP   2           HN       TRP   2  65.825  16.943  -3.591
    7    HA   TRP   2           HA       TRP   2  66.626  14.529  -4.902
    8    HB2  TRP   2           HB2      TRP   2  64.358  14.941  -2.914
    9    HB3  TRP   2           HB1      TRP   2  65.166  13.402  -3.293
   10    HD1  TRP   2           HD1      TRP   2  68.076  13.811  -3.094
   11    HE1  TRP   2           HE1      TRP   2  69.321  14.700  -0.992
   12    HE3  TRP   2           HE3      TRP   2  64.174  16.195  -0.792
   13    HZ2  TRP   2           HZ2      TRP   2  68.679  16.238   1.357
   14    HZ3  TRP   2           HZ3      TRP   2  64.513  17.366   1.379
   15    HH2  TRP   2           HH2      TRP   2  66.759  17.390   2.454
   16    H    GLY   3           HN       GLY   3  64.686  12.783  -5.164
   17    HA2  GLY   3           HA1      GLY   3  63.226  13.755  -7.549
   18    HA3  GLY   3           HA2      GLY   3  63.375  12.077  -6.990
   19    H    SER   4           HN       SER   4  62.563  14.332  -4.541
   20    HA   SER   4           HA       SER   4  59.629  14.001  -4.928
   21    HB2  SER   4           HB2      SER   4  61.055  12.992  -2.435
   22    HB3  SER   4           HB1      SER   4  59.301  13.002  -2.722
   23    HG   SER   4           HG       SER   4  60.631  11.838  -4.774
   24    H    ILE   5           HN       ILE   5  59.696  16.278  -5.185
   25    HA   ILE   5           HA       ILE   5  60.720  17.934  -2.976
   26    HB   ILE   5           HB       ILE   5  59.154  18.590  -5.515
   27   HG12  ILE   5          HG12      ILE   5  61.300  19.668  -6.166
   28   HG13  ILE   5          HG11      ILE   5  62.027  19.145  -4.630
   29   HG21  ILE   5          HG21      ILE   5  60.130  20.375  -3.249
   30   HG22  ILE   5          HG22      ILE   5  58.495  20.280  -3.943
   31   HG23  ILE   5          HG23      ILE   5  59.819  21.003  -4.884
   32   HD11  ILE   5           HD1      ILE   5  62.382  17.691  -6.825
   33   HD12  ILE   5           HD2      ILE   5  60.757  17.073  -6.447
   34   HD13  ILE   5           HD3      ILE   5  62.081  16.882  -5.271
   35    H    PHE   6           HN       PHE   6  57.817  16.245  -3.749
   36    HA   PHE   6           HA       PHE   6  56.544  17.257  -1.305
   37    HB2  PHE   6           HB2      PHE   6  54.512  18.099  -2.399
   38    HB3  PHE   6           HB1      PHE   6  55.933  19.037  -2.918
   39    HD1  PHE   6           HD1      PHE   6  56.705  18.979  -5.211
   40    HD2  PHE   6           HD2      PHE   6  53.535  16.356  -3.908
   41    HE1  PHE   6           HE1      PHE   6  56.219  18.388  -7.583
   42    HE2  PHE   6           HE2      PHE   6  53.050  15.765  -6.279
   43    HZ   PHE   6           HZ       PHE   6  54.352  16.827  -8.119
   44    H    LYS   7           HN       LYS   7  56.822  15.133  -4.024
   45    HA   LYS   7           HA       LYS   7  54.488  13.598  -3.906
   46    HB2  LYS   7           HB2      LYS   7  57.364  12.672  -4.266
   47    HB3  LYS   7           HB1      LYS   7  55.932  11.673  -4.611
   48    HG2  LYS   7           HG2      LYS   7  55.154  13.279  -6.283
   49    HG3  LYS   7           HG1      LYS   7  56.484  14.392  -5.878
   50    HD2  LYS   7           HD2      LYS   7  58.139  12.741  -6.629
   51    HD3  LYS   7           HD1      LYS   7  56.847  11.562  -6.958
   52    HE2  LYS   7           HE2      LYS   7  57.577  12.718  -9.035
   53    HE3  LYS   7           HE1      LYS   7  55.876  13.073  -8.650
   54    HZ1  LYS   7           HZ1      LYS   7  57.944  14.890  -9.014
   55    HZ2  LYS   7           HZ2      LYS   7  57.577  14.929  -7.356
   56    HZ3  LYS   7           HZ3      LYS   7  56.359  15.217  -8.506
   57    H    HIS   8           HN       HIS   8  57.421  13.292  -1.870
   58    HA   HIS   8           HA       HIS   8  56.229  11.143  -0.271
   59    HB2  HIS   8           HB2      HIS   8  58.266  11.474   1.146
   60    HB3  HIS   8           HB1      HIS   8  58.643  11.212  -0.573
   61    HD1  HIS   8           HD1      HIS   8  60.899  12.553   0.633
   62    HD2  HIS   8           HD2      HIS   8  57.475  14.775  -0.381
   63    HE1  HIS   8           HE1      HIS   8  61.612  14.997   0.418
   64    H    GLY   9           HN       GLY   9  54.409  13.194  -0.296
   65    HA2  GLY   9           HA1      GLY   9  54.110  13.694   2.534
   66    HA3  GLY   9           HA2      GLY   9  54.600  15.170   1.678
   67    H    ARG  10           HN       ARG  10  53.059  13.634  -0.680
   68    HA   ARG  10           HA       ARG  10  50.286  14.398   0.199
   69    HB2  ARG  10           HB2      ARG  10  51.744  15.333  -2.304
   70    HB3  ARG  10           HB1      ARG  10  49.982  15.452  -2.078
   71    HG2  ARG  10           HG2      ARG  10  50.297  16.833  -0.073
   72    HG3  ARG  10           HG1      ARG  10  52.063  16.659  -0.205
   73    HD2  ARG  10           HD2      ARG  10  51.902  17.711  -2.512
   74    HD3  ARG  10           HD1      ARG  10  50.194  18.064  -2.156
   75    HE   ARG  10           HE       ARG  10  52.458  19.544  -1.145
   76   HH11  ARG  10          HH11      ARG  10  49.678  20.630  -1.400
   77   HH12  ARG  10          HH12      ARG  10  49.205  20.813   0.255
   78   HH21  ARG  10          HH21      ARG  10  51.723  18.765   1.475
   79   HH22  ARG  10          HH22      ARG  10  50.364  19.757   1.884
   80    H    HIS  11           HN       HIS  11  52.057  11.917  -0.495
   81    HA   HIS  11           HA       HIS  11  49.861  10.472  -1.782
   82    HB2  HIS  11           HB2      HIS  11  52.517  10.826  -3.229
   83    HB3  HIS  11           HB1      HIS  11  51.324   9.568  -3.631
   84    HD1  HIS  11           HD1      HIS  11  51.852  13.331  -3.668
   85    HD2  HIS  11           HD2      HIS  11  49.100  10.488  -5.086
   86    HE1  HIS  11           HE1      HIS  11  50.225  14.552  -5.212
   87    H    ALA  12           HN       ALA  12  49.849   8.428  -1.518
   88    HA   ALA  12           HA       ALA  12  50.293   6.367  -0.615
   89    HB1  ALA  12           HB1      ALA  12  52.500   5.786  -0.090
   90    HB2  ALA  12           HB2      ALA  12  52.859   7.490   0.180
   91    HB3  ALA  12           HB3      ALA  12  52.619   6.902  -1.467
   92    H    ALA  13           HN       ALA  13  51.415   9.327   0.928
   93    HA   ALA  13           HA       ALA  13  51.013   8.322   3.647
   94    HB1  ALA  13           HB1      ALA  13  50.845  11.087   2.318
   95    HB2  ALA  13           HB2      ALA  13  52.094  10.524   3.454
   96    HB3  ALA  13           HB3      ALA  13  50.434  10.817   4.028
   97    H    LYS  14           HN       LYS  14  49.970   8.217   0.640
   98    HA   LYS  14           HA       LYS  14  46.918   8.315   1.325
   99    HB2  LYS  14           HB2      LYS  14  48.093   9.774  -0.514
  100    HB3  LYS  14           HB1      LYS  14  48.360   8.203  -1.350
  101    HG2  LYS  14           HG2      LYS  14  46.134   8.072  -2.017
  102    HG3  LYS  14           HG1      LYS  14  45.510   8.698  -0.477
  103    HD2  LYS  14           HD2      LYS  14  44.945  10.296  -2.190
  104    HD3  LYS  14           HD1      LYS  14  46.258  11.016  -1.234
  105    HE2  LYS  14           HE2      LYS  14  47.871  10.027  -2.982
  106    HE3  LYS  14           HE1      LYS  14  46.430   9.706  -3.974
  107    HZ1  LYS  14           HZ1      LYS  14  47.748  12.209  -3.384
  108    HZ2  LYS  14           HZ2      LYS  14  46.059  12.267  -3.205
  109    HZ3  LYS  14           HZ3      LYS  14  46.744  11.789  -4.685
  110    H    HIS  15           HN       HIS  15  45.945   6.945  -0.699
  111    HA   HIS  15           HA       HIS  15  45.263   4.732  -1.049
  112    HB2  HIS  15           HB2      HIS  15  46.804   5.394  -2.907
  113    HB3  HIS  15           HB1      HIS  15  48.137   4.608  -2.027
  114    HD1  HIS  15           HD1      HIS  15  48.331   2.079  -2.146
  115    HD2  HIS  15           HD2      HIS  15  44.688   3.505  -3.688
  116    HE1  HIS  15           HE1      HIS  15  47.165   0.112  -3.284
  117    H    ILE  16           HN       ILE  16  46.790   5.241   1.570
  118    HA   ILE  16           HA       ILE  16  46.586   2.791   2.652
  119    HB   ILE  16           HB       ILE  16  48.335   1.777   1.395
  120   HG12  ILE  16          HG12      ILE  16  50.121   1.305   3.019
  121   HG13  ILE  16          HG11      ILE  16  49.606   2.678   4.018
  122   HG21  ILE  16          HG21      ILE  16  50.643   2.877   1.295
  123   HG22  ILE  16          HG22      ILE  16  49.892   4.331   1.959
  124   HG23  ILE  16          HG23      ILE  16  49.389   3.730   0.370
  125   HD11  ILE  16           HD1      ILE  16  48.736   0.384   4.749
  126   HD12  ILE  16           HD2      ILE  16  47.749   0.382   3.268
  127   HD13  ILE  16           HD3      ILE  16  47.490   1.629   4.511
  128    H    GLY  17           HN       GLY  17  48.551   5.456   2.514
  129    HA2  GLY  17           HA1      GLY  17  48.708   5.740   5.429
  130    HA3  GLY  17           HA2      GLY  17  49.181   6.957   4.228
  131    H    HIS  18           HN       HIS  18  46.515   6.100   2.837
  132    HA   HIS  18           HA       HIS  18  44.848   8.148   4.271
  133    HB2  HIS  18           HB2      HIS  18  44.986   6.981   1.526
  134    HB3  HIS  18           HB1      HIS  18  43.329   7.214   2.116
  135    HD1  HIS  18           HD1      HIS  18  42.991   9.147   0.364
  136    HD2  HIS  18           HD2      HIS  18  46.052   9.864   3.155
  137    HE1  HIS  18           HE1      HIS  18  43.553  11.638   0.256
  138    H    ALA  19           HN       ALA  19  44.694   4.714   3.169
  139    HA   ALA  19           HA       ALA  19  43.584   3.602   5.460
  140    HB1  ALA  19           HB1      ALA  19  41.474   5.009   3.809
  141    HB2  ALA  19           HB2      ALA  19  41.620   4.884   5.581
  142    HB3  ALA  19           HB3      ALA  19  41.060   3.490   4.639
  143    H    ALA  20           HN       ALA  20  44.840   3.407   2.583
  144    HA   ALA  20           HA       ALA  20  45.108   1.713   1.020
  145    HB1  ALA  20           HB1      ALA  20  44.935  -0.537   1.777
  146    HB2  ALA  20           HB2      ALA  20  43.697  -0.120   2.985
  147    HB3  ALA  20           HB3      ALA  20  45.379   0.413   3.213
  148    H    VAL  21           HN       VAL  21  42.392   3.162   1.715
  149    HA   VAL  21           HA       VAL  21  40.831   1.735  -0.412
  150    HB   VAL  21           HB       VAL  21  39.745   2.654   2.293
  151   HG11  VAL  21          HG11      VAL  21  38.034   3.165   0.725
  152   HG12  VAL  21          HG12      VAL  21  37.602   1.541   1.302
  153   HG13  VAL  21          HG13      VAL  21  38.398   1.742  -0.278
  154   HG21  VAL  21          HG21      VAL  21  40.931   0.466   2.322
  155   HG22  VAL  21          HG22      VAL  21  39.902  -0.103   0.988
  156   HG23  VAL  21          HG23      VAL  21  39.182   0.260   2.574
  157    H    ASN  22           HN       ASN  22  42.151   4.501   0.993
  158    HA   ASN  22           HA       ASN  22  42.295   6.561  -0.279
  159    HB2  ASN  22           HB2      ASN  22  40.575   5.794  -1.989
  160    HB3  ASN  22           HB1      ASN  22  39.316   6.330  -0.841
  161   HD21  ASN  22          HD21      ASN  22  40.537   7.389  -3.604
  162   HD22  ASN  22          HD22      ASN  22  40.700   9.116  -3.271
  163    H    HIS  23           HN       HIS  23  39.624   5.522   1.775
  164    HA   HIS  23           HA       HIS  23  38.964   6.390   3.834
  165    HB2  HIS  23           HB2      HIS  23  41.451   7.371   3.814
  166    HB3  HIS  23           HB1      HIS  23  40.622   8.912   3.519
  167    HD1  HIS  23           HD1      HIS  23  39.685   5.955   5.805
  168    HD2  HIS  23           HD2      HIS  23  40.514  10.071   6.025
  169    HE1  HIS  23           HE1      HIS  23  39.259   6.690   8.215
  170    H    TYR  24           HN       TYR  24  37.382   6.639   1.688
  171    HA   TYR  24           HA       TYR  24  36.602   9.432   1.240
  172    HB2  TYR  24           HB2      TYR  24  34.846   8.485  -0.155
  173    HB3  TYR  24           HB1      TYR  24  36.377   7.645  -0.494
  174    HD1  TYR  24           HD1      TYR  24  33.045   7.376   1.113
  175    HD2  TYR  24           HD2      TYR  24  36.727   5.321   0.191
  176    HE1  TYR  24           HE1      TYR  24  31.980   5.204   1.709
  177    HE2  TYR  24           HE2      TYR  24  35.661   3.148   0.788
  178    HH   TYR  24           HH       TYR  24  33.743   2.122   1.283
  179    H    LEU  25           HN       LEU  25  35.960   7.034   3.615
  180    HA   LEU  25           HA       LEU  25  34.476   6.987   5.398
  181    HB2  LEU  25           HB2      LEU  25  33.886   9.910   4.811
  182    HB3  LEU  25           HB1      LEU  25  33.815   9.062   6.372
  183    HG   LEU  25           HG       LEU  25  36.336   9.590   4.736
  184   HD11  LEU  25          HD11      LEU  25  36.912  11.128   6.559
  185   HD12  LEU  25          HD12      LEU  25  35.409  10.713   7.417
  186   HD13  LEU  25          HD13      LEU  25  35.338  11.587   5.869
  187   HD21  LEU  25          HD21      LEU  25  35.805   8.088   7.333
  188   HD22  LEU  25          HD22      LEU  25  37.405   8.777   6.962
  189   HD23  LEU  25          HD23      LEU  25  36.705   7.537   5.898
  Start of MODEL   52
    1    H1   GLY   1           HT1      GLY   1  48.671  12.013 -13.665
    2    H2   GLY   1           HT2      GLY   1  49.120  12.622 -12.143
    3    H3   GLY   1           HT3      GLY   1  47.497  12.228 -12.462
    4    HA2  GLY   1           HA1      GLY   1  47.873   9.988 -12.444
    5    HA3  GLY   1           HA2      GLY   1  49.620  10.222 -12.653
    6    H    TRP   2           HN       TRP   2  50.915  10.816 -10.898
    7    HA   TRP   2           HA       TRP   2  50.265   9.657  -8.420
    8    HB2  TRP   2           HB2      TRP   2  52.147  11.988  -8.961
    9    HB3  TRP   2           HB1      TRP   2  52.150  10.969  -7.502
   10    HD1  TRP   2           HD1      TRP   2  52.714   8.328  -7.883
   11    HE1  TRP   2           HE1      TRP   2  54.256   7.156  -9.618
   12    HE3  TRP   2           HE3      TRP   2  53.062  12.098 -11.327
   13    HZ2  TRP   2           HZ2      TRP   2  55.461   7.799 -12.154
   14    HZ3  TRP   2           HZ3      TRP   2  54.412  11.797 -13.398
   15    HH2  TRP   2           HH2      TRP   2  55.611   9.653 -13.814
   16    H    GLY   3           HN       GLY   3  49.779  12.992  -9.568
   17    HA2  GLY   3           HA1      GLY   3  48.285  14.588  -8.777
   18    HA3  GLY   3           HA2      GLY   3  47.660  13.400  -7.616
   19    H    SER   4           HN       SER   4  50.843  13.217  -7.097
   20    HA   SER   4           HA       SER   4  50.712  14.731  -4.637
   21    HB2  SER   4           HB2      SER   4  52.864  13.887  -4.215
   22    HB3  SER   4           HB1      SER   4  52.170  12.651  -5.288
   23    HG   SER   4           HG       SER   4  53.620  13.157  -6.718
   24    H    ILE   5           HN       ILE   5  50.748  16.867  -4.488
   25    HA   ILE   5           HA       ILE   5  51.955  18.492  -6.643
   26    HB   ILE   5           HB       ILE   5  50.758  19.486  -4.025
   27   HG12  ILE   5          HG12      ILE   5  49.369  18.771  -6.649
   28   HG13  ILE   5          HG11      ILE   5  49.146  17.955  -5.084
   29   HG21  ILE   5          HG21      ILE   5  52.081  21.024  -5.610
   30   HG22  ILE   5          HG22      ILE   5  50.424  21.534  -5.222
   31   HG23  ILE   5          HG23      ILE   5  50.774  20.765  -6.788
   32   HD11  ILE   5           HD1      ILE   5  48.299  20.755  -5.895
   33   HD12  ILE   5           HD2      ILE   5  48.469  20.304  -4.180
   34   HD13  ILE   5           HD3      ILE   5  47.306  19.445  -5.217
   35    H    PHE   6           HN       PHE   6  52.694  17.426  -3.362
   36    HA   PHE   6           HA       PHE   6  55.176  19.151  -3.386
   37    HB2  PHE   6           HB2      PHE   6  53.413  18.055  -1.169
   38    HB3  PHE   6           HB1      PHE   6  55.115  18.463  -0.841
   39    HD1  PHE   6           HD1      PHE   6  55.874  20.762  -0.786
   40    HD2  PHE   6           HD2      PHE   6  51.823  19.828  -1.939
   41    HE1  PHE   6           HE1      PHE   6  55.265  23.170  -0.599
   42    HE2  PHE   6           HE2      PHE   6  51.213  22.235  -1.754
   43    HZ   PHE   6           HZ       PHE   6  52.935  23.907  -1.083
   44    H    LYS   7           HN       LYS   7  54.171  16.179  -4.253
   45    HA   LYS   7           HA       LYS   7  55.212  14.120  -4.453
   46    HB2  LYS   7           HB2      LYS   7  56.887  15.511  -5.618
   47    HB3  LYS   7           HB1      LYS   7  57.718  15.802  -4.071
   48    HG2  LYS   7           HG2      LYS   7  58.310  13.486  -3.839
   49    HG3  LYS   7           HG1      LYS   7  57.209  13.001  -5.150
   50    HD2  LYS   7           HD2      LYS   7  59.600  13.046  -5.881
   51    HD3  LYS   7           HD1      LYS   7  58.585  14.182  -6.800
   52    HE2  LYS   7           HE2      LYS   7  60.879  15.045  -5.919
   53    HE3  LYS   7           HE1      LYS   7  59.450  16.071  -5.655
   54    HZ1  LYS   7           HZ1      LYS   7  61.125  15.379  -3.716
   55    HZ2  LYS   7           HZ2      LYS   7  60.028  14.088  -3.594
   56    HZ3  LYS   7           HZ3      LYS   7  59.479  15.689  -3.444
   57    H    HIS   8           HN       HIS   8  54.648  12.857  -2.806
   58    HA   HIS   8           HA       HIS   8  54.896  11.642  -0.861
   59    HB2  HIS   8           HB2      HIS   8  57.661  12.834  -0.494
   60    HB3  HIS   8           HB1      HIS   8  57.063  11.231  -0.003
   61    HD1  HIS   8           HD1      HIS   8  59.580  11.682  -1.897
   62    HD2  HIS   8           HD2      HIS   8  55.670  10.858  -3.208
   63    HE1  HIS   8           HE1      HIS   8  59.761  10.633  -4.220
   64    H    GLY   9           HN       GLY   9  54.854  14.938  -1.017
   65    HA2  GLY   9           HA1      GLY   9  55.103  15.456   1.887
   66    HA3  GLY   9           HA2      GLY   9  54.722  16.634   0.614
   67    H    ARG  10           HN       ARG  10  52.850  14.007  -0.000
   68    HA   ARG  10           HA       ARG  10  50.760  14.290   1.969
   69    HB2  ARG  10           HB2      ARG  10  49.085  15.427   0.556
   70    HB3  ARG  10           HB1      ARG  10  50.478  16.489   0.872
   71    HG2  ARG  10           HG2      ARG  10  51.445  15.584  -1.364
   72    HG3  ARG  10           HG1      ARG  10  49.805  14.964  -1.673
   73    HD2  ARG  10           HD2      ARG  10  50.704  17.842  -1.329
   74    HD3  ARG  10           HD1      ARG  10  49.831  17.109  -2.696
   75    HE   ARG  10           HE       ARG  10  48.206  16.828  -0.375
   76   HH11  ARG  10          HH11      ARG  10  46.228  17.920  -1.187
   77   HH12  ARG  10          HH12      ARG  10  46.384  19.620  -1.481
   78   HH21  ARG  10          HH21      ARG  10  49.846  19.606  -1.285
   79   HH22  ARG  10          HH22      ARG  10  48.432  20.574  -1.536
   80    H    HIS  11           HN       HIS  11  52.344  12.865  -0.553
   81    HA   HIS  11           HA       HIS  11  50.033  11.074  -1.260
   82    HB2  HIS  11           HB2      HIS  11  51.242  12.115  -3.171
   83    HB3  HIS  11           HB1      HIS  11  52.758  11.385  -2.588
   84    HD1  HIS  11           HD1      HIS  11  53.307   9.374  -3.946
   85    HD2  HIS  11           HD2      HIS  11  49.183   9.676  -3.186
   86    HE1  HIS  11           HE1      HIS  11  52.185   7.343  -5.014
   87    H    ALA  12           HN       ALA  12  50.112   9.004  -1.168
   88    HA   ALA  12           HA       ALA  12  50.572   6.917  -0.371
   89    HB1  ALA  12           HB1      ALA  12  52.920   7.585  -1.056
   90    HB2  ALA  12           HB2      ALA  12  52.767   6.365   0.234
   91    HB3  ALA  12           HB3      ALA  12  53.054   8.062   0.627
   92    H    ALA  13           HN       ALA  13  51.514   9.783   1.457
   93    HA   ALA  13           HA       ALA  13  51.005   8.545   4.063
   94    HB1  ALA  13           HB1      ALA  13  51.997  10.770   4.184
   95    HB2  ALA  13           HB2      ALA  13  50.273  11.009   4.562
   96    HB3  ALA  13           HB3      ALA  13  50.892  11.398   2.939
   97    H    LYS  14           HN       LYS  14  50.127   8.663   1.008
   98    HA   LYS  14           HA       LYS  14  47.043   8.604   1.533
   99    HB2  LYS  14           HB2      LYS  14  48.257  10.260  -0.093
  100    HB3  LYS  14           HB1      LYS  14  48.638   8.777  -1.047
  101    HG2  LYS  14           HG2      LYS  14  46.459   8.632  -1.855
  102    HG3  LYS  14           HG1      LYS  14  45.722   9.110  -0.310
  103    HD2  LYS  14           HD2      LYS  14  46.306  11.481  -0.778
  104    HD3  LYS  14           HD1      LYS  14  47.027  10.990  -2.330
  105    HE2  LYS  14           HE2      LYS  14  44.112  10.694  -1.490
  106    HE3  LYS  14           HE1      LYS  14  44.758  11.770  -2.753
  107    HZ1  LYS  14           HZ1      LYS  14  45.713   9.344  -3.477
  108    HZ2  LYS  14           HZ2      LYS  14  44.316  10.072  -4.113
  109    HZ3  LYS  14           HZ3      LYS  14  44.188   8.941  -2.852
  110    H    HIS  15           HN       HIS  15  46.233   7.393  -0.666
  111    HA   HIS  15           HA       HIS  15  45.669   5.201  -1.264
  112    HB2  HIS  15           HB2      HIS  15  47.318   6.082  -2.936
  113    HB3  HIS  15           HB1      HIS  15  48.610   5.256  -2.032
  114    HD1  HIS  15           HD1      HIS  15  45.301   4.464  -3.814
  115    HD2  HIS  15           HD2      HIS  15  48.931   2.610  -2.779
  116    HE1  HIS  15           HE1      HIS  15  45.273   2.117  -4.823
  117    H    ILE  16           HN       ILE  16  46.977   5.533   1.494
  118    HA   ILE  16           HA       ILE  16  46.789   3.007   2.364
  119    HB   ILE  16           HB       ILE  16  48.642   2.134   1.147
  120   HG12  ILE  16          HG12      ILE  16  50.042   2.803   3.757
  121   HG13  ILE  16          HG11      ILE  16  48.573   1.805   3.788
  122   HG21  ILE  16          HG21      ILE  16  49.715   4.192   0.362
  123   HG22  ILE  16          HG22      ILE  16  50.927   3.316   1.317
  124   HG23  ILE  16          HG23      ILE  16  50.065   4.678   2.031
  125   HD11  ILE  16           HD1      ILE  16  50.509   0.335   3.676
  126   HD12  ILE  16           HD2      ILE  16  51.147   1.201   2.262
  127   HD13  ILE  16           HD3      ILE  16  49.650   0.251   2.122
  128    H    GLY  17           HN       GLY  17  48.587   5.781   2.557
  129    HA2  GLY  17           HA1      GLY  17  48.609   5.767   5.502
  130    HA3  GLY  17           HA2      GLY  17  49.120   7.102   4.450
  131    H    HIS  18           HN       HIS  18  46.545   6.278   2.838
  132    HA   HIS  18           HA       HIS  18  44.736   8.127   4.402
  133    HB2  HIS  18           HB2      HIS  18  45.050   7.349   1.519
  134    HB3  HIS  18           HB1      HIS  18  43.380   7.622   2.059
  135    HD1  HIS  18           HD1      HIS  18  46.224   9.552   3.635
  136    HD2  HIS  18           HD2      HIS  18  43.280  10.137   0.689
  137    HE1  HIS  18           HE1      HIS  18  46.160  12.051   3.108
  138    H    ALA  19           HN       ALA  19  44.810   4.833   2.900
  139    HA   ALA  19           HA       ALA  19  43.413   3.513   4.920
  140    HB1  ALA  19           HB1      ALA  19  41.408   4.709   4.869
  141    HB2  ALA  19           HB2      ALA  19  41.038   3.448   3.675
  142    HB3  ALA  19           HB3      ALA  19  41.545   5.065   3.130
  143    H    ALA  20           HN       ALA  20  45.045   3.572   2.201
  144    HA   ALA  20           HA       ALA  20  45.560   1.995   0.577
  145    HB1  ALA  20           HB1      ALA  20  45.376  -0.310   1.154
  146    HB2  ALA  20           HB2      ALA  20  44.007  -0.002   2.250
  147    HB3  ALA  20           HB3      ALA  20  45.640   0.556   2.685
  148    H    VAL  21           HN       VAL  21  42.718   3.287   1.044
  149    HA   VAL  21           HA       VAL  21  41.544   2.117  -1.425
  150    HB   VAL  21           HB       VAL  21  39.976   2.379   1.186
  151   HG11  VAL  21          HG11      VAL  21  38.236   1.118  -0.294
  152   HG12  VAL  21          HG12      VAL  21  39.227   1.647  -1.673
  153   HG13  VAL  21          HG13      VAL  21  38.474   2.850  -0.601
  154   HG21  VAL  21          HG21      VAL  21  40.987  -0.052  -0.361
  155   HG22  VAL  21          HG22      VAL  21  39.765  -0.144   0.930
  156   HG23  VAL  21          HG23      VAL  21  41.408   0.418   1.303
  157    H    ASN  22           HN       ASN  22  42.362   4.602   0.672
  158    HA   ASN  22           HA       ASN  22  42.386   6.900   0.014
  159    HB2  ASN  22           HB2      ASN  22  41.138   6.313  -2.172
  160    HB3  ASN  22           HB1      ASN  22  39.638   6.595  -1.251
  161   HD21  ASN  22          HD21      ASN  22  41.564   8.145  -3.404
  162   HD22  ASN  22          HD22      ASN  22  41.422   9.801  -2.806
  163    H    HIS  23           HN       HIS  23  39.525   5.142   1.095
  164    HA   HIS  23           HA       HIS  23  39.393   6.805   3.510
  165    HB2  HIS  23           HB2      HIS  23  37.205   6.948   1.397
  166    HB3  HIS  23           HB1      HIS  23  36.951   7.406   3.098
  167    HD1  HIS  23           HD1      HIS  23  37.765   8.885  -0.054
  168    HD2  HIS  23           HD2      HIS  23  39.135   9.431   3.884
  169    HE1  HIS  23           HE1      HIS  23  38.924  11.160   0.042
  170    H    TYR  24           HN       TYR  24  39.312   5.199   4.948
  171    HA   TYR  24           HA       TYR  24  37.991   2.667   4.356
  172    HB2  TYR  24           HB2      TYR  24  39.968   2.869   5.862
  173    HB3  TYR  24           HB1      TYR  24  38.966   3.775   7.021
  174    HD1  TYR  24           HD1      TYR  24  39.137   0.521   5.139
  175    HD2  TYR  24           HD2      TYR  24  37.628   2.607   8.605
  176    HE1  TYR  24           HE1      TYR  24  38.288  -1.630   6.065
  177    HE2  TYR  24           HE2      TYR  24  36.780   0.454   9.531
  178    HH   TYR  24           HH       TYR  24  36.329  -2.256   7.804
  179    H    LEU  25           HN       LEU  25  36.597   5.504   4.625
  180    HA   LEU  25           HA       LEU  25  34.107   4.380   5.707
  181    HB2  LEU  25           HB2      LEU  25  35.424   5.199   7.740
  182    HB3  LEU  25           HB1      LEU  25  35.295   6.833   7.056
  183    HG   LEU  25           HG       LEU  25  32.695   6.298   6.936
  184   HD11  LEU  25          HD11      LEU  25  33.686   4.311   9.036
  185   HD12  LEU  25          HD12      LEU  25  32.768   3.938   7.557
  186   HD13  LEU  25          HD13      LEU  25  31.997   4.843   8.877
  187   HD21  LEU  25          HD21      LEU  25  34.115   6.790   9.593
  188   HD22  LEU  25          HD22      LEU  25  32.415   7.176   9.235
  189   HD23  LEU  25          HD23      LEU  25  33.721   8.030   8.377
  Start of MODEL   53
    1    H1   GLY   1           HT1      GLY   1  63.034  16.263   8.053
    2    H2   GLY   1           HT2      GLY   1  62.068  17.656   8.164
    3    H3   GLY   1           HT3      GLY   1  63.185  17.292   9.392
    4    HA2  GLY   1           HA1      GLY   1  64.708  18.444   8.400
    5    HA3  GLY   1           HA2      GLY   1  64.577  17.346   7.012
    6    H    TRP   2           HN       TRP   2  62.032  17.850   6.092
    7    HA   TRP   2           HA       TRP   2  61.518  20.693   5.840
    8    HB2  TRP   2           HB2      TRP   2  63.607  20.479   4.459
    9    HB3  TRP   2           HB1      TRP   2  62.742  19.331   3.409
   10    HD1  TRP   2           HD1      TRP   2  61.165  20.300   1.622
   11    HE1  TRP   2           HE1      TRP   2  60.406  22.684   0.909
   12    HE3  TRP   2           HE3      TRP   2  63.100  22.967   5.540
   13    HZ2  TRP   2           HZ2      TRP   2  60.629  25.368   1.929
   14    HZ3  TRP   2           HZ3      TRP   2  62.816  25.438   5.650
   15    HH2  TRP   2           HH2      TRP   2  61.583  26.640   3.849
   16    H    GLY   3           HN       GLY   3  60.613  17.583   5.841
   17    HA2  GLY   3           HA1      GLY   3  58.646  16.515   5.264
   18    HA3  GLY   3           HA2      GLY   3  57.957  18.120   4.949
   19    H    SER   4           HN       SER   4  60.798  17.546   3.170
   20    HA   SER   4           HA       SER   4  61.140  17.242   0.898
   21    HB2  SER   4           HB2      SER   4  60.387  14.922   1.553
   22    HB3  SER   4           HB1      SER   4  58.745  15.373   1.044
   23    HG   SER   4           HG       SER   4  59.420  14.842  -0.875
   24    H    ILE   5           HN       ILE   5  59.835  17.095  -1.333
   25    HA   ILE   5           HA       ILE   5  58.323  19.604  -1.431
   26    HB   ILE   5           HB       ILE   5  58.118  18.981  -3.914
   27   HG12  ILE   5          HG12      ILE   5  60.090  16.789  -3.110
   28   HG13  ILE   5          HG11      ILE   5  58.369  16.481  -3.424
   29   HG21  ILE   5          HG21      ILE   5  60.946  18.969  -2.761
   30   HG22  ILE   5          HG22      ILE   5  59.938  20.428  -2.922
   31   HG23  ILE   5          HG23      ILE   5  60.449  19.537  -4.373
   32   HD11  ILE   5           HD1      ILE   5  58.786  17.660  -5.718
   33   HD12  ILE   5           HD2      ILE   5  59.420  16.014  -5.497
   34   HD13  ILE   5           HD3      ILE   5  60.512  17.409  -5.365
   35    H    PHE   6           HN       PHE   6  56.800  18.350   0.214
   36    HA   PHE   6           HA       PHE   6  54.612  17.700   0.565
   37    HB2  PHE   6           HB2      PHE   6  54.071  17.833  -2.419
   38    HB3  PHE   6           HB1      PHE   6  52.963  18.150  -1.064
   39    HD1  PHE   6           HD1      PHE   6  55.058  19.696  -3.498
   40    HD2  PHE   6           HD2      PHE   6  53.746  20.080   0.598
   41    HE1  PHE   6           HE1      PHE   6  55.658  22.113  -3.531
   42    HE2  PHE   6           HE2      PHE   6  54.350  22.497   0.563
   43    HZ   PHE   6           HZ       PHE   6  55.284  23.518  -1.508
   44    H    LYS   7           HN       LYS   7  56.812  15.996  -1.326
   45    HA   LYS   7           HA       LYS   7  55.490  13.805  -2.392
   46    HB2  LYS   7           HB2      LYS   7  57.970  14.166  -2.366
   47    HB3  LYS   7           HB1      LYS   7  57.993  13.630  -0.668
   48    HG2  LYS   7           HG2      LYS   7  57.096  11.445  -1.294
   49    HG3  LYS   7           HG1      LYS   7  56.902  11.972  -2.984
   50    HD2  LYS   7           HD2      LYS   7  59.328  12.258  -3.211
   51    HD3  LYS   7           HD1      LYS   7  59.562  11.836  -1.497
   52    HE2  LYS   7           HE2      LYS   7  58.251   9.983  -3.530
   53    HE3  LYS   7           HE1      LYS   7  59.979   9.921  -3.105
   54    HZ1  LYS   7           HZ1      LYS   7  57.684   9.005  -1.621
   55    HZ2  LYS   7           HZ2      LYS   7  58.744   9.953  -0.691
   56    HZ3  LYS   7           HZ3      LYS   7  59.316   8.561  -1.481
   57    H    HIS   8           HN       HIS   8  56.406  14.255   1.047
   58    HA   HIS   8           HA       HIS   8  55.000  11.771   1.813
   59    HB2  HIS   8           HB2      HIS   8  56.280  13.950   3.514
   60    HB3  HIS   8           HB1      HIS   8  55.727  12.357   4.085
   61    HD1  HIS   8           HD1      HIS   8  56.764  10.486   1.917
   62    HD2  HIS   8           HD2      HIS   8  59.030  13.707   3.390
   63    HE1  HIS   8           HE1      HIS   8  59.223   9.946   1.485
   64    H    GLY   9           HN       GLY   9  53.012  12.915   0.673
   65    HA2  GLY   9           HA1      GLY   9  51.066  13.349   2.648
   66    HA3  GLY   9           HA2      GLY   9  51.652  14.958   2.189
   67    H    ARG  10           HN       ARG  10  52.244  13.879  -0.592
   68    HA   ARG  10           HA       ARG  10  49.649  14.595  -1.715
   69    HB2  ARG  10           HB2      ARG  10  52.243  13.627  -2.967
   70    HB3  ARG  10           HB1      ARG  10  50.821  14.141  -3.902
   71    HG2  ARG  10           HG2      ARG  10  51.923  16.004  -1.771
   72    HG3  ARG  10           HG1      ARG  10  52.772  15.884  -3.327
   73    HD2  ARG  10           HD2      ARG  10  49.822  16.581  -2.960
   74    HD3  ARG  10           HD1      ARG  10  51.126  17.721  -3.363
   75    HE   ARG  10           HE       ARG  10  50.968  15.505  -5.252
   76   HH11  ARG  10          HH11      ARG  10  48.492  15.992  -6.097
   77   HH12  ARG  10          HH12      ARG  10  48.463  17.527  -6.900
   78   HH21  ARG  10          HH21      ARG  10  51.456  18.604  -5.518
   79   HH22  ARG  10          HH22      ARG  10  50.142  19.006  -6.573
   80    H    HIS  11           HN       HIS  11  50.913  12.319  -3.745
   81    HA   HIS  11           HA       HIS  11  48.752  10.397  -3.075
   82    HB2  HIS  11           HB2      HIS  11  50.659  10.366  -5.444
   83    HB3  HIS  11           HB1      HIS  11  49.125   9.478  -5.272
   84    HD1  HIS  11           HD1      HIS  11  47.242  11.651  -4.243
   85    HD2  HIS  11           HD2      HIS  11  50.066  12.350  -7.278
   86    HE1  HIS  11           HE1      HIS  11  46.415  13.646  -5.607
   87    H    ALA  12           HN       ALA  12  48.978   8.370  -2.686
   88    HA   ALA  12           HA       ALA  12  49.862   6.420  -1.890
   89    HB1  ALA  12           HB1      ALA  12  52.120   5.927  -2.309
   90    HB2  ALA  12           HB2      ALA  12  52.459   7.658  -2.342
   91    HB3  ALA  12           HB3      ALA  12  51.581   6.918  -3.682
   92    H    ALA  13           HN       ALA  13  51.404   9.514  -1.160
   93    HA   ALA  13           HA       ALA  13  52.218   8.714   1.534
   94    HB1  ALA  13           HB1      ALA  13  51.331  11.386   0.294
   95    HB2  ALA  13           HB2      ALA  13  53.004  10.918   0.683
   96    HB3  ALA  13           HB3      ALA  13  51.830  11.196   1.992
   97    H    LYS  14           HN       LYS  14  50.022   8.409  -0.753
   98    HA   LYS  14           HA       LYS  14  47.531   8.502   1.147
   99    HB2  LYS  14           HB2      LYS  14  47.769   9.825  -1.104
  100    HB3  LYS  14           HB1      LYS  14  47.738   8.193  -1.870
  101    HG2  LYS  14           HG2      LYS  14  45.444   7.983  -1.534
  102    HG3  LYS  14           HG1      LYS  14  45.486   8.738   0.074
  103    HD2  LYS  14           HD2      LYS  14  45.520  10.960  -0.895
  104    HD3  LYS  14           HD1      LYS  14  45.747  10.298  -2.532
  105    HE2  LYS  14           HE2      LYS  14  43.540   9.236  -2.450
  106    HE3  LYS  14           HE1      LYS  14  43.316   9.770  -0.766
  107    HZ1  LYS  14           HZ1      LYS  14  42.605  11.153  -3.025
  108    HZ2  LYS  14           HZ2      LYS  14  44.015  11.937  -2.493
  109    HZ3  LYS  14           HZ3      LYS  14  42.685  11.773  -1.448
  110    H    HIS  15           HN       HIS  15  45.859   6.972  -0.189
  111    HA   HIS  15           HA       HIS  15  45.187   4.732  -0.089
  112    HB2  HIS  15           HB2      HIS  15  47.412   4.583  -2.155
  113    HB3  HIS  15           HB1      HIS  15  45.979   3.531  -2.046
  114    HD1  HIS  15           HD1      HIS  15  47.153   6.344  -3.889
  115    HD2  HIS  15           HD2      HIS  15  43.503   5.463  -1.996
  116    HE1  HIS  15           HE1      HIS  15  45.364   7.825  -4.956
  117    H    ILE  16           HN       ILE  16  47.631   5.464   1.626
  118    HA   ILE  16           HA       ILE  16  47.986   3.116   2.867
  119    HB   ILE  16           HB       ILE  16  49.099   1.996   1.087
  120   HG12  ILE  16          HG12      ILE  16  51.510   3.068   2.595
  121   HG13  ILE  16          HG11      ILE  16  50.293   2.105   3.456
  122   HG21  ILE  16          HG21      ILE  16  49.560   3.871  -0.428
  123   HG22  ILE  16          HG22      ILE  16  51.120   3.116  -0.047
  124   HG23  ILE  16          HG23      ILE  16  50.643   4.605   0.769
  125   HD11  ILE  16           HD1      ILE  16  51.946   1.238   1.043
  126   HD12  ILE  16           HD2      ILE  16  50.585   0.298   1.697
  127   HD13  ILE  16           HD3      ILE  16  52.025   0.595   2.696
  128    H    GLY  17           HN       GLY  17  49.563   5.807   1.753
  129    HA2  GLY  17           HA1      GLY  17  50.936   6.274   4.312
  130    HA3  GLY  17           HA2      GLY  17  50.846   7.400   2.944
  131    H    HIS  18           HN       HIS  18  47.844   6.428   2.869
  132    HA   HIS  18           HA       HIS  18  46.898   8.590   4.749
  133    HB2  HIS  18           HB2      HIS  18  45.861   7.271   2.266
  134    HB3  HIS  18           HB1      HIS  18  44.624   7.637   3.485
  135    HD1  HIS  18           HD1      HIS  18  47.653   9.868   3.210
  136    HD2  HIS  18           HD2      HIS  18  43.671   9.809   1.854
  137    HE1  HIS  18           HE1      HIS  18  47.106  12.211   2.348
  138    H    ALA  19           HN       ALA  19  46.490   5.079   4.039
  139    HA   ALA  19           HA       ALA  19  46.357   4.155   6.640
  140    HB1  ALA  19           HB1      ALA  19  43.761   5.475   5.868
  141    HB2  ALA  19           HB2      ALA  19  44.550   5.377   7.461
  142    HB3  ALA  19           HB3      ALA  19  43.679   3.970   6.815
  143    H    ALA  20           HN       ALA  20  46.355   3.745   3.500
  144    HA   ALA  20           HA       ALA  20  46.079   1.919   2.095
  145    HB1  ALA  20           HB1      ALA  20  46.340  -0.258   3.016
  146    HB2  ALA  20           HB2      ALA  20  45.674   0.240   4.589
  147    HB3  ALA  20           HB3      ALA  20  47.274   0.824   4.073
  148    H    VAL  21           HN       VAL  21  43.781   3.335   3.755
  149    HA   VAL  21           HA       VAL  21  41.596   1.810   2.415
  150    HB   VAL  21           HB       VAL  21  41.532   2.591   5.368
  151   HG11  VAL  21          HG11      VAL  21  39.313   2.794   4.540
  152   HG12  VAL  21          HG12      VAL  21  39.361   1.148   5.200
  153   HG13  VAL  21          HG13      VAL  21  39.494   1.405   3.444
  154   HG21  VAL  21          HG21      VAL  21  42.945   0.621   5.050
  155   HG22  VAL  21          HG22      VAL  21  41.729  -0.126   3.987
  156   HG23  VAL  21          HG23      VAL  21  41.386   0.092   5.719
  157    H    ASN  22           HN       ASN  22  43.219   4.587   3.349
  158    HA   ASN  22           HA       ASN  22  42.765   6.722   2.358
  159    HB2  ASN  22           HB2      ASN  22  40.585   5.853   1.306
  160    HB3  ASN  22           HB1      ASN  22  39.787   6.322   2.831
  161   HD21  ASN  22          HD21      ASN  22  38.934   8.390   2.798
  162   HD22  ASN  22          HD22      ASN  22  39.572   9.721   1.827
  163    H    HIS  23           HN       HIS  23  41.009   5.331   5.096
  164    HA   HIS  23           HA       HIS  23  42.206   7.172   6.955
  165    HB2  HIS  23           HB2      HIS  23  40.553   8.735   5.871
  166    HB3  HIS  23           HB1      HIS  23  39.247   7.660   6.422
  167    HD1  HIS  23           HD1      HIS  23  39.682   7.015   9.212
  168    HD2  HIS  23           HD2      HIS  23  40.972  10.728   7.719
  169    HE1  HIS  23           HE1      HIS  23  39.895   8.603  11.202
  170    H    TYR  24           HN       TYR  24  42.612   5.544   8.317
  171    HA   TYR  24           HA       TYR  24  40.464   4.559   9.969
  172    HB2  TYR  24           HB2      TYR  24  40.047   3.127   7.982
  173    HB3  TYR  24           HB1      TYR  24  41.723   2.534   8.072
  174    HD1  TYR  24           HD1      TYR  24  42.334   0.803   9.615
  175    HD2  TYR  24           HD2      TYR  24  38.495   2.745   9.965
  176    HE1  TYR  24           HE1      TYR  24  41.633  -0.887  11.305
  177    HE2  TYR  24           HE2      TYR  24  37.795   1.056  11.656
  178    HH   TYR  24           HH       TYR  24  39.124  -0.349  13.397
  179    H    LEU  25           HN       LEU  25  43.653   5.108   9.088
  180    HA   LEU  25           HA       LEU  25  44.641   3.876  11.660
  181    HB2  LEU  25           HB2      LEU  25  46.183   3.989   9.036
  182    HB3  LEU  25           HB1      LEU  25  46.727   3.264  10.564
  183    HG   LEU  25           HG       LEU  25  44.241   2.332   9.058
  184   HD11  LEU  25          HD11      LEU  25  46.244   2.014   7.650
  185   HD12  LEU  25          HD12      LEU  25  45.655   0.450   8.262
  186   HD13  LEU  25          HD13      LEU  25  47.080   1.216   9.002
  187   HD21  LEU  25          HD21      LEU  25  45.878   1.255  11.397
  188   HD22  LEU  25          HD22      LEU  25  44.779   0.219  10.458
  189   HD23  LEU  25          HD23      LEU  25  44.137   1.616  11.346
  Start of MODEL   54
    1    H1   GLY   1           HT1      GLY   1  71.098  19.019  -3.939
    2    H2   GLY   1           HT2      GLY   1  70.760  17.419  -4.400
    3    H3   GLY   1           HT3      GLY   1  70.534  17.910  -2.789
    4    HA2  GLY   1           HA1      GLY   1  68.807  19.404  -3.440
    5    HA3  GLY   1           HA2      GLY   1  69.054  18.916  -5.128
    6    H    TRP   2           HN       TRP   2  66.877  18.643  -2.867
    7    HA   TRP   2           HA       TRP   2  66.524  15.778  -2.584
    8    HB2  TRP   2           HB2      TRP   2  64.147  16.514  -1.919
    9    HB3  TRP   2           HB1      TRP   2  65.489  17.156  -0.941
   10    HD1  TRP   2           HD1      TRP   2  63.002  18.187  -3.676
   11    HE1  TRP   2           HE1      TRP   2  62.843  20.781  -3.766
   12    HE3  TRP   2           HE3      TRP   2  66.743  19.339  -0.377
   13    HZ2  TRP   2           HZ2      TRP   2  64.177  23.027  -2.552
   14    HZ3  TRP   2           HZ3      TRP   2  67.283  21.714   0.142
   15    HH2  TRP   2           HH2      TRP   2  66.005  23.557  -0.942
   16    H    GLY   3           HN       GLY   3  65.583  14.328  -3.880
   17    HA2  GLY   3           HA1      GLY   3  64.803  15.166  -6.573
   18    HA3  GLY   3           HA2      GLY   3  64.828  13.513  -5.930
   19    H    SER   4           HN       SER   4  63.192  15.362  -3.717
   20    HA   SER   4           HA       SER   4  60.601  15.508  -5.065
   21    HB2  SER   4           HB2      SER   4  61.135  13.280  -3.064
   22    HB3  SER   4           HB1      SER   4  59.511  13.819  -3.544
   23    HG   SER   4           HG       SER   4  59.792  12.947  -5.473
   24    H    ILE   5           HN       ILE   5  58.874  16.216  -3.591
   25    HA   ILE   5           HA       ILE   5  59.628  17.072  -0.893
   26    HB   ILE   5           HB       ILE   5  60.719  18.854  -2.245
   27   HG12  ILE   5          HG12      ILE   5  58.182  19.851  -0.862
   28   HG13  ILE   5          HG11      ILE   5  59.642  19.313  -0.002
   29   HG21  ILE   5          HG21      ILE   5  59.478  20.270  -3.728
   30   HG22  ILE   5          HG22      ILE   5  57.921  19.593  -3.193
   31   HG23  ILE   5          HG23      ILE   5  59.035  18.605  -4.167
   32   HD11  ILE   5           HD1      ILE   5  59.849  21.685  -0.157
   33   HD12  ILE   5           HD2      ILE   5  59.322  21.701  -1.855
   34   HD13  ILE   5           HD3      ILE   5  60.922  21.050  -1.426
   35    H    PHE   6           HN       PHE   6  57.406  17.415  -3.677
   36    HA   PHE   6           HA       PHE   6  55.115  17.749  -1.769
   37    HB2  PHE   6           HB2      PHE   6  53.822  18.389  -3.731
   38    HB3  PHE   6           HB1      PHE   6  55.330  19.332  -3.684
   39    HD1  PHE   6           HD1      PHE   6  53.580  16.476  -5.318
   40    HD2  PHE   6           HD2      PHE   6  57.044  19.051  -5.375
   41    HE1  PHE   6           HE1      PHE   6  54.174  15.628  -7.584
   42    HE2  PHE   6           HE2      PHE   6  57.640  18.200  -7.640
   43    HZ   PHE   6           HZ       PHE   6  56.138  16.577  -8.789
   44    H    LYS   7           HN       LYS   7  56.712  15.421  -3.771
   45    HA   LYS   7           HA       LYS   7  54.383  13.737  -4.249
   46    HB2  LYS   7           HB2      LYS   7  57.369  13.148  -4.321
   47    HB3  LYS   7           HB1      LYS   7  56.101  12.022  -4.859
   48    HG2  LYS   7           HG2      LYS   7  55.294  13.780  -6.467
   49    HG3  LYS   7           HG1      LYS   7  56.680  14.793  -5.993
   50    HD2  LYS   7           HD2      LYS   7  58.190  12.842  -6.634
   51    HD3  LYS   7           HD1      LYS   7  56.752  12.059  -7.334
   52    HE2  LYS   7           HE2      LYS   7  56.401  14.052  -8.790
   53    HE3  LYS   7           HE1      LYS   7  57.879  14.783  -8.120
   54    HZ1  LYS   7           HZ1      LYS   7  57.667  12.963 -10.225
   55    HZ2  LYS   7           HZ2      LYS   7  58.435  12.146  -8.948
   56    HZ3  LYS   7           HZ3      LYS   7  59.080  13.603  -9.539
   57    H    HIS   8           HN       HIS   8  57.282  13.304  -2.162
   58    HA   HIS   8           HA       HIS   8  55.932  11.206  -0.619
   59    HB2  HIS   8           HB2      HIS   8  58.408  11.263  -1.081
   60    HB3  HIS   8           HB1      HIS   8  58.526  12.674  -0.001
   61    HD1  HIS   8           HD1      HIS   8  56.351   9.560   0.508
   62    HD2  HIS   8           HD2      HIS   8  59.720  11.422   2.200
   63    HE1  HIS   8           HE1      HIS   8  56.887   8.333   2.684
   64    H    GLY   9           HN       GLY   9  54.268  13.329  -0.500
   65    HA2  GLY   9           HA1      GLY   9  54.208  13.861   2.370
   66    HA3  GLY   9           HA2      GLY   9  54.552  15.309   1.402
   67    H    ARG  10           HN       ARG  10  52.981  14.403  -0.892
   68    HA   ARG  10           HA       ARG  10  50.220  14.840   0.252
   69    HB2  ARG  10           HB2      ARG  10  51.360  15.603  -2.471
   70    HB3  ARG  10           HB1      ARG  10  49.692  15.892  -1.919
   71    HG2  ARG  10           HG2      ARG  10  50.648  17.212   0.021
   72    HG3  ARG  10           HG1      ARG  10  52.250  17.060  -0.744
   73    HD2  ARG  10           HD2      ARG  10  51.149  19.208  -1.347
   74    HD3  ARG  10           HD1      ARG  10  51.403  18.178  -2.776
   75    HE   ARG  10           HE       ARG  10  49.057  18.038  -3.000
   76   HH11  ARG  10          HH11      ARG  10  48.922  20.646  -1.464
   77   HH12  ARG  10          HH12      ARG  10  47.761  20.264  -0.238
   78   HH21  ARG  10          HH21      ARG  10  47.996  16.838  -0.708
   79   HH22  ARG  10          HH22      ARG  10  47.237  18.108   0.191
   80    H    HIS  11           HN       HIS  11  52.228  12.535  -0.983
   81    HA   HIS  11           HA       HIS  11  49.904  10.897  -1.894
   82    HB2  HIS  11           HB2      HIS  11  52.487  11.261  -3.472
   83    HB3  HIS  11           HB1      HIS  11  51.251  10.025  -3.809
   84    HD1  HIS  11           HD1      HIS  11  48.946  10.813  -4.752
   85    HD2  HIS  11           HD2      HIS  11  51.804  13.868  -4.323
   86    HE1  HIS  11           HE1      HIS  11  48.061  12.865  -5.991
   87    H    ALA  12           HN       ALA  12  50.014   8.856  -1.606
   88    HA   ALA  12           HA       ALA  12  50.601   6.842  -0.687
   89    HB1  ALA  12           HB1      ALA  12  53.129   8.105   0.005
   90    HB2  ALA  12           HB2      ALA  12  52.863   7.487  -1.629
   91    HB3  ALA  12           HB3      ALA  12  52.853   6.389  -0.226
   92    H    ALA  13           HN       ALA  13  51.619   9.888   0.772
   93    HA   ALA  13           HA       ALA  13  51.354   8.900   3.518
   94    HB1  ALA  13           HB1      ALA  13  50.809  11.318   3.990
   95    HB2  ALA  13           HB2      ALA  13  50.841  11.656   2.242
   96    HB3  ALA  13           HB3      ALA  13  52.336  11.184   3.086
   97    H    LYS  14           HN       LYS  14  50.223   8.692   0.555
   98    HA   LYS  14           HA       LYS  14  47.194   8.647   1.339
   99    HB2  LYS  14           HB2      LYS  14  48.227  10.143  -0.548
  100    HB3  LYS  14           HB1      LYS  14  48.559   8.577  -1.376
  101    HG2  LYS  14           HG2      LYS  14  46.327   8.321  -1.980
  102    HG3  LYS  14           HG1      LYS  14  45.712   8.928  -0.428
  103    HD2  LYS  14           HD2      LYS  14  46.203  11.257  -1.163
  104    HD3  LYS  14           HD1      LYS  14  46.778  10.628  -2.726
  105    HE2  LYS  14           HE2      LYS  14  43.969  10.321  -1.578
  106    HE3  LYS  14           HE1      LYS  14  44.444  11.359  -2.943
  107    HZ1  LYS  14           HZ1      LYS  14  45.275   9.261  -4.025
  108    HZ2  LYS  14           HZ2      LYS  14  43.588   9.378  -3.860
  109    HZ3  LYS  14           HZ3      LYS  14  44.482   8.390  -2.805
  110    H    HIS  15           HN       HIS  15  46.235   7.199  -0.642
  111    HA   HIS  15           HA       HIS  15  45.673   4.945  -0.955
  112    HB2  HIS  15           HB2      HIS  15  47.138   5.676  -2.853
  113    HB3  HIS  15           HB1      HIS  15  48.528   4.969  -1.996
  114    HD1  HIS  15           HD1      HIS  15  48.848   2.451  -2.096
  115    HD2  HIS  15           HD2      HIS  15  45.125   3.687  -3.613
  116    HE1  HIS  15           HE1      HIS  15  47.763   0.418  -3.199
  117    H    ILE  16           HN       ILE  16  47.245   5.578   1.621
  118    HA   ILE  16           HA       ILE  16  47.193   3.140   2.744
  119    HB   ILE  16           HB       ILE  16  48.956   2.187   1.456
  120   HG12  ILE  16          HG12      ILE  16  50.547   3.167   3.851
  121   HG13  ILE  16          HG11      ILE  16  49.139   2.113   4.102
  122   HG21  ILE  16          HG21      ILE  16  49.876   4.181   0.371
  123   HG22  ILE  16          HG22      ILE  16  51.203   3.429   1.278
  124   HG23  ILE  16          HG23      ILE  16  50.376   4.837   1.941
  125   HD11  ILE  16           HD1      ILE  16  50.177   0.471   2.461
  126   HD12  ILE  16           HD2      ILE  16  51.092   0.697   3.967
  127   HD13  ILE  16           HD3      ILE  16  51.639   1.483   2.471
  128    H    GLY  17           HN       GLY  17  48.931   5.950   2.500
  129    HA2  GLY  17           HA1      GLY  17  49.199   6.245   5.420
  130    HA3  GLY  17           HA2      GLY  17  49.587   7.471   4.196
  131    H    HIS  18           HN       HIS  18  46.926   6.440   2.894
  132    HA   HIS  18           HA       HIS  18  45.191   8.431   4.341
  133    HB2  HIS  18           HB2      HIS  18  45.324   7.247   1.600
  134    HB3  HIS  18           HB1      HIS  18  43.673   7.421   2.225
  135    HD1  HIS  18           HD1      HIS  18  43.210   9.330   0.480
  136    HD2  HIS  18           HD2      HIS  18  46.309  10.182   3.188
  137    HE1  HIS  18           HE1      HIS  18  43.669  11.839   0.346
  138    H    ALA  19           HN       ALA  19  45.243   4.971   3.327
  139    HA   ALA  19           HA       ALA  19  44.194   3.845   5.628
  140    HB1  ALA  19           HB1      ALA  19  42.161   4.987   5.772
  141    HB2  ALA  19           HB2      ALA  19  41.662   3.600   4.783
  142    HB3  ALA  19           HB3      ALA  19  42.018   5.162   4.006
  143    H    ALA  20           HN       ALA  20  45.420   3.668   2.733
  144    HA   ALA  20           HA       ALA  20  45.762   1.963   1.196
  145    HB1  ALA  20           HB1      ALA  20  46.163   0.721   3.391
  146    HB2  ALA  20           HB2      ALA  20  45.716  -0.285   1.993
  147    HB3  ALA  20           HB3      ALA  20  44.503   0.101   3.237
  148    H    VAL  21           HN       VAL  21  42.961   3.244   1.923
  149    HA   VAL  21           HA       VAL  21  41.492   1.744  -0.208
  150    HB   VAL  21           HB       VAL  21  40.347   2.441   2.538
  151   HG11  VAL  21          HG11      VAL  21  38.575   2.804   0.998
  152   HG12  VAL  21          HG12      VAL  21  38.335   1.120   1.511
  153   HG13  VAL  21          HG13      VAL  21  39.095   1.471  -0.060
  154   HG21  VAL  21          HG21      VAL  21  40.885  -0.225   1.148
  155   HG22  VAL  21          HG22      VAL  21  40.016  -0.040   2.691
  156   HG23  VAL  21          HG23      VAL  21  41.733   0.412   2.578
  157    H    ASN  22           HN       ASN  22  42.590   4.523   1.301
  158    HA   ASN  22           HA       ASN  22  42.539   6.662   0.201
  159    HB2  ASN  22           HB2      ASN  22  40.909   5.805  -1.584
  160    HB3  ASN  22           HB1      ASN  22  39.599   6.228  -0.450
  161   HD21  ASN  22          HD21      ASN  22  38.850   8.346  -0.542
  162   HD22  ASN  22          HD22      ASN  22  39.739   9.680  -1.284
  163    H    HIS  23           HN       HIS  23  39.921   5.251   2.110
  164    HA   HIS  23           HA       HIS  23  40.308   7.291   4.170
  165    HB2  HIS  23           HB2      HIS  23  38.874   8.571   2.654
  166    HB3  HIS  23           HB1      HIS  23  37.698   7.237   2.598
  167    HD1  HIS  23           HD1      HIS  23  36.204   6.826   4.685
  168    HD2  HIS  23           HD2      HIS  23  38.916  10.007   5.143
  169    HE1  HIS  23           HE1      HIS  23  35.496   8.139   6.761
  170    H    TYR  24           HN       TYR  24  37.097   6.029   3.797
  171    HA   TYR  24           HA       TYR  24  35.933   4.519   5.118
  172    HB2  TYR  24           HB2      TYR  24  37.240   2.973   3.619
  173    HB3  TYR  24           HB1      TYR  24  38.469   2.850   4.900
  174    HD1  TYR  24           HD1      TYR  24  38.201   1.234   6.620
  175    HD2  TYR  24           HD2      TYR  24  34.769   2.469   4.311
  176    HE1  TYR  24           HE1      TYR  24  36.814  -0.497   7.754
  177    HE2  TYR  24           HE2      TYR  24  33.383   0.738   5.446
  178    HH   TYR  24           HH       TYR  24  34.492  -1.113   8.135
  179    H    LEU  25           HN       LEU  25  38.130   6.411   6.318
  180    HA   LEU  25           HA       LEU  25  38.958   6.868   8.433
  181    HB2  LEU  25           HB2      LEU  25  36.444   6.735   8.837
  182    HB3  LEU  25           HB1      LEU  25  36.705   5.073   9.405
  183    HG   LEU  25           HG       LEU  25  38.485   6.123  11.021
  184   HD11  LEU  25          HD11      LEU  25  36.910   8.589  10.149
  185   HD12  LEU  25          HD12      LEU  25  38.675   8.369  10.169
  186   HD13  LEU  25          HD13      LEU  25  37.781   8.500  11.695
  187   HD21  LEU  25          HD21      LEU  25  36.318   5.163  11.747
  188   HD22  LEU  25          HD22      LEU  25  35.513   6.711  11.395
  189   HD23  LEU  25          HD23      LEU  25  36.725   6.614  12.694
  Start of MODEL   55
    1    H1   GLY   1           HT1      GLY   1  68.207  17.892  -7.023
    2    H2   GLY   1           HT2      GLY   1  67.870  16.296  -7.503
    3    H3   GLY   1           HT3      GLY   1  69.478  16.840  -7.410
    4    HA2  GLY   1           HA1      GLY   1  68.930  15.437  -5.564
    5    HA3  GLY   1           HA2      GLY   1  69.320  17.096  -5.066
    6    H    TRP   2           HN       TRP   2  66.448  15.278  -6.245
    7    HA   TRP   2           HA       TRP   2  64.994  15.918  -3.764
    8    HB2  TRP   2           HB2      TRP   2  64.115  17.104  -6.431
    9    HB3  TRP   2           HB1      TRP   2  63.147  17.098  -4.936
   10    HD1  TRP   2           HD1      TRP   2  65.698  19.073  -6.744
   11    HE1  TRP   2           HE1      TRP   2  66.638  20.992  -5.263
   12    HE3  TRP   2           HE3      TRP   2  63.839  17.580  -2.214
   13    HZ2  TRP   2           HZ2      TRP   2  66.575  21.748  -2.484
   14    HZ3  TRP   2           HZ3      TRP   2  64.291  18.916  -0.161
   15    HH2  TRP   2           HH2      TRP   2  65.656  20.996  -0.292
   16    H    GLY   3           HN       GLY   3  63.818  15.392  -7.100
   17    HA2  GLY   3           HA1      GLY   3  62.763  13.559  -8.044
   18    HA3  GLY   3           HA2      GLY   3  63.503  12.544  -6.790
   19    H    SER   4           HN       SER   4  61.524  15.322  -5.968
   20    HA   SER   4           HA       SER   4  59.036  13.840  -5.744
   21    HB2  SER   4           HB2      SER   4  58.915  13.818  -3.269
   22    HB3  SER   4           HB1      SER   4  60.221  12.775  -3.875
   23    HG   SER   4           HG       SER   4  60.855  14.175  -2.133
   24    H    ILE   5           HN       ILE   5  58.644  15.839  -6.986
   25    HA   ILE   5           HA       ILE   5  58.871  18.420  -5.725
   26    HB   ILE   5           HB       ILE   5  56.825  17.672  -7.856
   27   HG12  ILE   5          HG12      ILE   5  59.802  18.285  -8.160
   28   HG13  ILE   5          HG11      ILE   5  58.997  16.745  -8.539
   29   HG21  ILE   5          HG21      ILE   5  56.884  19.988  -6.713
   30   HG22  ILE   5          HG22      ILE   5  56.978  19.973  -8.488
   31   HG23  ILE   5          HG23      ILE   5  58.452  20.224  -7.520
   32   HD11  ILE   5           HD1      ILE   5  58.737  19.413  -9.965
   33   HD12  ILE   5           HD2      ILE   5  57.508  18.138 -10.155
   34   HD13  ILE   5           HD3      ILE   5  59.192  17.833 -10.642
   35    H    PHE   6           HN       PHE   6  56.441  15.869  -5.693
   36    HA   PHE   6           HA       PHE   6  55.058  17.238  -3.459
   37    HB2  PHE   6           HB2      PHE   6  53.689  16.620  -6.108
   38    HB3  PHE   6           HB1      PHE   6  52.820  16.946  -4.590
   39    HD1  PHE   6           HD1      PHE   6  54.281  18.451  -7.496
   40    HD2  PHE   6           HD2      PHE   6  53.515  19.139  -3.302
   41    HE1  PHE   6           HE1      PHE   6  54.516  20.904  -7.855
   42    HE2  PHE   6           HE2      PHE   6  53.752  21.593  -3.663
   43    HZ   PHE   6           HZ       PHE   6  54.183  22.479  -5.952
   44    H    LYS   7           HN       LYS   7  56.121  14.523  -5.186
   45    HA   LYS   7           HA       LYS   7  54.294  12.494  -4.514
   46    HB2  LYS   7           HB2      LYS   7  57.335  12.320  -4.449
   47    HB3  LYS   7           HB1      LYS   7  56.204  10.955  -4.615
   48    HG2  LYS   7           HG2      LYS   7  55.337  11.931  -6.724
   49    HG3  LYS   7           HG1      LYS   7  56.479  13.287  -6.564
   50    HD2  LYS   7           HD2      LYS   7  58.377  11.682  -6.617
   51    HD3  LYS   7           HD1      LYS   7  57.225  10.340  -6.821
   52    HE2  LYS   7           HE2      LYS   7  56.369  11.490  -8.903
   53    HE3  LYS   7           HE1      LYS   7  57.693  12.667  -8.732
   54    HZ1  LYS   7           HZ1      LYS   7  58.065   9.720  -8.932
   55    HZ2  LYS   7           HZ2      LYS   7  59.286  10.899  -8.906
   56    HZ3  LYS   7           HZ3      LYS   7  58.227  10.798 -10.231
   57    H    HIS   8           HN       HIS   8  57.353  12.884  -2.701
   58    HA   HIS   8           HA       HIS   8  56.129  11.716  -0.314
   59    HB2  HIS   8           HB2      HIS   8  58.510  11.345  -0.932
   60    HB3  HIS   8           HB1      HIS   8  58.828  13.076  -0.674
   61    HD1  HIS   8           HD1      HIS   8  56.325  11.781   1.684
   62    HD2  HIS   8           HD2      HIS   8  60.514  12.101   1.556
   63    HE1  HIS   8           HE1      HIS   8  57.189  11.403   4.058
   64    H    GLY   9           HN       GLY   9  54.385  13.490  -0.412
   65    HA2  GLY   9           HA1      GLY   9  54.985  15.358   1.735
   66    HA3  GLY   9           HA2      GLY   9  54.814  16.172   0.169
   67    H    ARG  10           HN       ARG  10  52.883  13.923  -0.632
   68    HA   ARG  10           HA       ARG  10  50.594  14.303   1.153
   69    HB2  ARG  10           HB2      ARG  10  49.183  15.458  -0.559
   70    HB3  ARG  10           HB1      ARG  10  50.511  16.473   0.052
   71    HG2  ARG  10           HG2      ARG  10  51.878  15.864  -1.934
   72    HG3  ARG  10           HG1      ARG  10  50.527  14.884  -2.552
   73    HD2  ARG  10           HD2      ARG  10  50.511  17.890  -2.050
   74    HD3  ARG  10           HD1      ARG  10  50.474  17.077  -3.632
   75    HE   ARG  10           HE       ARG  10  48.261  16.074  -2.237
   76   HH11  ARG  10          HH11      ARG  10  49.481  19.031  -3.506
   77   HH12  ARG  10          HH12      ARG  10  47.936  19.813  -3.537
   78   HH21  ARG  10          HH21      ARG  10  46.250  17.124  -2.141
   79   HH22  ARG  10          HH22      ARG  10  46.106  18.734  -2.765
   80    H    HIS  11           HN       HIS  11  52.320  12.326  -0.524
   81    HA   HIS  11           HA       HIS  11  49.961  10.731  -1.474
   82    HB2  HIS  11           HB2      HIS  11  52.567  11.123  -3.008
   83    HB3  HIS  11           HB1      HIS  11  51.278   9.974  -3.440
   84    HD1  HIS  11           HD1      HIS  11  52.449  13.086  -4.533
   85    HD2  HIS  11           HD2      HIS  11  48.626  11.691  -3.474
   86    HE1  HIS  11           HE1      HIS  11  50.742  14.670  -5.586
   87    H    ALA  12           HN       ALA  12  50.049   8.671  -1.346
   88    HA   ALA  12           HA       ALA  12  50.588   6.589  -0.560
   89    HB1  ALA  12           HB1      ALA  12  52.832   6.064  -0.137
   90    HB2  ALA  12           HB2      ALA  12  53.138   7.766   0.205
   91    HB3  ALA  12           HB3      ALA  12  52.859   7.250  -1.460
   92    H    ALA  13           HN       ALA  13  51.657   9.499   1.118
   93    HA   ALA  13           HA       ALA  13  51.377   8.316   3.782
   94    HB1  ALA  13           HB1      ALA  13  50.832  11.171   2.769
   95    HB2  ALA  13           HB2      ALA  13  52.399  10.635   3.422
   96    HB3  ALA  13           HB3      ALA  13  50.963  10.673   4.472
   97    H    LYS  14           HN       LYS  14  50.243   8.351   0.810
   98    HA   LYS  14           HA       LYS  14  47.215   8.296   1.595
   99    HB2  LYS  14           HB2      LYS  14  48.272   9.910  -0.175
  100    HB3  LYS  14           HB1      LYS  14  48.579   8.407  -1.120
  101    HG2  LYS  14           HG2      LYS  14  46.342   8.245  -1.744
  102    HG3  LYS  14           HG1      LYS  14  45.736   8.724  -0.141
  103    HD2  LYS  14           HD2      LYS  14  46.037  11.065  -0.635
  104    HD3  LYS  14           HD1      LYS  14  46.953  10.699  -2.117
  105    HE2  LYS  14           HE2      LYS  14  44.590  11.347  -2.605
  106    HE3  LYS  14           HE1      LYS  14  44.958   9.689  -3.137
  107    HZ1  LYS  14           HZ1      LYS  14  43.973   8.860  -1.085
  108    HZ2  LYS  14           HZ2      LYS  14  42.851   9.792  -1.958
  109    HZ3  LYS  14           HZ3      LYS  14  43.615  10.442  -0.586
  110    H    HIS  15           HN       HIS  15  46.230   7.015  -0.498
  111    HA   HIS  15           HA       HIS  15  45.637   4.801  -0.976
  112    HB2  HIS  15           HB2      HIS  15  48.477   5.034  -2.034
  113    HB3  HIS  15           HB1      HIS  15  47.292   3.807  -2.542
  114    HD1  HIS  15           HD1      HIS  15  48.626   6.725  -3.866
  115    HD2  HIS  15           HD2      HIS  15  44.661   5.515  -3.158
  116    HE1  HIS  15           HE1      HIS  15  47.118   8.152  -5.353
  117    H    ILE  16           HN       ILE  16  47.178   5.218   1.645
  118    HA   ILE  16           HA       ILE  16  47.097   2.710   2.591
  119    HB   ILE  16           HB       ILE  16  48.849   1.829   1.246
  120   HG12  ILE  16          HG12      ILE  16  50.442   2.593   3.716
  121   HG13  ILE  16          HG11      ILE  16  49.007   1.558   3.881
  122   HG21  ILE  16          HG21      ILE  16  50.312   4.410   1.939
  123   HG22  ILE  16          HG22      ILE  16  49.822   3.881   0.319
  124   HG23  ILE  16          HG23      ILE  16  51.123   3.039   1.183
  125   HD11  ILE  16           HD1      ILE  16  50.937   0.115   3.654
  126   HD12  ILE  16           HD2      ILE  16  51.498   0.988   2.211
  127   HD13  ILE  16           HD3      ILE  16  50.012   0.010   2.140
  128    H    GLY  17           HN       GLY  17  48.864   5.511   2.557
  129    HA2  GLY  17           HA1      GLY  17  49.116   5.585   5.493
  130    HA3  GLY  17           HA2      GLY  17  49.546   6.886   4.365
  131    H    HIS  18           HN       HIS  18  46.854   5.993   2.982
  132    HA   HIS  18           HA       HIS  18  45.161   7.910   4.587
  133    HB2  HIS  18           HB2      HIS  18  45.272   6.981   1.740
  134    HB3  HIS  18           HB1      HIS  18  43.635   7.202   2.385
  135    HD1  HIS  18           HD1      HIS  18  43.333   9.276   0.781
  136    HD2  HIS  18           HD2      HIS  18  46.372   9.710   3.655
  137    HE1  HIS  18           HE1      HIS  18  43.940  11.754   0.880
  138    H    ALA  19           HN       ALA  19  45.167   4.544   3.276
  139    HA   ALA  19           HA       ALA  19  43.977   3.307   5.468
  140    HB1  ALA  19           HB1      ALA  19  41.924   4.721   3.761
  141    HB2  ALA  19           HB2      ALA  19  41.951   4.479   5.526
  142    HB3  ALA  19           HB3      ALA  19  41.506   3.135   4.455
  143    H    ALA  20           HN       ALA  20  45.308   3.311   2.561
  144    HA   ALA  20           HA       ALA  20  45.707   1.680   0.956
  145    HB1  ALA  20           HB1      ALA  20  44.458  -0.303   2.886
  146    HB2  ALA  20           HB2      ALA  20  46.100   0.346   3.106
  147    HB3  ALA  20           HB3      ALA  20  45.705  -0.600   1.651
  148    H    VAL  21           HN       VAL  21  42.922   2.907   1.694
  149    HA   VAL  21           HA       VAL  21  41.465   1.561  -0.525
  150    HB   VAL  21           HB       VAL  21  40.307   1.954   2.274
  151   HG11  VAL  21          HG11      VAL  21  38.518   2.390   0.780
  152   HG12  VAL  21          HG12      VAL  21  38.339   0.656   1.114
  153   HG13  VAL  21          HG13      VAL  21  39.088   1.194  -0.408
  154   HG21  VAL  21          HG21      VAL  21  41.013  -0.540   0.659
  155   HG22  VAL  21          HG22      VAL  21  40.031  -0.570   2.144
  156   HG23  VAL  21          HG23      VAL  21  41.720  -0.026   2.209
  157    H    ASN  22           HN       ASN  22  42.521   4.184   1.259
  158    HA   ASN  22           HA       ASN  22  42.400   6.445   0.523
  159    HB2  ASN  22           HB2      ASN  22  39.571   5.980  -0.478
  160    HB3  ASN  22           HB1      ASN  22  40.638   7.364  -0.789
  161   HD21  ASN  22          HD21      ASN  22  43.016   6.377  -1.622
  162   HD22  ASN  22          HD22      ASN  22  42.818   5.313  -3.017
  163    H    HIS  23           HN       HIS  23  39.705   4.687   1.948
  164    HA   HIS  23           HA       HIS  23  39.725   6.514   4.259
  165    HB2  HIS  23           HB2      HIS  23  37.316   6.326   2.409
  166    HB3  HIS  23           HB1      HIS  23  37.251   6.968   4.067
  167    HD1  HIS  23           HD1      HIS  23  39.533   8.778   4.399
  168    HD2  HIS  23           HD2      HIS  23  37.640   8.427   0.661
  169    HE1  HIS  23           HE1      HIS  23  40.048  10.906   3.082
  170    H    TYR  24           HN       TYR  24  39.953   4.995   5.773
  171    HA   TYR  24           HA       TYR  24  38.949   2.328   5.580
  172    HB2  TYR  24           HB2      TYR  24  40.768   3.039   7.113
  173    HB3  TYR  24           HB1      TYR  24  39.583   3.947   8.081
  174    HD1  TYR  24           HD1      TYR  24  40.679   0.560   7.007
  175    HD2  TYR  24           HD2      TYR  24  37.992   2.809   9.528
  176    HE1  TYR  24           HE1      TYR  24  40.101  -1.522   8.249
  177    HE2  TYR  24           HE2      TYR  24  37.415   0.727  10.769
  178    HH   TYR  24           HH       TYR  24  37.402  -1.868   9.964
  179    H    LEU  25           HN       LEU  25  37.336   5.283   6.150
  180    HA   LEU  25           HA       LEU  25  34.800   3.926   6.478
  181    HB2  LEU  25           HB2      LEU  25  36.009   3.937   8.833
  182    HB3  LEU  25           HB1      LEU  25  35.533   5.641   8.867
  183    HG   LEU  25           HG       LEU  25  33.795   4.437   9.985
  184   HD11  LEU  25          HD11      LEU  25  33.097   6.173   8.278
  185   HD12  LEU  25          HD12      LEU  25  31.847   4.978   8.690
  186   HD13  LEU  25          HD13      LEU  25  32.735   4.838   7.158
  187   HD21  LEU  25          HD21      LEU  25  32.804   2.411   9.301
  188   HD22  LEU  25          HD22      LEU  25  34.498   2.177   8.822
  189   HD23  LEU  25          HD23      LEU  25  33.281   2.614   7.603
  Start of MODEL   56
    1    H1   GLY   1           HT1      GLY   1  71.253  11.960  -1.924
    2    H2   GLY   1           HT2      GLY   1  69.772  12.789  -1.990
    3    H3   GLY   1           HT3      GLY   1  70.285  11.847  -3.309
    4    HA2  GLY   1           HA1      GLY   1  70.139   9.865  -2.004
    5    HA3  GLY   1           HA2      GLY   1  69.616  10.847  -0.620
    6    H    TRP   2           HN       TRP   2  67.537  10.504  -0.248
    7    HA   TRP   2           HA       TRP   2  65.682   9.554  -2.200
    8    HB2  TRP   2           HB2      TRP   2  65.190  11.060   0.400
    9    HB3  TRP   2           HB1      TRP   2  63.949  10.186  -0.530
   10    HD1  TRP   2           HD1      TRP   2  66.744   9.682   1.930
   11    HE1  TRP   2           HE1      TRP   2  66.978   7.167   2.545
   12    HE3  TRP   2           HE3      TRP   2  63.647   7.689  -1.627
   13    HZ2  TRP   2           HZ2      TRP   2  65.946   4.652   1.599
   14    HZ3  TRP   2           HZ3      TRP   2  63.286   5.229  -1.751
   15    HH2  TRP   2           HH2      TRP   2  64.432   3.709  -0.143
   16    H    GLY   3           HN       GLY   3  65.335  12.699  -0.530
   17    HA2  GLY   3           HA1      GLY   3  64.908  14.811  -1.414
   18    HA3  GLY   3           HA2      GLY   3  65.245  14.187  -3.040
   19    H    SER   4           HN       SER   4  62.919  12.634  -0.914
   20    HA   SER   4           HA       SER   4  60.834  12.665  -2.829
   21    HB2  SER   4           HB2      SER   4  59.347  12.109  -0.918
   22    HB3  SER   4           HB1      SER   4  60.848  11.156  -0.898
   23    HG   SER   4           HG       SER   4  61.668  12.645   0.629
   24    H    ILE   5           HN       ILE   5  59.968  14.419  -3.739
   25    HA   ILE   5           HA       ILE   5  59.920  16.990  -2.438
   26    HB   ILE   5           HB       ILE   5  59.952  16.860  -4.863
   27   HG12  ILE   5          HG12      ILE   5  57.225  17.926  -3.988
   28   HG13  ILE   5          HG11      ILE   5  58.767  18.775  -3.726
   29   HG21  ILE   5          HG21      ILE   5  58.476  14.662  -4.820
   30   HG22  ILE   5          HG22      ILE   5  58.372  15.764  -6.209
   31   HG23  ILE   5          HG23      ILE   5  57.110  15.793  -4.961
   32   HD11  ILE   5           HD1      ILE   5  59.183  18.652  -6.212
   33   HD12  ILE   5           HD2      ILE   5  57.763  19.631  -5.769
   34   HD13  ILE   5           HD3      ILE   5  57.546  17.982  -6.403
   35    H    PHE   6           HN       PHE   6  58.926  16.878  -0.457
   36    HA   PHE   6           HA       PHE   6  57.167  16.712   1.057
   37    HB2  PHE   6           HB2      PHE   6  55.753  17.813  -1.402
   38    HB3  PHE   6           HB1      PHE   6  55.005  17.724   0.211
   39    HD1  PHE   6           HD1      PHE   6  57.409  19.493  -1.917
   40    HD2  PHE   6           HD2      PHE   6  56.025  18.979   2.139
   41    HE1  PHE   6           HE1      PHE   6  58.551  21.608  -1.259
   42    HE2  PHE   6           HE2      PHE   6  57.166  21.094   2.795
   43    HZ   PHE   6           HZ       PHE   6  58.417  22.417   1.094
   44    H    LYS   7           HN       LYS   7  57.707  14.242   0.357
   45    HA   LYS   7           HA       LYS   7  56.826  12.111   0.131
   46    HB2  LYS   7           HB2      LYS   7  54.247  13.500   0.960
   47    HB3  LYS   7           HB1      LYS   7  54.562  11.750   1.019
   48    HG2  LYS   7           HG2      LYS   7  56.436  12.132   2.596
   49    HG3  LYS   7           HG1      LYS   7  56.148  13.882   2.516
   50    HD2  LYS   7           HD2      LYS   7  54.924  13.408   4.443
   51    HD3  LYS   7           HD1      LYS   7  53.647  13.154   3.235
   52    HE2  LYS   7           HE2      LYS   7  55.435  10.950   4.373
   53    HE3  LYS   7           HE1      LYS   7  53.782  11.304   4.921
   54    HZ1  LYS   7           HZ1      LYS   7  54.688  10.210   2.335
   55    HZ2  LYS   7           HZ2      LYS   7  53.212  11.047   2.431
   56    HZ3  LYS   7           HZ3      LYS   7  53.464   9.652   3.368
   57    H    HIS   8           HN       HIS   8  57.244  12.811  -2.268
   58    HA   HIS   8           HA       HIS   8  56.520  12.807  -4.483
   59    HB2  HIS   8           HB2      HIS   8  54.432  10.840  -3.486
   60    HB3  HIS   8           HB1      HIS   8  55.218  10.896  -5.082
   61    HD1  HIS   8           HD1      HIS   8  56.307  10.588  -1.397
   62    HD2  HIS   8           HD2      HIS   8  57.412   9.230  -5.220
   63    HE1  HIS   8           HE1      HIS   8  58.239   8.944  -1.092
   64    H    GLY   9           HN       GLY   9  55.174  14.732  -2.617
   65    HA2  GLY   9           HA1      GLY   9  53.621  16.423  -3.045
   66    HA3  GLY   9           HA2      GLY   9  53.081  15.557  -4.496
   67    H    ARG  10           HN       ARG  10  53.184  14.814  -0.983
   68    HA   ARG  10           HA       ARG  10  51.544  13.998   0.421
   69    HB2  ARG  10           HB2      ARG  10  49.881  15.770  -1.404
   70    HB3  ARG  10           HB1      ARG  10  49.189  14.929   0.001
   71    HG2  ARG  10           HG2      ARG  10  49.844  17.207   0.636
   72    HG3  ARG  10           HG1      ARG  10  50.878  16.026   1.471
   73    HD2  ARG  10           HD2      ARG  10  52.751  16.522   0.122
   74    HD3  ARG  10           HD1      ARG  10  51.755  17.207  -1.187
   75    HE   ARG  10           HE       ARG  10  51.981  19.273  -0.093
   76   HH11  ARG  10          HH11      ARG  10  50.309  18.494   2.255
   77   HH12  ARG  10          HH12      ARG  10  51.406  18.714   3.577
   78   HH21  ARG  10          HH21      ARG  10  54.233  18.775   1.569
   79   HH22  ARG  10          HH22      ARG  10  53.628  18.871   3.189
   80    H    HIS  11           HN       HIS  11  52.305  12.406  -1.949
   81    HA   HIS  11           HA       HIS  11  49.760  10.826  -2.245
   82    HB2  HIS  11           HB2      HIS  11  52.097  11.099  -4.177
   83    HB3  HIS  11           HB1      HIS  11  50.747   9.956  -4.378
   84    HD1  HIS  11           HD1      HIS  11  48.617  12.129  -3.162
   85    HD2  HIS  11           HD2      HIS  11  51.165  12.576  -6.477
   86    HE1  HIS  11           HE1      HIS  11  47.629  13.965  -4.639
   87    H    ALA  12           HN       ALA  12  50.351  10.160  -0.209
   88    HA   ALA  12           HA       ALA  12  51.144   7.478  -0.114
   89    HB1  ALA  12           HB1      ALA  12  53.396   8.356  -0.576
   90    HB2  ALA  12           HB2      ALA  12  53.306   7.905   1.140
   91    HB3  ALA  12           HB3      ALA  12  53.050   9.596   0.632
   92    H    ALA  13           HN       ALA  13  51.191  10.734   1.112
   93    HA   ALA  13           HA       ALA  13  50.448  10.031   3.870
   94    HB1  ALA  13           HB1      ALA  13  51.104  12.413   3.182
   95    HB2  ALA  13           HB2      ALA  13  49.477  12.317   3.897
   96    HB3  ALA  13           HB3      ALA  13  49.668  12.446   2.132
   97    H    LYS  14           HN       LYS  14  50.074   9.406   0.731
   98    HA   LYS  14           HA       LYS  14  47.037   8.747   0.857
   99    HB2  LYS  14           HB2      LYS  14  48.188  10.249  -0.904
  100    HB3  LYS  14           HB1      LYS  14  49.056   8.739  -1.415
  101    HG2  LYS  14           HG2      LYS  14  47.143   7.920  -2.480
  102    HG3  LYS  14           HG1      LYS  14  46.028   8.558  -1.246
  103    HD2  LYS  14           HD2      LYS  14  46.223  10.815  -2.214
  104    HD3  LYS  14           HD1      LYS  14  47.402  10.219  -3.407
  105    HE2  LYS  14           HE2      LYS  14  45.695   8.662  -4.313
  106    HE3  LYS  14           HE1      LYS  14  44.514   9.276  -3.132
  107    HZ1  LYS  14           HZ1      LYS  14  45.522  10.505  -5.565
  108    HZ2  LYS  14           HZ2      LYS  14  45.375  11.551  -4.235
  109    HZ3  LYS  14           HZ3      LYS  14  44.024  10.687  -4.794
  110    H    HIS  15           HN       HIS  15  46.887   6.983  -1.077
  111    HA   HIS  15           HA       HIS  15  46.806   4.649  -1.222
  112    HB2  HIS  15           HB2      HIS  15  48.555   5.507  -2.813
  113    HB3  HIS  15           HB1      HIS  15  49.787   5.121  -1.589
  114    HD1  HIS  15           HD1      HIS  15  50.728   2.810  -1.682
  115    HD2  HIS  15           HD2      HIS  15  46.891   3.015  -3.391
  116    HE1  HIS  15           HE1      HIS  15  50.208   0.511  -2.665
  117    H    ILE  16           HN       ILE  16  47.573   5.781   1.537
  118    HA   ILE  16           HA       ILE  16  47.662   3.485   2.915
  119    HB   ILE  16           HB       ILE  16  49.817   2.787   2.177
  120   HG12  ILE  16          HG12      ILE  16  50.427   4.257   4.770
  121   HG13  ILE  16          HG11      ILE  16  49.390   2.816   4.721
  122   HG21  ILE  16          HG21      ILE  16  50.662   5.672   2.697
  123   HG22  ILE  16          HG22      ILE  16  50.612   4.874   1.115
  124   HG23  ILE  16          HG23      ILE  16  51.805   4.379   2.330
  125   HD11  ILE  16           HD1      ILE  16  51.428   1.719   3.426
  126   HD12  ILE  16           HD2      ILE  16  51.503   1.889   5.192
  127   HD13  ILE  16           HD3      ILE  16  52.362   3.047   4.155
  128    H    GLY  17           HN       GLY  17  48.957   6.529   2.733
  129    HA2  GLY  17           HA1      GLY  17  48.449   7.110   5.568
  130    HA3  GLY  17           HA2      GLY  17  48.918   8.281   4.320
  131    H    HIS  18           HN       HIS  18  46.823   6.676   2.598
  132    HA   HIS  18           HA       HIS  18  44.510   8.434   3.398
  133    HB2  HIS  18           HB2      HIS  18  45.427   7.057   0.906
  134    HB3  HIS  18           HB1      HIS  18  43.675   6.981   1.166
  135    HD1  HIS  18           HD1      HIS  18  43.324   8.600  -0.880
  136    HD2  HIS  18           HD2      HIS  18  45.535  10.262   2.285
  137    HE1  HIS  18           HE1      HIS  18  43.376  11.129  -1.233
  138    H    ALA  19           HN       ALA  19  45.376   4.980   2.887
  139    HA   ALA  19           HA       ALA  19  44.033   3.872   5.032
  140    HB1  ALA  19           HB1      ALA  19  41.855   4.619   4.606
  141    HB2  ALA  19           HB2      ALA  19  41.833   3.073   3.734
  142    HB3  ALA  19           HB3      ALA  19  42.080   4.594   2.841
  143    H    ALA  20           HN       ALA  20  45.843   3.713   2.421
  144    HA   ALA  20           HA       ALA  20  46.779   1.984   1.185
  145    HB1  ALA  20           HB1      ALA  20  47.016  -0.145   2.247
  146    HB2  ALA  20           HB2      ALA  20  45.552   0.103   3.230
  147    HB3  ALA  20           HB3      ALA  20  47.017   1.061   3.554
  148    H    VAL  21           HN       VAL  21  43.750   2.754   1.260
  149    HA   VAL  21           HA       VAL  21  42.938   0.795  -0.840
  150    HB   VAL  21           HB       VAL  21  41.262   1.523   1.606
  151   HG11  VAL  21          HG11      VAL  21  39.710   1.425  -0.183
  152   HG12  VAL  21          HG12      VAL  21  39.681  -0.230   0.457
  153   HG13  VAL  21          HG13      VAL  21  40.605   0.134  -1.019
  154   HG21  VAL  21          HG21      VAL  21  42.454  -1.113   0.626
  155   HG22  VAL  21          HG22      VAL  21  41.310  -0.967   1.982
  156   HG23  VAL  21          HG23      VAL  21  42.918  -0.218   2.093
  157    H    ASN  22           HN       ASN  22  43.296   3.854   0.452
  158    HA   ASN  22           HA       ASN  22  43.054   5.860  -0.822
  159    HB2  ASN  22           HB2      ASN  22  40.493   4.763  -2.029
  160    HB3  ASN  22           HB1      ASN  22  41.390   6.219  -2.499
  161   HD21  ASN  22          HD21      ASN  22  44.005   4.551  -1.971
  162   HD22  ASN  22          HD22      ASN  22  44.173   3.631  -3.471
  163    H    HIS  23           HN       HIS  23  40.364   4.098   0.640
  164    HA   HIS  23           HA       HIS  23  39.853   6.385   2.426
  165    HB2  HIS  23           HB2      HIS  23  37.788   5.482   0.380
  166    HB3  HIS  23           HB1      HIS  23  37.403   6.459   1.817
  167    HD1  HIS  23           HD1      HIS  23  39.239   8.658   2.025
  168    HD2  HIS  23           HD2      HIS  23  38.156   7.174  -1.755
  169    HE1  HIS  23           HE1      HIS  23  39.785  10.471   0.311
  170    H    TYR  24           HN       TYR  24  37.305   4.154   1.546
  171    HA   TYR  24           HA       TYR  24  36.288   2.467   2.766
  172    HB2  TYR  24           HB2      TYR  24  38.474   1.340   2.217
  173    HB3  TYR  24           HB1      TYR  24  39.087   1.871   3.802
  174    HD1  TYR  24           HD1      TYR  24  36.314  -0.058   2.158
  175    HD2  TYR  24           HD2      TYR  24  38.568   0.633   5.775
  176    HE1  TYR  24           HE1      TYR  24  35.193  -2.007   3.231
  177    HE2  TYR  24           HE2      TYR  24  37.446  -1.317   6.847
  178    HH   TYR  24           HH       TYR  24  34.731  -2.743   5.782
  179    H    LEU  25           HN       LEU  25  37.371   5.184   4.079
  180    HA   LEU  25           HA       LEU  25  37.195   6.188   6.159
  181    HB2  LEU  25           HB2      LEU  25  34.839   5.794   5.849
  182    HB3  LEU  25           HB1      LEU  25  34.999   4.089   6.321
  183    HG   LEU  25           HG       LEU  25  35.472   4.686   8.621
  184   HD11  LEU  25          HD11      LEU  25  35.405   7.205   9.240
  185   HD12  LEU  25          HD12      LEU  25  35.682   7.511   7.507
  186   HD13  LEU  25          HD13      LEU  25  36.883   6.603   8.456
  187   HD21  LEU  25          HD21      LEU  25  33.396   5.861   9.226
  188   HD22  LEU  25          HD22      LEU  25  33.087   4.726   7.889
  189   HD23  LEU  25          HD23      LEU  25  33.234   6.470   7.561
  Start of MODEL   57
    1    H1   GLY   1           HT1      GLY   1  55.714  22.344 -10.714
    2    H2   GLY   1           HT2      GLY   1  54.204  23.064 -11.020
    3    H3   GLY   1           HT3      GLY   1  54.478  22.240  -9.559
    4    HA2  GLY   1           HA1      GLY   1  55.825  24.705 -10.448
    5    HA3  GLY   1           HA2      GLY   1  54.520  24.604  -9.250
    6    H    TRP   2           HN       TRP   2  56.816  25.813  -8.508
    7    HA   TRP   2           HA       TRP   2  58.486  25.762  -6.906
    8    HB2  TRP   2           HB2      TRP   2  56.612  25.022  -5.476
    9    HB3  TRP   2           HB1      TRP   2  56.947  23.330  -5.910
   10    HD1  TRP   2           HD1      TRP   2  58.658  22.100  -4.476
   11    HE1  TRP   2           HE1      TRP   2  60.397  22.745  -2.654
   12    HE3  TRP   2           HE3      TRP   2  58.293  27.198  -4.779
   13    HZ2  TRP   2           HZ2      TRP   2  61.464  25.161  -1.505
   14    HZ3  TRP   2           HZ3      TRP   2  59.680  28.653  -3.311
   15    HH2  TRP   2           HH2      TRP   2  61.264  27.641  -1.675
   16    H    GLY   3           HN       GLY   3  57.978  22.231  -6.927
   17    HA2  GLY   3           HA1      GLY   3  60.073  21.573  -8.729
   18    HA3  GLY   3           HA2      GLY   3  60.766  21.668  -7.098
   19    H    SER   4           HN       SER   4  57.661  20.886  -6.530
   20    HA   SER   4           HA       SER   4  57.527  18.119  -7.315
   21    HB2  SER   4           HB2      SER   4  57.909  17.126  -5.039
   22    HB3  SER   4           HB1      SER   4  59.382  17.776  -5.792
   23    HG   SER   4           HG       SER   4  57.723  19.045  -3.851
   24    H    ILE   5           HN       ILE   5  55.394  17.988  -7.532
   25    HA   ILE   5           HA       ILE   5  53.576  19.620  -5.991
   26    HB   ILE   5           HB       ILE   5  51.813  18.039  -7.018
   27   HG12  ILE   5          HG12      ILE   5  54.173  17.043  -8.682
   28   HG13  ILE   5          HG11      ILE   5  53.630  16.158  -7.243
   29   HG21  ILE   5          HG21      ILE   5  52.530  20.220  -8.013
   30   HG22  ILE   5          HG22      ILE   5  52.087  19.025  -9.250
   31   HG23  ILE   5          HG23      ILE   5  53.801  19.365  -8.917
   32   HD11  ILE   5           HD1      ILE   5  52.499  15.163  -9.109
   33   HD12  ILE   5           HD2      ILE   5  52.043  16.745  -9.774
   34   HD13  ILE   5           HD3      ILE   5  51.281  16.156  -8.278
   35    H    PHE   6           HN       PHE   6  52.153  16.580  -6.041
   36    HA   PHE   6           HA       PHE   6  52.223  16.443  -3.107
   37    HB2  PHE   6           HB2      PHE   6  51.041  14.314  -4.916
   38    HB3  PHE   6           HB1      PHE   6  50.494  14.857  -3.312
   39    HD1  PHE   6           HD1      PHE   6  49.493  14.897  -6.599
   40    HD2  PHE   6           HD2      PHE   6  50.233  17.682  -3.381
   41    HE1  PHE   6           HE1      PHE   6  47.947  16.535  -7.658
   42    HE2  PHE   6           HE2      PHE   6  48.685  19.316  -4.444
   43    HZ   PHE   6           HZ       PHE   6  47.597  18.770  -6.616
   44    H    LYS   7           HN       LYS   7  54.249  15.389  -5.572
   45    HA   LYS   7           HA       LYS   7  54.947  12.754  -4.794
   46    HB2  LYS   7           HB2      LYS   7  55.738  13.974  -6.849
   47    HB3  LYS   7           HB1      LYS   7  56.849  14.900  -5.810
   48    HG2  LYS   7           HG2      LYS   7  57.962  12.845  -5.093
   49    HG3  LYS   7           HG1      LYS   7  56.794  11.857  -6.002
   50    HD2  LYS   7           HD2      LYS   7  57.553  12.875  -8.118
   51    HD3  LYS   7           HD1      LYS   7  58.697  13.904  -7.224
   52    HE2  LYS   7           HE2      LYS   7  58.716  10.855  -7.305
   53    HE3  LYS   7           HE1      LYS   7  59.858  11.932  -8.144
   54    HZ1  LYS   7           HZ1      LYS   7  61.039  11.605  -6.265
   55    HZ2  LYS   7           HZ2      LYS   7  59.678  11.238  -5.316
   56    HZ3  LYS   7           HZ3      LYS   7  60.063  12.857  -5.666
   57    H    HIS   8           HN       HIS   8  56.023  15.914  -3.544
   58    HA   HIS   8           HA       HIS   8  58.091  14.888  -1.842
   59    HB2  HIS   8           HB2      HIS   8  57.826  17.284  -2.466
   60    HB3  HIS   8           HB1      HIS   8  56.369  17.365  -1.446
   61    HD1  HIS   8           HD1      HIS   8  58.943  15.118  -0.065
   62    HD2  HIS   8           HD2      HIS   8  57.994  19.206   0.201
   63    HE1  HIS   8           HE1      HIS   8  60.217  16.067   1.936
   64    H    GLY   9           HN       GLY   9  56.982  12.931  -1.052
   65    HA2  GLY   9           HA1      GLY   9  55.709  11.770   0.512
   66    HA3  GLY   9           HA2      GLY   9  56.372  12.982   1.622
   67    H    ARG  10           HN       ARG  10  53.647  12.192  -0.519
   68    HA   ARG  10           HA       ARG  10  51.771  13.308   1.387
   69    HB2  ARG  10           HB2      ARG  10  52.814  15.339   0.069
   70    HB3  ARG  10           HB1      ARG  10  51.772  14.790  -1.262
   71    HG2  ARG  10           HG2      ARG  10  49.840  14.821   0.458
   72    HG3  ARG  10           HG1      ARG  10  50.947  15.722   1.518
   73    HD2  ARG  10           HD2      ARG  10  51.237  17.444  -0.240
   74    HD3  ARG  10           HD1      ARG  10  50.133  16.542  -1.304
   75    HE   ARG  10           HE       ARG  10  48.703  16.982   1.075
   76   HH11  ARG  10          HH11      ARG  10  48.558  19.300   1.872
   77   HH12  ARG  10          HH12      ARG  10  48.271  20.459   0.617
   78   HH21  ARG  10          HH21      ARG  10  49.082  18.274  -1.951
   79   HH22  ARG  10          HH22      ARG  10  48.568  19.877  -1.547
   80    H    HIS  11           HN       HIS  11  52.607  11.077  -0.706
   81    HA   HIS  11           HA       HIS  11  49.773  10.436  -1.409
   82    HB2  HIS  11           HB2      HIS  11  50.393   9.783  -3.687
   83    HB3  HIS  11           HB1      HIS  11  50.779  11.502  -3.432
   84    HD1  HIS  11           HD1      HIS  11  53.420  10.987  -1.720
   85    HD2  HIS  11           HD2      HIS  11  52.538   9.327  -5.483
   86    HE1  HIS  11           HE1      HIS  11  55.638  10.308  -2.792
   87    H    ALA  12           HN       ALA  12  49.232   8.437  -1.529
   88    HA   ALA  12           HA       ALA  12  49.236   6.176  -1.140
   89    HB1  ALA  12           HB1      ALA  12  52.123   6.443  -0.864
   90    HB2  ALA  12           HB2      ALA  12  51.380   6.347  -2.462
   91    HB3  ALA  12           HB3      ALA  12  51.254   4.989  -1.317
   92    H    ALA  13           HN       ALA  13  51.389   8.338   0.602
   93    HA   ALA  13           HA       ALA  13  51.258   6.791   3.093
   94    HB1  ALA  13           HB1      ALA  13  51.712   9.731   2.349
   95    HB2  ALA  13           HB2      ALA  13  52.840   8.635   3.183
   96    HB3  ALA  13           HB3      ALA  13  51.399   9.245   4.031
   97    H    LYS  14           HN       LYS  14  49.717   7.700   0.454
   98    HA   LYS  14           HA       LYS  14  46.970   8.281   1.826
   99    HB2  LYS  14           HB2      LYS  14  48.192   9.835   0.067
  100    HB3  LYS  14           HB1      LYS  14  47.764   8.525  -1.091
  101    HG2  LYS  14           HG2      LYS  14  45.331   9.094   0.345
  102    HG3  LYS  14           HG1      LYS  14  46.062  10.691   0.113
  103    HD2  LYS  14           HD2      LYS  14  45.675   8.685  -2.150
  104    HD3  LYS  14           HD1      LYS  14  44.512   9.968  -1.749
  105    HE2  LYS  14           HE2      LYS  14  46.296  11.674  -2.067
  106    HE3  LYS  14           HE1      LYS  14  47.436  10.384  -2.516
  107    HZ1  LYS  14           HZ1      LYS  14  45.972   9.791  -4.352
  108    HZ2  LYS  14           HZ2      LYS  14  46.454  11.416  -4.467
  109    HZ3  LYS  14           HZ3      LYS  14  44.892  11.027  -3.925
  110    H    HIS  15           HN       HIS  15  45.524   7.676  -0.534
  111    HA   HIS  15           HA       HIS  15  44.286   5.746  -1.129
  112    HB2  HIS  15           HB2      HIS  15  45.840   6.476  -2.981
  113    HB3  HIS  15           HB1      HIS  15  46.967   5.206  -2.450
  114    HD1  HIS  15           HD1      HIS  15  43.455   5.690  -3.865
  115    HD2  HIS  15           HD2      HIS  15  46.291   2.633  -3.314
  116    HE1  HIS  15           HE1      HIS  15  42.582   3.613  -5.071
  117    H    ILE  16           HN       ILE  16  45.901   5.349   1.389
  118    HA   ILE  16           HA       ILE  16  45.328   2.841   2.023
  119    HB   ILE  16           HB       ILE  16  46.682   1.724   0.377
  120   HG12  ILE  16          HG12      ILE  16  48.407   1.763   2.882
  121   HG13  ILE  16          HG11      ILE  16  46.842   0.926   2.804
  122   HG21  ILE  16          HG21      ILE  16  49.096   2.228   0.068
  123   HG22  ILE  16          HG22      ILE  16  49.003   3.501   1.288
  124   HG23  ILE  16          HG23      ILE  16  48.149   3.693  -0.260
  125   HD11  ILE  16           HD1      ILE  16  47.860  -0.236   0.659
  126   HD12  ILE  16           HD2      ILE  16  48.366  -0.790   2.268
  127   HD13  ILE  16           HD3      ILE  16  49.419   0.293   1.334
  128    H    GLY  17           HN       GLY  17  47.997   4.808   2.050
  129    HA2  GLY  17           HA1      GLY  17  48.527   4.495   4.882
  130    HA3  GLY  17           HA2      GLY  17  49.180   5.771   3.835
  131    H    HIS  18           HN       HIS  18  46.163   5.925   2.896
  132    HA   HIS  18           HA       HIS  18  45.437   8.008   4.945
  133    HB2  HIS  18           HB2      HIS  18  44.783   7.450   2.089
  134    HB3  HIS  18           HB1      HIS  18  43.366   7.918   3.047
  135    HD1  HIS  18           HD1      HIS  18  46.771   9.283   3.951
  136    HD2  HIS  18           HD2      HIS  18  43.332  10.521   1.868
  137    HE1  HIS  18           HE1      HIS  18  46.984  11.799   3.555
  138    H    ALA  19           HN       ALA  19  44.576   4.828   3.685
  139    HA   ALA  19           HA       ALA  19  43.113   4.211   6.132
  140    HB1  ALA  19           HB1      ALA  19  40.922   3.749   4.920
  141    HB2  ALA  19           HB2      ALA  19  41.552   4.743   3.584
  142    HB3  ALA  19           HB3      ALA  19  41.312   5.463   5.196
  143    H    ALA  20           HN       ALA  20  42.754   3.297   2.703
  144    HA   ALA  20           HA       ALA  20  44.347   0.898   2.931
  145    HB1  ALA  20           HB1      ALA  20  42.445   0.121   4.280
  146    HB2  ALA  20           HB2      ALA  20  42.501  -0.738   2.722
  147    HB3  ALA  20           HB3      ALA  20  41.322   0.572   2.977
  148    H    VAL  21           HN       VAL  21  42.127   3.063   1.444
  149    HA   VAL  21           HA       VAL  21  43.173   2.363  -1.236
  150    HB   VAL  21           HB       VAL  21  40.172   2.345  -0.647
  151   HG11  VAL  21          HG11      VAL  21  40.551   3.306  -2.819
  152   HG12  VAL  21          HG12      VAL  21  40.119   1.608  -3.105
  153   HG13  VAL  21          HG13      VAL  21  41.820   2.119  -3.197
  154   HG21  VAL  21          HG21      VAL  21  42.164   0.142  -1.336
  155   HG22  VAL  21          HG22      VAL  21  40.404  -0.059  -1.506
  156   HG23  VAL  21          HG23      VAL  21  41.110   0.248   0.094
  157    H    ASN  22           HN       ASN  22  41.728   4.462   1.102
  158    HA   ASN  22           HA       ASN  22  42.583   6.880   0.034
  159    HB2  ASN  22           HB2      ASN  22  41.316   6.728  -1.979
  160    HB3  ASN  22           HB1      ASN  22  39.904   6.050  -1.136
  161   HD21  ASN  22          HD21      ASN  22  38.326   7.517  -0.376
  162   HD22  ASN  22          HD22      ASN  22  38.523   9.272  -0.446
  163    H    HIS  23           HN       HIS  23  39.772   5.226   1.475
  164    HA   HIS  23           HA       HIS  23  39.980   6.918   3.875
  165    HB2  HIS  23           HB2      HIS  23  37.656   7.773   3.714
  166    HB3  HIS  23           HB1      HIS  23  38.702   8.419   2.427
  167    HD1  HIS  23           HD1      HIS  23  38.631   5.631   0.749
  168    HD2  HIS  23           HD2      HIS  23  35.341   7.913   2.038
  169    HE1  HIS  23           HE1      HIS  23  36.656   5.038  -0.759
  170    H    TYR  24           HN       TYR  24  39.533   5.727   5.572
  171    HA   TYR  24           HA       TYR  24  38.488   3.049   5.287
  172    HB2  TYR  24           HB2      TYR  24  40.019   3.705   7.118
  173    HB3  TYR  24           HB1      TYR  24  38.773   4.797   7.770
  174    HD1  TYR  24           HD1      TYR  24  36.829   3.934   8.950
  175    HD2  TYR  24           HD2      TYR  24  39.690   1.243   7.159
  176    HE1  TYR  24           HE1      TYR  24  35.811   2.027  10.189
  177    HE2  TYR  24           HE2      TYR  24  38.673  -0.664   8.399
  178    HH   TYR  24           HH       TYR  24  35.893  -0.816   9.735
  179    H    LEU  25           HN       LEU  25  37.038   6.034   5.086
  180    HA   LEU  25           HA       LEU  25  34.555   5.427   6.530
  181    HB2  LEU  25           HB2      LEU  25  34.937   7.505   4.347
  182    HB3  LEU  25           HB1      LEU  25  33.767   7.514   5.687
  183    HG   LEU  25           HG       LEU  25  36.799   7.755   5.928
  184   HD11  LEU  25          HD11      LEU  25  34.579   9.736   6.596
  185   HD12  LEU  25          HD12      LEU  25  35.531   9.770   5.092
  186   HD13  LEU  25          HD13      LEU  25  36.332  10.031   6.661
  187   HD21  LEU  25          HD21      LEU  25  34.573   7.491   7.992
  188   HD22  LEU  25          HD22      LEU  25  36.120   8.280   8.387
  189   HD23  LEU  25          HD23      LEU  25  36.096   6.576   7.880
  Start of MODEL   58
    1    H1   GLY   1           HT1      GLY   1  56.474  18.271  -3.633
    2    H2   GLY   1           HT2      GLY   1  56.656  19.857  -4.216
    3    H3   GLY   1           HT3      GLY   1  55.421  19.490  -3.106
    4    HA2  GLY   1           HA1      GLY   1  57.301  20.657  -2.120
    5    HA3  GLY   1           HA2      GLY   1  56.939  19.079  -1.391
    6    H    TRP   2           HN       TRP   2  59.421  20.964  -2.076
    7    HA   TRP   2           HA       TRP   2  61.667  20.609  -2.525
    8    HB2  TRP   2           HB2      TRP   2  61.192  18.943  -0.619
    9    HB3  TRP   2           HB1      TRP   2  61.145  17.682  -1.873
   10    HD1  TRP   2           HD1      TRP   2  63.542  20.609  -0.965
   11    HE1  TRP   2           HE1      TRP   2  65.996  19.776  -1.172
   12    HE3  TRP   2           HE3      TRP   2  62.638  15.801  -2.475
   13    HZ2  TRP   2           HZ2      TRP   2  67.351  17.343  -1.900
   14    HZ3  TRP   2           HZ3      TRP   2  64.527  14.241  -2.920
   15    HH2  TRP   2           HH2      TRP   2  66.880  15.007  -2.634
   16    H    GLY   3           HN       GLY   3  63.202  18.734  -3.670
   17    HA2  GLY   3           HA1      GLY   3  62.616  18.960  -6.424
   18    HA3  GLY   3           HA2      GLY   3  63.770  17.815  -5.711
   19    H    SER   4           HN       SER   4  61.375  16.783  -4.057
   20    HA   SER   4           HA       SER   4  60.772  14.571  -5.821
   21    HB2  SER   4           HB2      SER   4  59.550  15.470  -3.186
   22    HB3  SER   4           HB1      SER   4  59.133  13.951  -4.011
   23    HG   SER   4           HG       SER   4  61.830  14.364  -3.812
   24    H    ILE   5           HN       ILE   5  59.013  14.114  -7.057
   25    HA   ILE   5           HA       ILE   5  57.386  16.384  -7.900
   26    HB   ILE   5           HB       ILE   5  56.919  13.455  -8.594
   27   HG12  ILE   5          HG12      ILE   5  58.884  15.461  -9.793
   28   HG13  ILE   5          HG11      ILE   5  59.294  13.943  -8.961
   29   HG21  ILE   5          HG21      ILE   5  56.520  15.963 -10.277
   30   HG22  ILE   5          HG22      ILE   5  55.243  15.305  -9.227
   31   HG23  ILE   5          HG23      ILE   5  55.878  14.329 -10.571
   32   HD11  ILE   5           HD1      ILE   5  59.430  13.390 -11.265
   33   HD12  ILE   5           HD2      ILE   5  57.970  14.323 -11.668
   34   HD13  ILE   5           HD3      ILE   5  57.829  12.785 -10.780
   35    H    PHE   6           HN       PHE   6  56.655  16.669  -5.535
   36    HA   PHE   6           HA       PHE   6  54.960  16.512  -3.956
   37    HB2  PHE   6           HB2      PHE   6  53.380  15.730  -6.438
   38    HB3  PHE   6           HB1      PHE   6  52.670  16.227  -4.884
   39    HD1  PHE   6           HD1      PHE   6  52.990  18.544  -4.029
   40    HD2  PHE   6           HD2      PHE   6  54.409  17.350  -7.927
   41    HE1  PHE   6           HE1      PHE   6  53.242  20.938  -4.671
   42    HE2  PHE   6           HE2      PHE   6  54.658  19.746  -8.569
   43    HZ   PHE   6           HZ       PHE   6  54.143  21.536  -6.915
   44    H    LYS   7           HN       LYS   7  56.537  14.006  -4.777
   45    HA   LYS   7           HA       LYS   7  54.700  11.788  -4.399
   46    HB2  LYS   7           HB2      LYS   7  57.723  11.968  -4.071
   47    HB3  LYS   7           HB1      LYS   7  56.780  10.458  -4.096
   48    HG2  LYS   7           HG2      LYS   7  55.911  11.104  -6.368
   49    HG3  LYS   7           HG1      LYS   7  57.008  12.506  -6.342
   50    HD2  LYS   7           HD2      LYS   7  58.923  10.883  -5.959
   51    HD3  LYS   7           HD1      LYS   7  57.773   9.559  -6.263
   52    HE2  LYS   7           HE2      LYS   7  58.621  11.767  -8.178
   53    HE3  LYS   7           HE1      LYS   7  58.844  10.011  -8.366
   54    HZ1  LYS   7           HZ1      LYS   7  56.980  10.284  -9.604
   55    HZ2  LYS   7           HZ2      LYS   7  56.441  11.642  -8.736
   56    HZ3  LYS   7           HZ3      LYS   7  56.229  10.081  -8.097
   57    H    HIS   8           HN       HIS   8  57.384  12.931  -2.295
   58    HA   HIS   8           HA       HIS   8  55.944  11.800   0.065
   59    HB2  HIS   8           HB2      HIS   8  58.392  11.350  -0.329
   60    HB3  HIS   8           HB1      HIS   8  58.698  13.087  -0.094
   61    HD1  HIS   8           HD1      HIS   8  59.388  13.629   2.233
   62    HD2  HIS   8           HD2      HIS   8  56.759  10.349   2.103
   63    HE1  HIS   8           HE1      HIS   8  59.020  12.853   4.639
   64    H    GLY   9           HN       GLY   9  54.270  13.570  -0.339
   65    HA2  GLY   9           HA1      GLY   9  54.753  15.663   1.620
   66    HA3  GLY   9           HA2      GLY   9  54.719  16.296  -0.039
   67    H    ARG  10           HN       ARG  10  52.801  14.060  -0.787
   68    HA   ARG  10           HA       ARG  10  50.408  14.510   0.788
   69    HB2  ARG  10           HB2      ARG  10  49.144  15.727  -1.024
   70    HB3  ARG  10           HB1      ARG  10  50.396  16.704  -0.219
   71    HG2  ARG  10           HG2      ARG  10  51.977  16.142  -2.087
   72    HG3  ARG  10           HG1      ARG  10  50.648  15.288  -2.909
   73    HD2  ARG  10           HD2      ARG  10  50.800  18.249  -2.216
   74    HD3  ARG  10           HD1      ARG  10  50.742  17.517  -3.837
   75    HE   ARG  10           HE       ARG  10  48.414  16.702  -2.397
   76   HH11  ARG  10          HH11      ARG  10  47.042  17.420  -4.382
   77   HH12  ARG  10          HH12      ARG  10  46.810  19.135  -4.437
   78   HH21  ARG  10          HH21      ARG  10  49.356  19.821  -2.187
   79   HH22  ARG  10          HH22      ARG  10  48.118  20.495  -3.194
   80    H    HIS  11           HN       HIS  11  51.981  12.340  -0.378
   81    HA   HIS  11           HA       HIS  11  49.740  10.848  -1.515
   82    HB2  HIS  11           HB2      HIS  11  52.143  11.565  -3.243
   83    HB3  HIS  11           HB1      HIS  11  51.104  10.159  -3.579
   84    HD1  HIS  11           HD1      HIS  11  51.442  13.680  -4.360
   85    HD2  HIS  11           HD2      HIS  11  48.224  11.022  -3.852
   86    HE1  HIS  11           HE1      HIS  11  49.379  14.773  -5.401
   87    H    ALA  12           HN       ALA  12  49.890   8.795  -1.451
   88    HA   ALA  12           HA       ALA  12  50.538   6.709  -0.774
   89    HB1  ALA  12           HB1      ALA  12  53.110   7.923  -0.147
   90    HB2  ALA  12           HB2      ALA  12  52.725   7.451  -1.805
   91    HB3  ALA  12           HB3      ALA  12  52.818   6.233  -0.509
   92    H    ALA  13           HN       ALA  13  51.630   9.606   0.898
   93    HA   ALA  13           HA       ALA  13  51.554   8.362   3.548
   94    HB1  ALA  13           HB1      ALA  13  50.700  10.861   4.031
   95    HB2  ALA  13           HB2      ALA  13  51.351  11.181   2.405
   96    HB3  ALA  13           HB3      ALA  13  52.425  10.584   3.693
   97    H    LYS  14           HN       LYS  14  50.237   8.399   0.659
   98    HA   LYS  14           HA       LYS  14  47.269   8.244   1.634
   99    HB2  LYS  14           HB2      LYS  14  48.155   9.946  -0.146
  100    HB3  LYS  14           HB1      LYS  14  48.451   8.485  -1.157
  101    HG2  LYS  14           HG2      LYS  14  46.185   8.250  -1.636
  102    HG3  LYS  14           HG1      LYS  14  45.667   8.693   0.008
  103    HD2  LYS  14           HD2      LYS  14  46.065  11.085  -0.516
  104    HD3  LYS  14           HD1      LYS  14  46.591  10.638  -2.157
  105    HE2  LYS  14           HE2      LYS  14  43.833  10.185  -0.937
  106    HE3  LYS  14           HE1      LYS  14  44.248  11.319  -2.244
  107    HZ1  LYS  14           HZ1      LYS  14  44.345   8.348  -2.321
  108    HZ2  LYS  14           HZ2      LYS  14  45.035   9.334  -3.521
  109    HZ3  LYS  14           HZ3      LYS  14  43.360   9.376  -3.242
  110    H    HIS  15           HN       HIS  15  46.188   7.001  -0.438
  111    HA   HIS  15           HA       HIS  15  45.624   4.785  -0.942
  112    HB2  HIS  15           HB2      HIS  15  48.385   5.095  -2.177
  113    HB3  HIS  15           HB1      HIS  15  47.156   3.904  -2.668
  114    HD1  HIS  15           HD1      HIS  15  48.413   7.050  -3.712
  115    HD2  HIS  15           HD2      HIS  15  44.518   5.574  -3.125
  116    HE1  HIS  15           HE1      HIS  15  46.829   8.519  -5.077
  117    H    ILE  16           HN       ILE  16  47.271   5.155   1.595
  118    HA   ILE  16           HA       ILE  16  47.333   2.624   2.444
  119    HB   ILE  16           HB       ILE  16  49.079   1.856   0.946
  120   HG12  ILE  16          HG12      ILE  16  50.970   1.339   2.424
  121   HG13  ILE  16          HG11      ILE  16  50.432   2.561   3.592
  122   HG21  ILE  16          HG21      ILE  16  51.298   3.138   0.881
  123   HG22  ILE  16          HG22      ILE  16  50.465   4.452   1.717
  124   HG23  ILE  16          HG23      ILE  16  49.938   3.972   0.092
  125   HD11  ILE  16           HD1      ILE  16  48.431   1.322   4.097
  126   HD12  ILE  16           HD2      ILE  16  49.753   0.134   4.091
  127   HD13  ILE  16           HD3      ILE  16  48.657   0.253   2.694
  128    H    GLY  17           HN       GLY  17  48.986   5.494   2.397
  129    HA2  GLY  17           HA1      GLY  17  49.390   5.518   5.316
  130    HA3  GLY  17           HA2      GLY  17  49.703   6.857   4.198
  131    H    HIS  18           HN       HIS  18  46.979   5.884   2.940
  132    HA   HIS  18           HA       HIS  18  45.243   7.539   4.801
  133    HB2  HIS  18           HB2      HIS  18  45.304   7.027   1.818
  134    HB3  HIS  18           HB1      HIS  18  43.719   7.259   2.569
  135    HD1  HIS  18           HD1      HIS  18  43.543   9.535   1.202
  136    HD2  HIS  18           HD2      HIS  18  46.518   9.427   4.174
  137    HE1  HIS  18           HE1      HIS  18  44.301  11.940   1.611
  138    H    ALA  19           HN       ALA  19  46.158   4.437   3.948
  139    HA   ALA  19           HA       ALA  19  45.304   2.410   4.743
  140    HB1  ALA  19           HB1      ALA  19  42.585   3.589   5.389
  141    HB2  ALA  19           HB2      ALA  19  43.979   3.980   6.428
  142    HB3  ALA  19           HB3      ALA  19  43.485   2.285   6.206
  143    H    ALA  20           HN       ALA  20  44.957   3.865   2.113
  144    HA   ALA  20           HA       ALA  20  43.895   3.516   0.076
  145    HB1  ALA  20           HB1      ALA  20  43.510   0.749   1.280
  146    HB2  ALA  20           HB2      ALA  20  44.931   1.309   0.365
  147    HB3  ALA  20           HB3      ALA  20  43.352   1.161  -0.444
  148    H    VAL  21           HN       VAL  21  42.310   4.085   2.713
  149    HA   VAL  21           HA       VAL  21  39.650   4.023   1.392
  150    HB   VAL  21           HB       VAL  21  40.166   2.723   4.107
  151   HG11  VAL  21          HG11      VAL  21  37.631   3.479   2.599
  152   HG12  VAL  21          HG12      VAL  21  38.055   3.795   4.299
  153   HG13  VAL  21          HG13      VAL  21  37.627   2.152   3.785
  154   HG21  VAL  21          HG21      VAL  21  39.158   0.701   2.863
  155   HG22  VAL  21          HG22      VAL  21  40.792   1.179   2.369
  156   HG23  VAL  21          HG23      VAL  21  39.395   1.630   1.364
  157    H    ASN  22           HN       ASN  22  42.027   5.365   3.430
  158    HA   ASN  22           HA       ASN  22  41.956   7.709   4.039
  159    HB2  ASN  22           HB2      ASN  22  39.549   7.952   3.188
  160    HB3  ASN  22           HB1      ASN  22  39.033   7.403   4.808
  161   HD21  ASN  22          HD21      ASN  22  40.025   8.699   6.712
  162   HD22  ASN  22          HD22      ASN  22  40.235  10.434   6.452
  163    H    HIS  23           HN       HIS  23  40.264   5.097   5.692
  164    HA   HIS  23           HA       HIS  23  41.984   5.348   8.008
  165    HB2  HIS  23           HB2      HIS  23  40.176   5.915   9.650
  166    HB3  HIS  23           HB1      HIS  23  40.593   7.258   8.559
  167    HD1  HIS  23           HD1      HIS  23  38.886   7.895   6.683
  168    HD2  HIS  23           HD2      HIS  23  37.570   4.863   9.285
  169    HE1  HIS  23           HE1      HIS  23  36.383   7.580   6.280
  170    H    TYR  24           HN       TYR  24  42.295   3.302   8.525
  171    HA   TYR  24           HA       TYR  24  40.461   1.211   7.749
  172    HB2  TYR  24           HB2      TYR  24  41.951  -0.265   9.033
  173    HB3  TYR  24           HB1      TYR  24  42.900   0.859   8.030
  174    HD1  TYR  24           HD1      TYR  24  43.995   2.858   9.064
  175    HD2  TYR  24           HD2      TYR  24  42.022  -0.149  11.450
  176    HE1  TYR  24           HE1      TYR  24  45.151   3.713  11.098
  177    HE2  TYR  24           HE2      TYR  24  43.179   0.706  13.484
  178    HH   TYR  24           HH       TYR  24  44.647   2.182  14.290
  179    H    LEU  25           HN       LEU  25  40.142   3.539  10.063
  180    HA   LEU  25           HA       LEU  25  39.207   1.998  12.325
  181    HB2  LEU  25           HB2      LEU  25  38.375   4.812  11.523
  182    HB3  LEU  25           HB1      LEU  25  38.325   4.097  13.149
  183    HG   LEU  25           HG       LEU  25  40.887   4.490  11.532
  184   HD11  LEU  25          HD11      LEU  25  39.781   6.650  12.109
  185   HD12  LEU  25          HD12      LEU  25  41.312   6.420  12.988
  186   HD13  LEU  25          HD13      LEU  25  39.759   6.161  13.820
  187   HD21  LEU  25          HD21      LEU  25  41.247   2.776  13.162
  188   HD22  LEU  25          HD22      LEU  25  40.263   3.612  14.385
  189   HD23  LEU  25          HD23      LEU  25  41.856   4.258  13.930
  Start of MODEL   59
    1    H1   GLY   1           HT1      GLY   1  67.085  21.553  -0.472
    2    H2   GLY   1           HT2      GLY   1  65.595  22.060   0.169
    3    H3   GLY   1           HT3      GLY   1  66.203  22.773  -1.249
    4    HA2  GLY   1           HA1      GLY   1  66.124  20.054  -1.684
    5    HA3  GLY   1           HA2      GLY   1  64.579  20.526  -0.950
    6    H    TRP   2           HN       TRP   2  65.107  19.588  -3.665
    7    HA   TRP   2           HA       TRP   2  65.213  21.612  -5.604
    8    HB2  TRP   2           HB2      TRP   2  63.299  19.259  -5.781
    9    HB3  TRP   2           HB1      TRP   2  64.188  20.067  -7.095
   10    HD1  TRP   2           HD1      TRP   2  64.723  17.726  -4.098
   11    HE1  TRP   2           HE1      TRP   2  66.959  16.433  -4.400
   12    HE3  TRP   2           HE3      TRP   2  66.480  20.114  -8.272
   13    HZ2  TRP   2           HZ2      TRP   2  69.189  16.458  -6.221
   14    HZ3  TRP   2           HZ3      TRP   2  68.663  19.462  -9.274
   15    HH2  TRP   2           HH2      TRP   2  70.018  17.639  -8.254
   16    H    GLY   3           HN       GLY   3  62.121  20.086  -4.624
   17    HA2  GLY   3           HA1      GLY   3  60.718  22.305  -3.733
   18    HA3  GLY   3           HA2      GLY   3  60.620  22.420  -5.503
   19    H    SER   4           HN       SER   4  60.743  19.477  -5.817
   20    HA   SER   4           HA       SER   4  59.154  17.819  -6.165
   21    HB2  SER   4           HB2      SER   4  58.089  16.969  -4.170
   22    HB3  SER   4           HB1      SER   4  59.707  17.550  -3.722
   23    HG   SER   4           HG       SER   4  58.818  19.294  -2.766
   24    H    ILE   5           HN       ILE   5  56.640  17.290  -5.588
   25    HA   ILE   5           HA       ILE   5  54.984  19.739  -5.995
   26    HB   ILE   5           HB       ILE   5  54.743  17.368  -7.899
   27   HG12  ILE   5          HG12      ILE   5  56.229  20.011  -8.257
   28   HG13  ILE   5          HG11      ILE   5  56.933  18.378  -8.295
   29   HG21  ILE   5          HG21      ILE   5  52.783  18.968  -7.416
   30   HG22  ILE   5          HG22      ILE   5  53.259  18.800  -9.120
   31   HG23  ILE   5          HG23      ILE   5  53.759  20.236  -8.194
   32   HD11  ILE   5           HD1      ILE   5  55.277  17.920 -10.250
   33   HD12  ILE   5           HD2      ILE   5  56.689  18.951 -10.585
   34   HD13  ILE   5           HD3      ILE   5  55.092  19.689 -10.321
   35    H    PHE   6           HN       PHE   6  55.381  16.314  -5.304
   36    HA   PHE   6           HA       PHE   6  53.190  16.367  -3.409
   37    HB2  PHE   6           HB2      PHE   6  51.807  14.609  -4.558
   38    HB3  PHE   6           HB1      PHE   6  51.771  16.193  -5.371
   39    HD1  PHE   6           HD1      PHE   6  52.578  16.441  -7.615
   40    HD2  PHE   6           HD2      PHE   6  53.373  12.803  -5.431
   41    HE1  PHE   6           HE1      PHE   6  53.439  15.379  -9.698
   42    HE2  PHE   6           HE2      PHE   6  54.234  11.743  -7.513
   43    HZ   PHE   6           HZ       PHE   6  54.331  13.053  -9.629
   44    H    LYS   7           HN       LYS   7  55.893  15.035  -4.970
   45    HA   LYS   7           HA       LYS   7  55.775  12.356  -3.868
   46    HB2  LYS   7           HB2      LYS   7  57.183  13.097  -5.836
   47    HB3  LYS   7           HB1      LYS   7  58.242  13.939  -4.680
   48    HG2  LYS   7           HG2      LYS   7  58.733  11.839  -3.529
   49    HG3  LYS   7           HG1      LYS   7  57.573  10.966  -4.559
   50    HD2  LYS   7           HD2      LYS   7  58.915  11.480  -6.554
   51    HD3  LYS   7           HD1      LYS   7  60.055  12.426  -5.566
   52    HE2  LYS   7           HE2      LYS   7  60.967  10.179  -5.954
   53    HE3  LYS   7           HE1      LYS   7  60.558  10.372  -4.232
   54    HZ1  LYS   7           HZ1      LYS   7  59.754   8.265  -5.056
   55    HZ2  LYS   7           HZ2      LYS   7  58.891   9.029  -6.304
   56    HZ3  LYS   7           HZ3      LYS   7  58.434   9.264  -4.684
   57    H    HIS   8           HN       HIS   8  56.547  15.482  -2.605
   58    HA   HIS   8           HA       HIS   8  58.255  14.497  -0.428
   59    HB2  HIS   8           HB2      HIS   8  58.427  16.805  -1.393
   60    HB3  HIS   8           HB1      HIS   8  56.823  17.167  -0.710
   61    HD1  HIS   8           HD1      HIS   8  56.656  17.669   1.780
   62    HD2  HIS   8           HD2      HIS   8  60.439  16.220   0.660
   63    HE1  HIS   8           HE1      HIS   8  58.212  17.979   3.782
   64    H    GLY   9           HN       GLY   9  56.120  12.880  -0.322
   65    HA2  GLY   9           HA1      GLY   9  54.647  12.064   1.273
   66    HA3  GLY   9           HA2      GLY   9  55.083  13.425   2.324
   67    H    ARG  10           HN       ARG  10  53.011  12.360  -0.346
   68    HA   ARG  10           HA       ARG  10  50.815  13.975   0.664
   69    HB2  ARG  10           HB2      ARG  10  52.327  15.616  -0.673
   70    HB3  ARG  10           HB1      ARG  10  51.776  14.740  -2.118
   71    HG2  ARG  10           HG2      ARG  10  49.433  15.251  -1.572
   72    HG3  ARG  10           HG1      ARG  10  49.934  16.047  -0.061
   73    HD2  ARG  10           HD2      ARG  10  51.311  17.649  -1.442
   74    HD3  ARG  10           HD1      ARG  10  50.605  16.918  -2.904
   75    HE   ARG  10           HE       ARG  10  48.565  17.792  -1.016
   76   HH11  ARG  10          HH11      ARG  10  50.648  18.598  -3.640
   77   HH12  ARG  10          HH12      ARG  10  49.773  20.029  -4.071
   78   HH21  ARG  10          HH21      ARG  10  47.466  19.713  -1.502
   79   HH22  ARG  10          HH22      ARG  10  47.971  20.659  -2.862
   80    H    HIS  11           HN       HIS  11  52.167  11.434  -0.952
   81    HA   HIS  11           HA       HIS  11  49.508  10.422  -1.722
   82    HB2  HIS  11           HB2      HIS  11  50.455  11.668  -3.771
   83    HB3  HIS  11           HB1      HIS  11  51.720  10.418  -3.809
   84    HD1  HIS  11           HD1      HIS  11  50.615   7.815  -3.664
   85    HD2  HIS  11           HD2      HIS  11  48.199  10.910  -5.169
   86    HE1  HIS  11           HE1      HIS  11  48.756   6.730  -5.040
   87    H    ALA  12           HN       ALA  12  49.285   8.381  -1.765
   88    HA   ALA  12           HA       ALA  12  49.649   6.162  -1.336
   89    HB1  ALA  12           HB1      ALA  12  51.815   5.285  -1.501
   90    HB2  ALA  12           HB2      ALA  12  52.462   6.871  -1.086
   91    HB3  ALA  12           HB3      ALA  12  51.750   6.612  -2.681
   92    H    ALA  13           HN       ALA  13  51.512   8.681   0.272
   93    HA   ALA  13           HA       ALA  13  51.636   7.253   2.827
   94    HB1  ALA  13           HB1      ALA  13  52.946   9.356   2.616
   95    HB2  ALA  13           HB2      ALA  13  51.591   9.650   3.732
   96    HB3  ALA  13           HB3      ALA  13  51.502  10.227   2.050
   97    H    LYS  14           HN       LYS  14  49.897   7.770   0.220
   98    HA   LYS  14           HA       LYS  14  47.147   8.049   1.687
   99    HB2  LYS  14           HB2      LYS  14  48.024   9.705  -0.150
  100    HB3  LYS  14           HB1      LYS  14  47.884   8.290  -1.255
  101    HG2  LYS  14           HG2      LYS  14  45.568   8.474  -1.354
  102    HG3  LYS  14           HG1      LYS  14  45.405   8.866   0.369
  103    HD2  LYS  14           HD2      LYS  14  44.661  10.790  -0.859
  104    HD3  LYS  14           HD1      LYS  14  46.257  11.212  -0.198
  105    HE2  LYS  14           HE2      LYS  14  47.252  10.452  -2.423
  106    HE3  LYS  14           HE1      LYS  14  45.588  10.343  -3.040
  107    HZ1  LYS  14           HZ1      LYS  14  45.513  12.762  -1.991
  108    HZ2  LYS  14           HZ2      LYS  14  46.030  12.481  -3.584
  109    HZ3  LYS  14           HZ3      LYS  14  47.171  12.701  -2.344
  110    H    HIS  15           HN       HIS  15  45.540   7.168  -0.209
  111    HA   HIS  15           HA       HIS  15  44.512   5.129  -0.714
  112    HB2  HIS  15           HB2      HIS  15  47.045   5.184  -2.389
  113    HB3  HIS  15           HB1      HIS  15  45.693   4.066  -2.680
  114    HD1  HIS  15           HD1      HIS  15  46.924   7.319  -3.659
  115    HD2  HIS  15           HD2      HIS  15  43.127   5.616  -3.071
  116    HE1  HIS  15           HE1      HIS  15  45.224   8.827  -4.826
  117    H    ILE  16           HN       ILE  16  46.592   5.003   1.537
  118    HA   ILE  16           HA       ILE  16  46.367   2.435   2.247
  119    HB   ILE  16           HB       ILE  16  47.595   1.510   0.398
  120   HG12  ILE  16          HG12      ILE  16  49.650   1.758   2.634
  121   HG13  ILE  16          HG11      ILE  16  48.250   0.669   2.696
  122   HG21  ILE  16          HG21      ILE  16  49.573   3.753   0.968
  123   HG22  ILE  16          HG22      ILE  16  48.673   3.501  -0.538
  124   HG23  ILE  16          HG23      ILE  16  49.976   2.389  -0.078
  125   HD11  ILE  16           HD1      ILE  16  49.837  -0.804   1.833
  126   HD12  ILE  16           HD2      ILE  16  50.743   0.480   1.008
  127   HD13  ILE  16           HD3      ILE  16  49.227  -0.133   0.304
  128    H    GLY  17           HN       GLY  17  48.392   5.043   1.998
  129    HA2  GLY  17           HA1      GLY  17  49.372   4.707   4.779
  130    HA3  GLY  17           HA2      GLY  17  49.766   6.038   3.675
  131    H    HIS  18           HN       HIS  18  46.710   5.665   2.908
  132    HA   HIS  18           HA       HIS  18  45.756   7.656   4.973
  133    HB2  HIS  18           HB2      HIS  18  45.100   7.043   2.120
  134    HB3  HIS  18           HB1      HIS  18  43.687   7.400   3.128
  135    HD1  HIS  18           HD1      HIS  18  43.349   9.674   1.857
  136    HD2  HIS  18           HD2      HIS  18  47.005   9.365   3.913
  137    HE1  HIS  18           HE1      HIS  18  44.338  12.024   2.014
  138    H    ALA  19           HN       ALA  19  45.137   4.336   3.716
  139    HA   ALA  19           HA       ALA  19  43.488   3.919   6.191
  140    HB1  ALA  19           HB1      ALA  19  41.949   4.779   4.407
  141    HB2  ALA  19           HB2      ALA  19  41.523   3.180   5.056
  142    HB3  ALA  19           HB3      ALA  19  42.308   3.317   3.464
  143    H    ALA  20           HN       ALA  20  46.038   2.886   4.890
  144    HA   ALA  20           HA       ALA  20  47.090   0.819   4.709
  145    HB1  ALA  20           HB1      ALA  20  46.098   0.698   7.030
  146    HB2  ALA  20           HB2      ALA  20  46.429  -0.870   6.254
  147    HB3  ALA  20           HB3      ALA  20  44.764  -0.246   6.325
  148    H    VAL  21           HN       VAL  21  44.175   1.443   3.234
  149    HA   VAL  21           HA       VAL  21  44.476  -0.922   1.477
  150    HB   VAL  21           HB       VAL  21  41.809  -0.326   2.843
  151   HG11  VAL  21          HG11      VAL  21  42.724  -2.391   0.794
  152   HG12  VAL  21          HG12      VAL  21  41.479  -1.136   0.583
  153   HG13  VAL  21          HG13      VAL  21  41.185  -2.504   1.678
  154   HG21  VAL  21          HG21      VAL  21  43.256  -1.423   4.454
  155   HG22  VAL  21          HG22      VAL  21  43.837  -2.575   3.227
  156   HG23  VAL  21          HG23      VAL  21  42.158  -2.658   3.806
  157    H    ASN  22           HN       ASN  22  43.115   2.250   2.257
  158    HA   ASN  22           HA       ASN  22  43.273   3.180  -0.414
  159    HB2  ASN  22           HB2      ASN  22  40.649   3.270  -0.789
  160    HB3  ASN  22           HB1      ASN  22  41.559   1.814  -1.241
  161   HD21  ASN  22          HD21      ASN  22  41.250   2.442   2.202
  162   HD22  ASN  22          HD22      ASN  22  40.010   1.220   2.506
  163    H    HIS  23           HN       HIS  23  40.290   3.593   1.446
  164    HA   HIS  23           HA       HIS  23  41.260   6.157   2.634
  165    HB2  HIS  23           HB2      HIS  23  38.944   5.912   0.678
  166    HB3  HIS  23           HB1      HIS  23  39.211   7.317   1.736
  167    HD1  HIS  23           HD1      HIS  23  39.736   6.438  -1.617
  168    HD2  HIS  23           HD2      HIS  23  42.192   8.174   1.316
  169    HE1  HIS  23           HE1      HIS  23  41.664   7.596  -2.826
  170    H    TYR  24           HN       TYR  24  40.576   6.310   4.655
  171    HA   TYR  24           HA       TYR  24  38.638   4.396   5.697
  172    HB2  TYR  24           HB2      TYR  24  40.558   5.276   7.030
  173    HB3  TYR  24           HB1      TYR  24  39.809   6.890   7.001
  174    HD1  TYR  24           HD1      TYR  24  37.942   7.428   8.431
  175    HD2  TYR  24           HD2      TYR  24  39.364   3.362   8.145
  176    HE1  TYR  24           HE1      TYR  24  36.517   6.792  10.374
  177    HE2  TYR  24           HE2      TYR  24  37.940   2.727  10.089
  178    HH   TYR  24           HH       TYR  24  35.586   4.010  11.227
  179    H    LEU  25           HN       LEU  25  38.364   7.149   3.871
  180    HA   LEU  25           HA       LEU  25  36.050   8.355   5.222
  181    HB2  LEU  25           HB2      LEU  25  36.840   8.749   2.317
  182    HB3  LEU  25           HB1      LEU  25  36.010   9.884   3.408
  183    HG   LEU  25           HG       LEU  25  38.911   8.958   3.591
  184   HD11  LEU  25          HD11      LEU  25  39.443  11.265   3.086
  185   HD12  LEU  25          HD12      LEU  25  37.732  11.744   3.209
  186   HD13  LEU  25          HD13      LEU  25  38.274  10.711   1.864
  187   HD21  LEU  25          HD21      LEU  25  38.947  10.729   5.476
  188   HD22  LEU  25          HD22      LEU  25  38.167   9.178   5.858
  189   HD23  LEU  25          HD23      LEU  25  37.172  10.604   5.474
  Start of MODEL   60
    1    H1   GLY   1           HT1      GLY   1  66.940  14.594  -9.127
    2    H2   GLY   1           HT2      GLY   1  67.637  15.177 -10.562
    3    H3   GLY   1           HT3      GLY   1  66.000  15.485 -10.221
    4    HA2  GLY   1           HA1      GLY   1  68.380  16.797  -9.302
    5    HA3  GLY   1           HA2      GLY   1  66.740  17.430  -9.544
    6    H    TRP   2           HN       TRP   2  65.243  17.384  -7.888
    7    HA   TRP   2           HA       TRP   2  66.242  17.619  -5.253
    8    HB2  TRP   2           HB2      TRP   2  63.434  16.924  -6.203
    9    HB3  TRP   2           HB1      TRP   2  63.854  17.448  -4.555
   10    HD1  TRP   2           HD1      TRP   2  63.290  18.717  -8.059
   11    HE1  TRP   2           HE1      TRP   2  63.462  21.311  -8.125
   12    HE3  TRP   2           HE3      TRP   2  65.137  19.522  -3.354
   13    HZ2  TRP   2           HZ2      TRP   2  64.295  23.422  -6.353
   14    HZ3  TRP   2           HZ3      TRP   2  65.614  21.833  -2.562
   15    HH2  TRP   2           HH2      TRP   2  65.194  23.782  -4.056
   16    H    GLY   3           HN       GLY   3  63.690  15.231  -5.680
   17    HA2  GLY   3           HA1      GLY   3  64.953  12.802  -5.530
   18    HA3  GLY   3           HA2      GLY   3  65.089  13.404  -3.864
   19    H    SER   4           HN       SER   4  62.421  14.905  -4.768
   20    HA   SER   4           HA       SER   4  60.483  12.733  -4.844
   21    HB2  SER   4           HB2      SER   4  60.666  14.319  -2.256
   22    HB3  SER   4           HB1      SER   4  59.522  13.015  -2.641
   23    HG   SER   4           HG       SER   4  61.336  11.616  -2.814
   24    H    ILE   5           HN       ILE   5  59.381  13.747  -6.444
   25    HA   ILE   5           HA       ILE   5  58.897  16.599  -6.445
   26    HB   ILE   5           HB       ILE   5  57.263  14.512  -7.946
   27   HG12  ILE   5          HG12      ILE   5  59.999  15.695  -8.616
   28   HG13  ILE   5          HG11      ILE   5  59.640  13.987  -8.273
   29   HG21  ILE   5          HG21      ILE   5  58.149  17.300  -8.799
   30   HG22  ILE   5          HG22      ILE   5  56.631  17.010  -7.915
   31   HG23  ILE   5          HG23      ILE   5  56.878  16.282  -9.517
   32   HD11  ILE   5           HD1      ILE   5  59.704  14.095 -10.642
   33   HD12  ILE   5           HD2      ILE   5  58.829  15.642 -10.686
   34   HD13  ILE   5           HD3      ILE   5  57.967  14.142 -10.263
   35    H    PHE   6           HN       PHE   6  58.128  16.740  -4.180
   36    HA   PHE   6           HA       PHE   6  56.414  16.979  -2.637
   37    HB2  PHE   6           HB2      PHE   6  54.856  17.233  -5.237
   38    HB3  PHE   6           HB1      PHE   6  54.152  17.556  -3.635
   39    HD1  PHE   6           HD1      PHE   6  54.614  19.603  -2.468
   40    HD2  PHE   6           HD2      PHE   6  56.868  18.576  -6.003
   41    HE1  PHE   6           HE1      PHE   6  55.607  21.888  -2.500
   42    HE2  PHE   6           HE2      PHE   6  57.859  20.862  -6.035
   43    HZ   PHE   6           HZ       PHE   6  57.287  22.491  -4.239
   44    H    LYS   7           HN       LYS   7  57.115  14.238  -3.647
   45    HA   LYS   7           HA       LYS   7  54.620  12.731  -3.687
   46    HB2  LYS   7           HB2      LYS   7  57.513  11.898  -3.236
   47    HB3  LYS   7           HB1      LYS   7  56.159  10.757  -3.387
   48    HG2  LYS   7           HG2      LYS   7  56.634  12.856  -5.541
   49    HG3  LYS   7           HG1      LYS   7  57.594  11.362  -5.527
   50    HD2  LYS   7           HD2      LYS   7  55.422  10.051  -5.488
   51    HD3  LYS   7           HD1      LYS   7  54.557  11.588  -5.726
   52    HE2  LYS   7           HE2      LYS   7  56.514  10.218  -7.597
   53    HE3  LYS   7           HE1      LYS   7  54.833  10.706  -7.916
   54    HZ1  LYS   7           HZ1      LYS   7  55.591  13.045  -7.567
   55    HZ2  LYS   7           HZ2      LYS   7  56.253  12.290  -8.938
   56    HZ3  LYS   7           HZ3      LYS   7  57.190  12.479  -7.533
   57    H    HIS   8           HN       HIS   8  57.330  12.771  -1.326
   58    HA   HIS   8           HA       HIS   8  55.626  11.629   0.757
   59    HB2  HIS   8           HB2      HIS   8  57.625  11.987   2.197
   60    HB3  HIS   8           HB1      HIS   8  58.025  11.134   0.686
   61    HD1  HIS   8           HD1      HIS   8  57.324  14.666   0.032
   62    HD2  HIS   8           HD2      HIS   8  60.674  12.463   1.305
   63    HE1  HIS   8           HE1      HIS   8  59.388  16.116  -0.374
   64    H    GLY   9           HN       GLY   9  54.005  13.496   0.308
   65    HA2  GLY   9           HA1      GLY   9  54.158  15.259   2.597
   66    HA3  GLY   9           HA2      GLY   9  54.459  16.142   1.088
   67    H    ARG  10           HN       ARG  10  52.676  14.175  -0.374
   68    HA   ARG  10           HA       ARG  10  50.008  14.704   0.784
   69    HB2  ARG  10           HB2      ARG  10  49.253  15.864  -1.345
   70    HB3  ARG  10           HB1      ARG  10  50.324  16.830  -0.302
   71    HG2  ARG  10           HG2      ARG  10  52.233  16.395  -1.704
   72    HG3  ARG  10           HG1      ARG  10  51.355  15.150  -2.624
   73    HD2  ARG  10           HD2      ARG  10  51.570  17.450  -3.749
   74    HD3  ARG  10           HD1      ARG  10  49.927  16.773  -3.653
   75    HE   ARG  10           HE       ARG  10  50.382  18.381  -1.334
   76   HH11  ARG  10          HH11      ARG  10  48.058  19.334  -2.014
   77   HH12  ARG  10          HH12      ARG  10  48.244  20.600  -3.179
   78   HH21  ARG  10          HH21      ARG  10  51.485  19.707  -4.028
   79   HH22  ARG  10          HH22      ARG  10  50.184  20.813  -4.319
   80    H    HIS  11           HN       HIS  11  51.794  12.452  -0.075
   81    HA   HIS  11           HA       HIS  11  49.705  10.921  -1.401
   82    HB2  HIS  11           HB2      HIS  11  50.788  12.135  -3.349
   83    HB3  HIS  11           HB1      HIS  11  52.303  11.296  -2.940
   84    HD1  HIS  11           HD1      HIS  11  52.230   8.603  -3.013
   85    HD2  HIS  11           HD2      HIS  11  49.029  10.604  -4.864
   86    HE1  HIS  11           HE1      HIS  11  51.019   6.904  -4.487
   87    H    ALA  12           HN       ALA  12  49.911   8.865  -1.360
   88    HA   ALA  12           HA       ALA  12  50.548   6.796  -0.648
   89    HB1  ALA  12           HB1      ALA  12  52.794   7.612  -1.492
   90    HB2  ALA  12           HB2      ALA  12  52.810   6.362  -0.222
   91    HB3  ALA  12           HB3      ALA  12  53.030   8.065   0.186
   92    H    ALA  13           HN       ALA  13  51.468   9.677   1.168
   93    HA   ALA  13           HA       ALA  13  51.229   8.361   3.775
   94    HB1  ALA  13           HB1      ALA  13  52.129  10.766   3.457
   95    HB2  ALA  13           HB2      ALA  13  50.767  10.637   4.597
   96    HB3  ALA  13           HB3      ALA  13  50.490  11.226   2.940
   97    H    LYS  14           HN       LYS  14  50.109   8.480   0.800
   98    HA   LYS  14           HA       LYS  14  47.082   8.248   1.561
   99    HB2  LYS  14           HB2      LYS  14  48.074   9.991  -0.122
  100    HB3  LYS  14           HB1      LYS  14  48.461   8.547  -1.131
  101    HG2  LYS  14           HG2      LYS  14  46.238   8.293  -1.775
  102    HG3  LYS  14           HG1      LYS  14  45.598   8.704  -0.168
  103    HD2  LYS  14           HD2      LYS  14  46.040  11.114  -0.635
  104    HD3  LYS  14           HD1      LYS  14  46.622  10.676  -2.260
  105    HE2  LYS  14           HE2      LYS  14  44.391   9.609  -2.716
  106    HE3  LYS  14           HE1      LYS  14  43.822  10.212  -1.140
  107    HZ1  LYS  14           HZ1      LYS  14  44.793  12.450  -2.150
  108    HZ2  LYS  14           HZ2      LYS  14  43.195  11.945  -2.431
  109    HZ3  LYS  14           HZ3      LYS  14  44.393  11.677  -3.606
  110    H    HIS  15           HN       HIS  15  46.173   7.024  -0.594
  111    HA   HIS  15           HA       HIS  15  45.680   4.807  -1.175
  112    HB2  HIS  15           HB2      HIS  15  48.494   5.273  -2.226
  113    HB3  HIS  15           HB1      HIS  15  47.419   3.961  -2.766
  114    HD1  HIS  15           HD1      HIS  15  44.862   6.097  -2.341
  115    HD2  HIS  15           HD2      HIS  15  48.165   6.357  -4.933
  116    HE1  HIS  15           HE1      HIS  15  44.215   7.677  -4.244
  117    H    ILE  16           HN       ILE  16  47.178   5.165   1.465
  118    HA   ILE  16           HA       ILE  16  47.223   2.617   2.289
  119    HB   ILE  16           HB       ILE  16  49.024   1.882   0.918
  120   HG12  ILE  16          HG12      ILE  16  50.389   2.652   3.530
  121   HG13  ILE  16          HG11      ILE  16  49.184   1.352   3.423
  122   HG21  ILE  16          HG21      ILE  16  51.237   3.189   0.926
  123   HG22  ILE  16          HG22      ILE  16  50.367   4.488   1.743
  124   HG23  ILE  16          HG23      ILE  16  49.904   4.019   0.098
  125   HD11  ILE  16           HD1      ILE  16  51.171   0.138   3.148
  126   HD12  ILE  16           HD2      ILE  16  51.991   1.457   2.290
  127   HD13  ILE  16           HD3      ILE  16  50.770   0.473   1.449
  128    H    GLY  17           HN       GLY  17  48.877   5.485   2.402
  129    HA2  GLY  17           HA1      GLY  17  49.105   5.440   5.336
  130    HA3  GLY  17           HA2      GLY  17  49.471   6.813   4.272
  131    H    HIS  18           HN       HIS  18  46.834   5.864   2.833
  132    HA   HIS  18           HA       HIS  18  45.042   7.609   4.522
  133    HB2  HIS  18           HB2      HIS  18  45.208   6.828   1.634
  134    HB3  HIS  18           HB1      HIS  18  43.558   6.934   2.278
  135    HD1  HIS  18           HD1      HIS  18  43.162   9.066   0.770
  136    HD2  HIS  18           HD2      HIS  18  46.160   9.513   3.685
  137    HE1  HIS  18           HE1      HIS  18  43.636  11.565   0.999
  138    H    ALA  19           HN       ALA  19  45.204   4.327   3.029
  139    HA   ALA  19           HA       ALA  19  44.122   2.883   5.132
  140    HB1  ALA  19           HB1      ALA  19  41.957   4.341   3.615
  141    HB2  ALA  19           HB2      ALA  19  42.055   3.952   5.351
  142    HB3  ALA  19           HB3      ALA  19  41.625   2.686   4.183
  143    H    ALA  20           HN       ALA  20  45.431   3.111   2.268
  144    HA   ALA  20           HA       ALA  20  45.859   1.623   0.539
  145    HB1  ALA  20           HB1      ALA  20  44.625  -0.514   2.304
  146    HB2  ALA  20           HB2      ALA  20  46.262   0.134   2.571
  147    HB3  ALA  20           HB3      ALA  20  45.873  -0.707   1.050
  148    H    VAL  21           HN       VAL  21  43.011   2.720   1.344
  149    HA   VAL  21           HA       VAL  21  41.641   1.502  -1.007
  150    HB   VAL  21           HB       VAL  21  40.399   1.667   1.781
  151   HG11  VAL  21          HG11      VAL  21  39.282   1.042  -0.979
  152   HG12  VAL  21          HG12      VAL  21  38.648   2.157   0.254
  153   HG13  VAL  21          HG13      VAL  21  38.505   0.404   0.490
  154   HG21  VAL  21          HG21      VAL  21  41.891  -0.257   1.599
  155   HG22  VAL  21          HG22      VAL  21  41.203  -0.692   0.018
  156   HG23  VAL  21          HG23      VAL  21  40.216  -0.838   1.492
  157    H    ASN  22           HN       ASN  22  42.557   4.037   0.992
  158    HA   ASN  22           HA       ASN  22  42.388   6.329   0.314
  159    HB2  ASN  22           HB2      ASN  22  40.899   5.685  -1.688
  160    HB3  ASN  22           HB1      ASN  22  39.517   5.866  -0.576
  161   HD21  ASN  22          HD21      ASN  22  39.088   7.668  -2.346
  162   HD22  ASN  22          HD22      ASN  22  39.762   9.257  -1.967
  163    H    HIS  23           HN       HIS  23  39.788   4.436   1.769
  164    HA   HIS  23           HA       HIS  23  39.901   6.100   4.182
  165    HB2  HIS  23           HB2      HIS  23  37.440   6.119   2.390
  166    HB3  HIS  23           HB1      HIS  23  37.403   6.580   4.109
  167    HD1  HIS  23           HD1      HIS  23  39.366   8.488   4.744
  168    HD2  HIS  23           HD2      HIS  23  38.079   8.244   0.748
  169    HE1  HIS  23           HE1      HIS  23  39.965  10.700   3.615
  170    H    TYR  24           HN       TYR  24  40.174   4.434   5.547
  171    HA   TYR  24           HA       TYR  24  39.089   1.822   5.184
  172    HB2  TYR  24           HB2      TYR  24  40.969   2.343   6.710
  173    HB3  TYR  24           HB1      TYR  24  39.850   3.222   7.780
  174    HD1  TYR  24           HD1      TYR  24  38.196   2.035   9.136
  175    HD2  TYR  24           HD2      TYR  24  40.844  -0.108   6.485
  176    HE1  TYR  24           HE1      TYR  24  37.572  -0.109  10.245
  177    HE2  TYR  24           HE2      TYR  24  40.222  -2.250   7.594
  178    HH   TYR  24           HH       TYR  24  38.943  -3.222   9.171
  179    H    LEU  25           HN       LEU  25  37.589   4.763   6.086
  180    HA   LEU  25           HA       LEU  25  35.527   3.695   7.814
  181    HB2  LEU  25           HB2      LEU  25  35.810   6.215   6.143
  182    HB3  LEU  25           HB1      LEU  25  34.314   5.864   7.039
  183    HG   LEU  25           HG       LEU  25  35.550   5.754   9.148
  184   HD11  LEU  25          HD11      LEU  25  37.662   4.821   8.564
  185   HD12  LEU  25          HD12      LEU  25  38.040   6.489   9.053
  186   HD13  LEU  25          HD13      LEU  25  37.968   6.063   7.326
  187   HD21  LEU  25          HD21      LEU  25  36.367   8.200   7.513
  188   HD22  LEU  25          HD22      LEU  25  36.269   8.110   9.289
  189   HD23  LEU  25          HD23      LEU  25  34.790   7.974   8.307
  Start of MODEL   61
    1    H1   GLY   1           HT1      GLY   1  64.634  14.246  -7.045
    2    H2   GLY   1           HT2      GLY   1  64.230  15.477  -5.946
    3    H3   GLY   1           HT3      GLY   1  64.503  13.893  -5.393
    4    HA2  GLY   1           HA1      GLY   1  66.795  14.160  -6.415
    5    HA3  GLY   1           HA2      GLY   1  66.408  15.891  -6.355
    6    H    TRP   2           HN       TRP   2  65.155  16.350  -4.083
    7    HA   TRP   2           HA       TRP   2  67.259  16.025  -2.109
    8    HB2  TRP   2           HB2      TRP   2  64.398  17.002  -1.750
    9    HB3  TRP   2           HB1      TRP   2  65.756  17.260  -0.627
   10    HD1  TRP   2           HD1      TRP   2  64.492  18.274  -4.106
   11    HE1  TRP   2           HE1      TRP   2  65.705  20.444  -4.870
   12    HE3  TRP   2           HE3      TRP   2  67.884  18.688  -0.294
   13    HZ2  TRP   2           HZ2      TRP   2  67.857  22.109  -3.928
   14    HZ3  TRP   2           HZ3      TRP   2  69.507  20.574  -0.246
   15    HH2  TRP   2           HH2      TRP   2  69.497  22.284  -2.059
   16    H    GLY   3           HN       GLY   3  63.786  15.137  -1.890
   17    HA2  GLY   3           HA1      GLY   3  64.076  12.416  -1.337
   18    HA3  GLY   3           HA2      GLY   3  64.304  13.230   0.225
   19    H    SER   4           HN       SER   4  62.401  15.287  -1.444
   20    HA   SER   4           HA       SER   4  60.158  15.833  -1.227
   21    HB2  SER   4           HB2      SER   4  59.657  12.850  -1.510
   22    HB3  SER   4           HB1      SER   4  58.578  14.186  -1.970
   23    HG   SER   4           HG       SER   4  61.159  14.155  -3.049
   24    H    ILE   5           HN       ILE   5  60.681  16.356   1.056
   25    HA   ILE   5           HA       ILE   5  60.142  14.502   3.174
   26    HB   ILE   5           HB       ILE   5  59.701  17.514   3.330
   27   HG12  ILE   5          HG12      ILE   5  62.303  15.919   3.441
   28   HG13  ILE   5          HG11      ILE   5  61.855  17.130   2.218
   29   HG21  ILE   5          HG21      ILE   5  59.104  15.929   5.269
   30   HG22  ILE   5          HG22      ILE   5  60.242  17.240   5.652
   31   HG23  ILE   5          HG23      ILE   5  60.844  15.585   5.393
   32   HD11  ILE   5           HD1      ILE   5  63.251  18.326   3.718
   33   HD12  ILE   5           HD2      ILE   5  62.527  17.557   5.148
   34   HD13  ILE   5           HD3      ILE   5  61.606  18.774   4.228
   35    H    PHE   6           HN       PHE   6  58.094  16.488   1.132
   36    HA   PHE   6           HA       PHE   6  55.732  16.250   2.845
   37    HB2  PHE   6           HB2      PHE   6  56.120  17.090  -0.054
   38    HB3  PHE   6           HB1      PHE   6  54.552  17.119   0.789
   39    HD1  PHE   6           HD1      PHE   6  57.801  18.768   0.379
   40    HD2  PHE   6           HD2      PHE   6  54.246  18.571   2.819
   41    HE1  PHE   6           HE1      PHE   6  58.377  20.968   1.397
   42    HE2  PHE   6           HE2      PHE   6  54.823  20.771   3.838
   43    HZ   PHE   6           HZ       PHE   6  56.936  21.922   3.193
   44    H    LYS   7           HN       LYS   7  57.201  13.763   2.029
   45    HA   LYS   7           HA       LYS   7  56.684  11.625   1.300
   46    HB2  LYS   7           HB2      LYS   7  53.925  12.688   1.999
   47    HB3  LYS   7           HB1      LYS   7  54.220  10.997   1.533
   48    HG2  LYS   7           HG2      LYS   7  55.794  10.714   3.386
   49    HG3  LYS   7           HG1      LYS   7  55.637  12.433   3.819
   50    HD2  LYS   7           HD2      LYS   7  53.340  12.158   4.468
   51    HD3  LYS   7           HD1      LYS   7  53.261  10.530   3.750
   52    HE2  LYS   7           HE2      LYS   7  53.539  10.646   6.310
   53    HE3  LYS   7           HE1      LYS   7  54.684   9.605   5.431
   54    HZ1  LYS   7           HZ1      LYS   7  55.789  11.039   7.060
   55    HZ2  LYS   7           HZ2      LYS   7  55.207  12.419   6.256
   56    HZ3  LYS   7           HZ3      LYS   7  56.304  11.379   5.480
   57    H    HIS   8           HN       HIS   8  57.483  12.276  -0.826
   58    HA   HIS   8           HA       HIS   8  57.277  12.474  -3.130
   59    HB2  HIS   8           HB2      HIS   8  56.450  10.126  -2.639
   60    HB3  HIS   8           HB1      HIS   8  54.793  10.767  -2.740
   61    HD1  HIS   8           HD1      HIS   8  53.853  11.375  -5.055
   62    HD2  HIS   8           HD2      HIS   8  57.862  10.103  -5.140
   63    HE1  HIS   8           HE1      HIS   8  54.492  11.033  -7.505
   64    H    GLY   9           HN       GLY   9  55.488  14.236  -1.235
   65    HA2  GLY   9           HA1      GLY   9  54.286  16.169  -1.729
   66    HA3  GLY   9           HA2      GLY   9  54.279  15.723  -3.445
   67    H    ARG  10           HN       ARG  10  52.823  14.891  -0.283
   68    HA   ARG  10           HA       ARG  10  50.697  14.154   0.244
   69    HB2  ARG  10           HB2      ARG  10  50.138  15.812  -2.241
   70    HB3  ARG  10           HB1      ARG  10  48.836  15.041  -1.308
   71    HG2  ARG  10           HG2      ARG  10  49.158  17.353  -0.544
   72    HG3  ARG  10           HG1      ARG  10  49.628  16.218   0.741
   73    HD2  ARG  10           HD2      ARG  10  51.936  16.625   0.427
   74    HD3  ARG  10           HD1      ARG  10  51.699  17.279  -1.213
   75    HE   ARG  10           HE       ARG  10  50.320  18.941   0.672
   76   HH11  ARG  10          HH11      ARG  10  52.726  19.142  -1.495
   77   HH12  ARG  10          HH12      ARG  10  53.795  20.136  -0.563
   78   HH21  ARG  10          HH21      ARG  10  52.017  19.741   2.388
   79   HH22  ARG  10          HH22      ARG  10  53.395  20.475   1.635
   80    H    HIS  11           HN       HIS  11  52.249  12.213  -0.933
   81    HA   HIS  11           HA       HIS  11  50.134  10.510  -2.065
   82    HB2  HIS  11           HB2      HIS  11  52.647  11.162  -3.663
   83    HB3  HIS  11           HB1      HIS  11  51.537   9.820  -4.031
   84    HD1  HIS  11           HD1      HIS  11  48.802  10.932  -3.845
   85    HD2  HIS  11           HD2      HIS  11  51.985  13.233  -5.353
   86    HE1  HIS  11           HE1      HIS  11  47.788  12.785  -5.282
   87    H    ALA  12           HN       ALA  12  50.216   9.355  -0.406
   88    HA   ALA  12           HA       ALA  12  51.197   7.025   0.079
   89    HB1  ALA  12           HB1      ALA  12  53.334   7.360   1.359
   90    HB2  ALA  12           HB2      ALA  12  53.253   9.010   0.729
   91    HB3  ALA  12           HB3      ALA  12  53.486   7.645  -0.385
   92    H    ALA  13           HN       ALA  13  51.343  10.329   1.137
   93    HA   ALA  13           HA       ALA  13  50.552   9.756   3.920
   94    HB1  ALA  13           HB1      ALA  13  49.469  12.073   3.668
   95    HB2  ALA  13           HB2      ALA  13  50.110  12.127   2.009
   96    HB3  ALA  13           HB3      ALA  13  51.226  12.085   3.396
   97    H    LYS  14           HN       LYS  14  50.240   8.934   0.844
   98    HA   LYS  14           HA       LYS  14  47.170   8.389   0.935
   99    HB2  LYS  14           HB2      LYS  14  48.366   9.810  -0.890
  100    HB3  LYS  14           HB1      LYS  14  49.182   8.265  -1.350
  101    HG2  LYS  14           HG2      LYS  14  47.250   7.463  -2.382
  102    HG3  LYS  14           HG1      LYS  14  46.160   8.140  -1.150
  103    HD2  LYS  14           HD2      LYS  14  46.396  10.382  -2.167
  104    HD3  LYS  14           HD1      LYS  14  47.518   9.720  -3.380
  105    HE2  LYS  14           HE2      LYS  14  45.661   8.096  -4.042
  106    HE3  LYS  14           HE1      LYS  14  44.570   9.056  -3.015
  107    HZ1  LYS  14           HZ1      LYS  14  45.528  11.024  -4.374
  108    HZ2  LYS  14           HZ2      LYS  14  44.323  10.045  -5.063
  109    HZ3  LYS  14           HZ3      LYS  14  45.949   9.833  -5.504
  110    H    HIS  15           HN       HIS  15  47.004   6.544  -0.949
  111    HA   HIS  15           HA       HIS  15  46.894   4.203  -0.977
  112    HB2  HIS  15           HB2      HIS  15  49.820   4.870  -1.460
  113    HB3  HIS  15           HB1      HIS  15  49.085   3.288  -1.811
  114    HD1  HIS  15           HD1      HIS  15  46.705   3.572  -3.328
  115    HD2  HIS  15           HD2      HIS  15  49.717   6.485  -3.689
  116    HE1  HIS  15           HE1      HIS  15  46.285   4.834  -5.509
  117    H    ILE  16           HN       ILE  16  47.579   5.435   1.725
  118    HA   ILE  16           HA       ILE  16  47.649   3.219   3.222
  119    HB   ILE  16           HB       ILE  16  49.814   2.464   2.567
  120   HG12  ILE  16          HG12      ILE  16  50.536   4.035   5.066
  121   HG13  ILE  16          HG11      ILE  16  49.298   2.763   5.149
  122   HG21  ILE  16          HG21      ILE  16  50.674   4.447   1.405
  123   HG22  ILE  16          HG22      ILE  16  51.812   4.079   2.715
  124   HG23  ILE  16          HG23      ILE  16  50.634   5.376   2.913
  125   HD11  ILE  16           HD1      ILE  16  50.988   1.169   4.110
  126   HD12  ILE  16           HD2      ILE  16  51.409   1.750   5.736
  127   HD13  ILE  16           HD3      ILE  16  52.214   2.442   4.312
  128    H    GLY  17           HN       GLY  17  48.935   6.256   2.901
  129    HA2  GLY  17           HA1      GLY  17  48.394   6.971   5.703
  130    HA3  GLY  17           HA2      GLY  17  48.888   8.081   4.408
  131    H    HIS  18           HN       HIS  18  46.819   6.392   2.738
  132    HA   HIS  18           HA       HIS  18  44.488   8.179   3.444
  133    HB2  HIS  18           HB2      HIS  18  45.462   6.769   0.981
  134    HB3  HIS  18           HB1      HIS  18  43.699   6.797   1.186
  135    HD1  HIS  18           HD1      HIS  18  45.784   9.654   2.512
  136    HD2  HIS  18           HD2      HIS  18  43.327   8.801  -0.793
  137    HE1  HIS  18           HE1      HIS  18  45.396  11.849   1.265
  138    H    ALA  19           HN       ALA  19  45.359   4.707   2.961
  139    HA   ALA  19           HA       ALA  19  43.883   3.654   5.067
  140    HB1  ALA  19           HB1      ALA  19  41.742   4.379   4.462
  141    HB2  ALA  19           HB2      ALA  19  41.787   2.812   3.630
  142    HB3  ALA  19           HB3      ALA  19  42.099   4.310   2.720
  143    H    ALA  20           HN       ALA  20  45.876   3.408   2.585
  144    HA   ALA  20           HA       ALA  20  46.892   1.628   1.486
  145    HB1  ALA  20           HB1      ALA  20  45.522  -0.178   3.503
  146    HB2  ALA  20           HB2      ALA  20  46.955   0.799   3.900
  147    HB3  ALA  20           HB3      ALA  20  47.052  -0.454   2.640
  148    H    VAL  21           HN       VAL  21  43.861   2.392   1.331
  149    HA   VAL  21           HA       VAL  21  43.210   0.401  -0.785
  150    HB   VAL  21           HB       VAL  21  41.404   1.064   1.588
  151   HG11  VAL  21          HG11      VAL  21  40.855  -0.254  -1.097
  152   HG12  VAL  21          HG12      VAL  21  39.923   1.012  -0.263
  153   HG13  VAL  21          HG13      VAL  21  39.873  -0.660   0.330
  154   HG21  VAL  21          HG21      VAL  21  43.032  -0.686   2.107
  155   HG22  VAL  21          HG22      VAL  21  42.665  -1.531   0.586
  156   HG23  VAL  21          HG23      VAL  21  41.443  -1.446   1.878
  157    H    ASN  22           HN       ASN  22  43.423   3.456   0.535
  158    HA   ASN  22           HA       ASN  22  43.193   5.475  -0.707
  159    HB2  ASN  22           HB2      ASN  22  40.774   4.327  -2.141
  160    HB3  ASN  22           HB1      ASN  22  41.690   5.797  -2.528
  161   HD21  ASN  22          HD21      ASN  22  41.201   2.948  -3.914
  162   HD22  ASN  22          HD22      ASN  22  42.828   2.557  -4.480
  163    H    HIS  23           HN       HIS  23  40.481   3.568   0.487
  164    HA   HIS  23           HA       HIS  23  39.788   5.564   2.444
  165    HB2  HIS  23           HB2      HIS  23  37.493   6.095   1.508
  166    HB3  HIS  23           HB1      HIS  23  38.850   6.844   0.634
  167    HD1  HIS  23           HD1      HIS  23  39.480   5.882  -1.716
  168    HD2  HIS  23           HD2      HIS  23  36.050   4.174   0.018
  169    HE1  HIS  23           HE1      HIS  23  38.294   4.537  -3.537
  170    H    TYR  24           HN       TYR  24  39.621   3.997   3.953
  171    HA   TYR  24           HA       TYR  24  38.427   1.432   3.516
  172    HB2  TYR  24           HB2      TYR  24  39.953   1.895   5.387
  173    HB3  TYR  24           HB1      TYR  24  38.766   3.019   6.094
  174    HD1  TYR  24           HD1      TYR  24  39.501  -0.544   5.317
  175    HD2  TYR  24           HD2      TYR  24  36.763   2.204   7.211
  176    HE1  TYR  24           HE1      TYR  24  38.374  -2.452   6.458
  177    HE2  TYR  24           HE2      TYR  24  35.636   0.296   8.350
  178    HH   TYR  24           HH       TYR  24  35.866  -1.945   8.883
  179    H    LEU  25           HN       LEU  25  37.019   4.508   3.668
  180    HA   LEU  25           HA       LEU  25  34.538   3.774   5.000
  181    HB2  LEU  25           HB2      LEU  25  35.411   6.087   3.240
  182    HB3  LEU  25           HB1      LEU  25  33.733   5.935   3.794
  183    HG   LEU  25           HG       LEU  25  35.280   7.405   5.218
  184   HD11  LEU  25          HD11      LEU  25  34.149   5.100   6.850
  185   HD12  LEU  25          HD12      LEU  25  33.088   6.241   5.997
  186   HD13  LEU  25          HD13      LEU  25  34.205   6.830   7.245
  187   HD21  LEU  25          HD21      LEU  25  36.867   6.361   6.700
  188   HD22  LEU  25          HD22      LEU  25  37.231   5.785   5.058
  189   HD23  LEU  25          HD23      LEU  25  36.366   4.729   6.200
  Start of MODEL   62
    1    H1   GLY   1           HT1      GLY   1  61.454  22.216 -11.368
    2    H2   GLY   1           HT2      GLY   1  61.963  20.674 -10.867
    3    H3   GLY   1           HT3      GLY   1  63.075  21.760 -11.555
    4    HA2  GLY   1           HA1      GLY   1  63.312  22.960  -9.717
    5    HA3  GLY   1           HA2      GLY   1  61.636  22.660  -9.217
    6    H    TRP   2           HN       TRP   2  61.761  21.814  -7.236
    7    HA   TRP   2           HA       TRP   2  63.886  20.264  -6.206
    8    HB2  TRP   2           HB2      TRP   2  60.934  20.106  -5.476
    9    HB3  TRP   2           HB1      TRP   2  62.294  19.547  -4.472
   10    HD1  TRP   2           HD1      TRP   2  63.859  21.386  -3.375
   11    HE1  TRP   2           HE1      TRP   2  63.536  23.918  -2.876
   12    HE3  TRP   2           HE3      TRP   2  59.807  22.289  -6.371
   13    HZ2  TRP   2           HZ2      TRP   2  61.745  26.023  -3.686
   14    HZ3  TRP   2           HZ3      TRP   2  58.808  24.566  -6.492
   15    HH2  TRP   2           HH2      TRP   2  59.771  26.432  -5.153
   16    H    GLY   3           HN       GLY   3  61.410  19.413  -8.468
   17    HA2  GLY   3           HA1      GLY   3  61.114  17.441  -9.653
   18    HA3  GLY   3           HA2      GLY   3  62.585  16.805  -8.890
   19    H    SER   4           HN       SER   4  60.242  18.001  -6.695
   20    HA   SER   4           HA       SER   4  58.674  15.550  -6.476
   21    HB2  SER   4           HB2      SER   4  60.894  16.083  -4.468
   22    HB3  SER   4           HB1      SER   4  59.532  14.980  -4.171
   23    HG   SER   4           HG       SER   4  60.267  13.652  -5.725
   24    H    ILE   5           HN       ILE   5  57.561  17.854  -6.840
   25    HA   ILE   5           HA       ILE   5  57.247  19.579  -4.593
   26    HB   ILE   5           HB       ILE   5  56.529  20.243  -6.837
   27   HG12  ILE   5          HG12      ILE   5  54.112  20.053  -4.974
   28   HG13  ILE   5          HG11      ILE   5  55.424  21.246  -4.819
   29   HG21  ILE   5          HG21      ILE   5  54.110  18.417  -6.675
   30   HG22  ILE   5          HG22      ILE   5  55.645  17.801  -7.328
   31   HG23  ILE   5          HG23      ILE   5  54.846  19.192  -8.093
   32   HD11  ILE   5           HD1      ILE   5  53.492  20.915  -7.149
   33   HD12  ILE   5           HD2      ILE   5  54.933  21.957  -7.208
   34   HD13  ILE   5           HD3      ILE   5  53.630  22.305  -6.047
   35    H    PHE   6           HN       PHE   6  56.762  18.831  -2.628
   36    HA   PHE   6           HA       PHE   6  55.686  17.598  -0.967
   37    HB2  PHE   6           HB2      PHE   6  53.422  18.623  -2.716
   38    HB3  PHE   6           HB1      PHE   6  53.105  17.736  -1.206
   39    HD1  PHE   6           HD1      PHE   6  53.695  18.686   0.974
   40    HD2  PHE   6           HD2      PHE   6  54.484  20.845  -2.678
   41    HE1  PHE   6           HE1      PHE   6  54.089  20.766   2.289
   42    HE2  PHE   6           HE2      PHE   6  54.878  22.926  -1.364
   43    HZ   PHE   6           HZ       PHE   6  54.641  22.893   1.117
   44    H    LYS   7           HN       LYS   7  56.396  16.179  -3.641
   45    HA   LYS   7           HA       LYS   7  54.414  14.093  -3.947
   46    HB2  LYS   7           HB2      LYS   7  56.180  14.757  -5.646
   47    HB3  LYS   7           HB1      LYS   7  57.375  13.929  -4.619
   48    HG2  LYS   7           HG2      LYS   7  56.135  11.819  -4.816
   49    HG3  LYS   7           HG1      LYS   7  54.865  12.629  -5.764
   50    HD2  LYS   7           HD2      LYS   7  56.462  13.136  -7.550
   51    HD3  LYS   7           HD1      LYS   7  57.796  12.453  -6.589
   52    HE2  LYS   7           HE2      LYS   7  56.799  10.234  -6.672
   53    HE3  LYS   7           HE1      LYS   7  55.338  10.876  -7.462
   54    HZ1  LYS   7           HZ1      LYS   7  56.789   9.910  -9.098
   55    HZ2  LYS   7           HZ2      LYS   7  58.098  10.859  -8.580
   56    HZ3  LYS   7           HZ3      LYS   7  56.757  11.591  -9.323
   57    H    HIS   8           HN       HIS   8  57.696  14.075  -2.471
   58    HA   HIS   8           HA       HIS   8  57.116  11.506  -1.134
   59    HB2  HIS   8           HB2      HIS   8  59.416  11.728  -0.278
   60    HB3  HIS   8           HB1      HIS   8  59.365  11.988  -2.038
   61    HD1  HIS   8           HD1      HIS   8  58.004  14.982  -1.454
   62    HD2  HIS   8           HD2      HIS   8  61.707  13.490  -0.133
   63    HE1  HIS   8           HE1      HIS   8  59.511  16.991  -0.985
   64    H    GLY   9           HN       GLY   9  55.300  13.554  -0.394
   65    HA2  GLY   9           HA1      GLY   9  55.546  13.385   2.473
   66    HA3  GLY   9           HA2      GLY   9  55.958  15.017   1.912
   67    H    ARG  10           HN       ARG  10  53.657  13.022   0.175
   68    HA   ARG  10           HA       ARG  10  51.303  13.987   1.546
   69    HB2  ARG  10           HB2      ARG  10  52.294  16.057   0.255
   70    HB3  ARG  10           HB1      ARG  10  51.646  15.254  -1.193
   71    HG2  ARG  10           HG2      ARG  10  49.403  15.114   0.047
   72    HG3  ARG  10           HG1      ARG  10  50.114  16.193   1.270
   73    HD2  ARG  10           HD2      ARG  10  50.651  17.824  -0.584
   74    HD3  ARG  10           HD1      ARG  10  49.739  16.777  -1.698
   75    HE   ARG  10           HE       ARG  10  48.189  17.508   0.662
   76   HH11  ARG  10          HH11      ARG  10  47.810  17.325  -2.532
   77   HH12  ARG  10          HH12      ARG  10  47.139  18.900  -2.790
   78   HH21  ARG  10          HH21      ARG  10  47.954  20.056   0.377
   79   HH22  ARG  10          HH22      ARG  10  47.221  20.447  -1.143
   80    H    HIS  11           HN       HIS  11  52.757  11.680   0.107
   81    HA   HIS  11           HA       HIS  11  50.290  10.612  -1.174
   82    HB2  HIS  11           HB2      HIS  11  53.010  10.714  -2.534
   83    HB3  HIS  11           HB1      HIS  11  51.644   9.713  -3.084
   84    HD1  HIS  11           HD1      HIS  11  49.851  10.818  -4.480
   85    HD2  HIS  11           HD2      HIS  11  52.462  13.588  -2.690
   86    HE1  HIS  11           HE1      HIS  11  49.276  13.123  -5.419
   87    H    ALA  12           HN       ALA  12  50.021   8.554  -1.162
   88    HA   ALA  12           HA       ALA  12  50.162   6.376  -0.482
   89    HB1  ALA  12           HB1      ALA  12  52.268   5.456  -0.003
   90    HB2  ALA  12           HB2      ALA  12  52.834   7.063   0.454
   91    HB3  ALA  12           HB3      ALA  12  52.548   6.692  -1.248
   92    H    ALA  13           HN       ALA  13  51.561   8.971   1.433
   93    HA   ALA  13           HA       ALA  13  50.963   7.683   4.000
   94    HB1  ALA  13           HB1      ALA  13  51.258  10.571   3.009
   95    HB2  ALA  13           HB2      ALA  13  52.270   9.728   4.206
   96    HB3  ALA  13           HB3      ALA  13  50.608  10.209   4.625
   97    H    LYS  14           HN       LYS  14  50.057   8.107   0.978
   98    HA   LYS  14           HA       LYS  14  47.006   8.446   1.556
   99    HB2  LYS  14           HB2      LYS  14  48.474   9.968  -0.035
  100    HB3  LYS  14           HB1      LYS  14  48.494   8.506  -1.086
  101    HG2  LYS  14           HG2      LYS  14  45.727   8.900  -0.369
  102    HG3  LYS  14           HG1      LYS  14  46.335  10.543  -0.634
  103    HD2  LYS  14           HD2      LYS  14  47.309   9.727  -2.845
  104    HD3  LYS  14           HD1      LYS  14  46.407   8.213  -2.596
  105    HE2  LYS  14           HE2      LYS  14  45.275  11.025  -2.875
  106    HE3  LYS  14           HE1      LYS  14  45.011   9.634  -3.953
  107    HZ1  LYS  14           HZ1      LYS  14  43.116   9.832  -2.564
  108    HZ2  LYS  14           HZ2      LYS  14  44.058   9.967  -1.155
  109    HZ3  LYS  14           HZ3      LYS  14  43.988   8.493  -1.997
  110    H    HIS  15           HN       HIS  15  46.277   7.435  -0.969
  111    HA   HIS  15           HA       HIS  15  45.450   5.322  -1.612
  112    HB2  HIS  15           HB2      HIS  15  47.385   6.101  -3.072
  113    HB3  HIS  15           HB1      HIS  15  48.410   4.963  -2.169
  114    HD1  HIS  15           HD1      HIS  15  45.404   5.088  -4.505
  115    HD2  HIS  15           HD2      HIS  15  48.020   2.249  -2.836
  116    HE1  HIS  15           HE1      HIS  15  44.981   2.870  -5.699
  117    H    ILE  16           HN       ILE  16  46.389   5.375   1.253
  118    HA   ILE  16           HA       ILE  16  45.936   2.891   2.041
  119    HB   ILE  16           HB       ILE  16  47.760   1.801   0.913
  120   HG12  ILE  16          HG12      ILE  16  48.797   2.292   3.729
  121   HG13  ILE  16          HG11      ILE  16  47.384   1.269   3.391
  122   HG21  ILE  16          HG21      ILE  16  49.144   3.861   0.399
  123   HG22  ILE  16          HG22      ILE  16  50.115   2.574   1.131
  124   HG23  ILE  16          HG23      ILE  16  49.591   3.941   2.120
  125   HD11  ILE  16           HD1      ILE  16  49.000   0.030   1.706
  126   HD12  ILE  16           HD2      ILE  16  49.150  -0.293   3.446
  127   HD13  ILE  16           HD3      ILE  16  50.291   0.810   2.650
  128    H    GLY  17           HN       GLY  17  48.302   5.178   2.447
  129    HA2  GLY  17           HA1      GLY  17  48.158   5.204   5.340
  130    HA3  GLY  17           HA2      GLY  17  48.909   6.451   4.322
  131    H    HIS  18           HN       HIS  18  46.205   6.125   2.705
  132    HA   HIS  18           HA       HIS  18  44.796   8.276   4.274
  133    HB2  HIS  18           HB2      HIS  18  44.906   7.375   1.429
  134    HB3  HIS  18           HB1      HIS  18  43.267   7.759   1.984
  135    HD1  HIS  18           HD1      HIS  18  43.294   9.857   0.376
  136    HD2  HIS  18           HD2      HIS  18  46.222   9.947   3.387
  137    HE1  HIS  18           HE1      HIS  18  44.143  12.261   0.545
  138    H    ALA  19           HN       ALA  19  44.598   4.911   3.224
  139    HA   ALA  19           HA       ALA  19  42.686   4.322   5.339
  140    HB1  ALA  19           HB1      ALA  19  41.670   4.414   2.475
  141    HB2  ALA  19           HB2      ALA  19  41.048   5.304   3.891
  142    HB3  ALA  19           HB3      ALA  19  40.852   3.540   3.796
  143    H    ALA  20           HN       ALA  20  43.246   3.135   2.022
  144    HA   ALA  20           HA       ALA  20  44.921   0.936   2.848
  145    HB1  ALA  20           HB1      ALA  20  43.402  -0.906   2.555
  146    HB2  ALA  20           HB2      ALA  20  42.083   0.185   2.069
  147    HB3  ALA  20           HB3      ALA  20  42.676   0.196   3.747
  148    H    VAL  21           HN       VAL  21  42.918   2.716   0.657
  149    HA   VAL  21           HA       VAL  21  44.660   1.898  -1.609
  150    HB   VAL  21           HB       VAL  21  41.619   1.687  -1.815
  151   HG11  VAL  21          HG11      VAL  21  42.596   2.323  -3.926
  152   HG12  VAL  21          HG12      VAL  21  42.273   0.580  -4.024
  153   HG13  VAL  21          HG13      VAL  21  43.928   1.162  -3.735
  154   HG21  VAL  21          HG21      VAL  21  42.395  -0.186  -0.484
  155   HG22  VAL  21          HG22      VAL  21  43.780  -0.454  -1.571
  156   HG23  VAL  21          HG23      VAL  21  42.125  -0.788  -2.133
  157    H    ASN  22           HN       ASN  22  42.504   4.090   0.023
  158    HA   ASN  22           HA       ASN  22  43.440   6.432  -1.201
  159    HB2  ASN  22           HB2      ASN  22  42.607   5.845  -3.369
  160    HB3  ASN  22           HB1      ASN  22  41.084   5.224  -2.697
  161   HD21  ASN  22          HD21      ASN  22  42.666   7.992  -4.055
  162   HD22  ASN  22          HD22      ASN  22  41.387   9.162  -3.710
  163    H    HIS  23           HN       HIS  23  40.533   4.727  -0.058
  164    HA   HIS  23           HA       HIS  23  40.178   6.579   2.127
  165    HB2  HIS  23           HB2      HIS  23  39.364   7.925   0.079
  166    HB3  HIS  23           HB1      HIS  23  38.015   6.771  -0.004
  167    HD1  HIS  23           HD1      HIS  23  39.681   8.417   3.052
  168    HD2  HIS  23           HD2      HIS  23  35.912   8.083   1.216
  169    HE1  HIS  23           HE1      HIS  23  37.996   9.623   4.547
  170    H    TYR  24           HN       TYR  24  37.101   6.135   1.637
  171    HA   TYR  24           HA       TYR  24  35.564   4.610   2.468
  172    HB2  TYR  24           HB2      TYR  24  37.449   2.601   1.171
  173    HB3  TYR  24           HB1      TYR  24  35.748   2.315   1.613
  174    HD1  TYR  24           HD1      TYR  24  33.924   3.273   0.313
  175    HD2  TYR  24           HD2      TYR  24  38.033   4.153  -0.670
  176    HE1  TYR  24           HE1      TYR  24  33.197   4.237  -1.867
  177    HE2  TYR  24           HE2      TYR  24  37.307   5.116  -2.850
  178    HH   TYR  24           HH       TYR  24  33.893   4.905  -3.883
  179    H    LEU  25           HN       LEU  25  37.953   5.339   4.127
  180    HA   LEU  25           HA       LEU  25  38.944   3.120   5.569
  181    HB2  LEU  25           HB2      LEU  25  39.463   5.717   5.698
  182    HB3  LEU  25           HB1      LEU  25  38.246   5.707   6.992
  183    HG   LEU  25           HG       LEU  25  40.796   4.029   6.870
  184   HD11  LEU  25          HD11      LEU  25  39.904   6.218   8.798
  185   HD12  LEU  25          HD12      LEU  25  41.053   6.451   7.459
  186   HD13  LEU  25          HD13      LEU  25  41.467   5.367   8.809
  187   HD21  LEU  25          HD21      LEU  25  40.035   3.448   9.282
  188   HD22  LEU  25          HD22      LEU  25  39.180   2.641   7.951
  189   HD23  LEU  25          HD23      LEU  25  38.426   4.023   8.784
  Start of MODEL   63
    1    H1   GLY   1           HT1      GLY   1  66.384  23.720  -3.397
    2    H2   GLY   1           HT2      GLY   1  66.298  22.422  -4.491
    3    H3   GLY   1           HT3      GLY   1  67.643  22.588  -3.466
    4    HA2  GLY   1           HA1      GLY   1  66.539  21.923  -1.624
    5    HA3  GLY   1           HA2      GLY   1  64.967  22.347  -2.332
    6    H    TRP   2           HN       TRP   2  64.638  20.087  -1.343
    7    HA   TRP   2           HA       TRP   2  65.745  17.779  -2.589
    8    HB2  TRP   2           HB2      TRP   2  62.912  18.014  -1.516
    9    HB3  TRP   2           HB1      TRP   2  63.940  16.564  -1.582
   10    HD1  TRP   2           HD1      TRP   2  66.549  17.335  -0.329
   11    HE1  TRP   2           HE1      TRP   2  66.795  18.155   2.127
   12    HE3  TRP   2           HE3      TRP   2  61.754  18.937   0.470
   13    HZ2  TRP   2           HZ2      TRP   2  65.114  19.344   4.140
   14    HZ3  TRP   2           HZ3      TRP   2  61.096  19.911   2.665
   15    HH2  TRP   2           HH2      TRP   2  62.770  20.116   4.499
   16    H    GLY   3           HN       GLY   3  63.394  20.091  -3.690
   17    HA2  GLY   3           HA1      GLY   3  62.450  20.298  -5.804
   18    HA3  GLY   3           HA2      GLY   3  63.337  18.849  -6.319
   19    H    SER   4           HN       SER   4  61.718  18.128  -3.491
   20    HA   SER   4           HA       SER   4  59.847  16.396  -4.868
   21    HB2  SER   4           HB2      SER   4  58.999  15.935  -2.568
   22    HB3  SER   4           HB1      SER   4  60.766  15.782  -2.691
   23    HG   SER   4           HG       SER   4  59.612  18.260  -2.005
   24    H    ILE   5           HN       ILE   5  58.163  17.170  -5.966
   25    HA   ILE   5           HA       ILE   5  56.888  19.695  -5.245
   26    HB   ILE   5           HB       ILE   5  55.806  17.554  -7.124
   27   HG12  ILE   5          HG12      ILE   5  58.039  17.895  -7.895
   28   HG13  ILE   5          HG11      ILE   5  57.037  18.932  -8.926
   29   HG21  ILE   5          HG21      ILE   5  54.950  19.707  -8.293
   30   HG22  ILE   5          HG22      ILE   5  55.349  20.543  -6.776
   31   HG23  ILE   5          HG23      ILE   5  54.162  19.224  -6.777
   32   HD11  ILE   5           HD1      ILE   5  58.819  19.752  -6.599
   33   HD12  ILE   5           HD2      ILE   5  57.588  20.841  -7.277
   34   HD13  ILE   5           HD3      ILE   5  58.922  20.265  -8.297
   35    H    PHE   6           HN       PHE   6  56.589  18.791  -2.941
   36    HA   PHE   6           HA       PHE   6  55.103  18.124  -1.296
   37    HB2  PHE   6           HB2      PHE   6  52.953  18.328  -3.434
   38    HB3  PHE   6           HB1      PHE   6  52.760  18.490  -1.673
   39    HD1  PHE   6           HD1      PHE   6  53.345  20.271  -4.742
   40    HD2  PHE   6           HD2      PHE   6  54.159  20.366  -0.503
   41    HE1  PHE   6           HE1      PHE   6  53.829  22.712  -4.889
   42    HE2  PHE   6           HE2      PHE   6  54.641  22.805  -0.650
   43    HZ   PHE   6           HZ       PHE   6  54.454  23.982  -2.839
   44    H    LYS   7           HN       LYS   7  55.934  16.238  -3.823
   45    HA   LYS   7           HA       LYS   7  54.029  14.099  -3.738
   46    HB2  LYS   7           HB2      LYS   7  57.007  14.101  -4.368
   47    HB3  LYS   7           HB1      LYS   7  55.925  12.722  -4.653
   48    HG2  LYS   7           HG2      LYS   7  55.264  15.465  -5.798
   49    HG3  LYS   7           HG1      LYS   7  56.411  14.396  -6.632
   50    HD2  LYS   7           HD2      LYS   7  54.618  12.581  -6.576
   51    HD3  LYS   7           HD1      LYS   7  53.485  13.821  -5.988
   52    HE2  LYS   7           HE2      LYS   7  53.235  13.707  -8.385
   53    HE3  LYS   7           HE1      LYS   7  54.107  15.214  -8.018
   54    HZ1  LYS   7           HZ1      LYS   7  55.757  12.851  -8.425
   55    HZ2  LYS   7           HZ2      LYS   7  55.993  14.451  -8.948
   56    HZ3  LYS   7           HZ3      LYS   7  54.944  13.420  -9.801
   57    H    HIS   8           HN       HIS   8  57.226  14.433  -2.126
   58    HA   HIS   8           HA       HIS   8  56.689  12.096  -0.433
   59    HB2  HIS   8           HB2      HIS   8  58.979  12.759  -1.229
   60    HB3  HIS   8           HB1      HIS   8  58.880  14.193  -0.182
   61    HD1  HIS   8           HD1      HIS   8  57.679  10.642   0.620
   62    HD2  HIS   8           HD2      HIS   8  60.612  13.389   1.859
   63    HE1  HIS   8           HE1      HIS   8  58.789   9.680   2.712
   64    H    GLY   9           HN       GLY   9  54.744  14.284  -0.284
   65    HA2  GLY   9           HA1      GLY   9  54.582  14.437   2.607
   66    HA3  GLY   9           HA2      GLY   9  55.039  15.998   1.898
   67    H    ARG  10           HN       ARG  10  53.069  13.831   0.019
   68    HA   ARG  10           HA       ARG  10  50.513  14.826   0.979
   69    HB2  ARG  10           HB2      ARG  10  51.647  16.785  -0.370
   70    HB3  ARG  10           HB1      ARG  10  51.224  15.820  -1.801
   71    HG2  ARG  10           HG2      ARG  10  48.842  15.785  -1.048
   72    HG3  ARG  10           HG1      ARG  10  49.285  16.797   0.347
   73    HD2  ARG  10           HD2      ARG  10  48.383  18.191  -1.480
   74    HD3  ARG  10           HD1      ARG  10  50.102  18.560  -1.205
   75    HE   ARG  10           HE       ARG  10  49.985  16.552  -3.206
   76   HH11  ARG  10          HH11      ARG  10  49.821  17.073  -5.410
   77   HH12  ARG  10          HH12      ARG  10  49.580  18.725  -5.871
   78   HH21  ARG  10          HH21      ARG  10  49.323  19.877  -2.611
   79   HH22  ARG  10          HH22      ARG  10  49.299  20.312  -4.287
   80    H    HIS  11           HN       HIS  11  52.271  12.473  -0.119
   81    HA   HIS  11           HA       HIS  11  49.973  11.086  -1.332
   82    HB2  HIS  11           HB2      HIS  11  51.036  12.169  -3.313
   83    HB3  HIS  11           HB1      HIS  11  52.572  11.372  -2.895
   84    HD1  HIS  11           HD1      HIS  11  52.916   9.013  -3.702
   85    HD2  HIS  11           HD2      HIS  11  48.877  10.175  -3.840
   86    HE1  HIS  11           HE1      HIS  11  51.628   7.154  -4.891
   87    H    ALA  12           HN       ALA  12  50.025   9.020  -1.340
   88    HA   ALA  12           HA       ALA  12  50.494   6.899  -0.662
   89    HB1  ALA  12           HB1      ALA  12  52.795   7.545  -1.503
   90    HB2  ALA  12           HB2      ALA  12  52.718   6.279  -0.251
   91    HB3  ALA  12           HB3      ALA  12  53.073   7.953   0.182
   92    H    ALA  13           HN       ALA  13  51.646   9.661   1.207
   93    HA   ALA  13           HA       ALA  13  51.311   8.315   3.788
   94    HB1  ALA  13           HB1      ALA  13  50.955  10.637   4.628
   95    HB2  ALA  13           HB2      ALA  13  50.874  11.246   2.957
   96    HB3  ALA  13           HB3      ALA  13  52.408  10.613   3.601
   97    H    LYS  14           HN       LYS  14  50.196   8.582   0.823
   98    HA   LYS  14           HA       LYS  14  47.162   8.574   1.590
   99    HB2  LYS  14           HB2      LYS  14  48.288  10.274  -0.052
  100    HB3  LYS  14           HB1      LYS  14  48.560   8.827  -1.097
  101    HG2  LYS  14           HG2      LYS  14  46.323   8.774  -1.747
  102    HG3  LYS  14           HG1      LYS  14  45.717   9.181  -0.126
  103    HD2  LYS  14           HD2      LYS  14  46.185  11.546  -0.489
  104    HD3  LYS  14           HD1      LYS  14  46.987  11.190  -2.038
  105    HE2  LYS  14           HE2      LYS  14  44.053  10.671  -1.387
  106    HE3  LYS  14           HE1      LYS  14  44.677  11.979  -2.419
  107    HZ1  LYS  14           HZ1      LYS  14  44.442  10.512  -4.066
  108    HZ2  LYS  14           HZ2      LYS  14  44.293   9.186  -3.014
  109    HZ3  LYS  14           HZ3      LYS  14  45.832   9.755  -3.458
  110    H    HIS  15           HN       HIS  15  46.158   7.476  -0.598
  111    HA   HIS  15           HA       HIS  15  45.501   5.320  -1.240
  112    HB2  HIS  15           HB2      HIS  15  47.022   6.241  -3.000
  113    HB3  HIS  15           HB1      HIS  15  48.374   5.372  -2.233
  114    HD1  HIS  15           HD1      HIS  15  44.792   4.456  -3.345
  115    HD2  HIS  15           HD2      HIS  15  48.722   2.974  -3.531
  116    HE1  HIS  15           HE1      HIS  15  44.702   2.209  -4.555
  117    H    ILE  16           HN       ILE  16  47.014   5.504   1.419
  118    HA   ILE  16           HA       ILE  16  46.848   2.946   2.196
  119    HB   ILE  16           HB       ILE  16  48.582   2.087   0.811
  120   HG12  ILE  16          HG12      ILE  16  50.090   2.683   3.385
  121   HG13  ILE  16          HG11      ILE  16  48.700   1.576   3.365
  122   HG21  ILE  16          HG21      ILE  16  49.631   4.162   0.021
  123   HG22  ILE  16          HG22      ILE  16  50.893   3.213   0.824
  124   HG23  ILE  16          HG23      ILE  16  50.139   4.561   1.672
  125   HD11  ILE  16           HD1      ILE  16  49.970   0.365   1.412
  126   HD12  ILE  16           HD2      ILE  16  50.554   0.137   3.074
  127   HD13  ILE  16           HD3      ILE  16  51.392   1.265   1.991
  128    H    GLY  17           HN       GLY  17  48.757   5.649   2.362
  129    HA2  GLY  17           HA1      GLY  17  48.997   5.527   5.288
  130    HA3  GLY  17           HA2      GLY  17  49.451   6.894   4.250
  131    H    HIS  18           HN       HIS  18  46.738   6.198   2.827
  132    HA   HIS  18           HA       HIS  18  45.105   8.022   4.594
  133    HB2  HIS  18           HB2      HIS  18  45.169   7.321   1.679
  134    HB3  HIS  18           HB1      HIS  18  43.548   7.567   2.358
  135    HD1  HIS  18           HD1      HIS  18  46.442   9.497   3.807
  136    HD2  HIS  18           HD2      HIS  18  43.271  10.114   1.118
  137    HE1  HIS  18           HE1      HIS  18  46.328  12.004   3.327
  138    H    ALA  19           HN       ALA  19  44.973   4.794   2.973
  139    HA   ALA  19           HA       ALA  19  43.789   3.372   5.042
  140    HB1  ALA  19           HB1      ALA  19  41.819   4.598   5.317
  141    HB2  ALA  19           HB2      ALA  19  41.279   3.427   4.097
  142    HB3  ALA  19           HB3      ALA  19  41.754   5.069   3.603
  143    H    ALA  20           HN       ALA  20  45.108   3.577   2.187
  144    HA   ALA  20           HA       ALA  20  45.420   2.101   0.426
  145    HB1  ALA  20           HB1      ALA  20  45.587   0.505   2.426
  146    HB2  ALA  20           HB2      ALA  20  45.198  -0.226   0.852
  147    HB3  ALA  20           HB3      ALA  20  43.912   0.032   2.055
  148    H    VAL  21           HN       VAL  21  42.639   3.427   1.261
  149    HA   VAL  21           HA       VAL  21  41.242   2.475  -1.199
  150    HB   VAL  21           HB       VAL  21  39.910   2.625   1.546
  151   HG11  VAL  21          HG11      VAL  21  38.887   2.150  -1.281
  152   HG12  VAL  21          HG12      VAL  21  38.273   3.277  -0.047
  153   HG13  VAL  21          HG13      VAL  21  37.999   1.533   0.132
  154   HG21  VAL  21          HG21      VAL  21  41.279   0.608   1.368
  155   HG22  VAL  21          HG22      VAL  21  40.630   0.264  -0.252
  156   HG23  VAL  21          HG23      VAL  21  39.574   0.147   1.175
  157    H    ASN  22           HN       ASN  22  42.313   4.810   0.954
  158    HA   ASN  22           HA       ASN  22  42.364   7.141   0.363
  159    HB2  ASN  22           HB2      ASN  22  40.827   6.764  -1.654
  160    HB3  ASN  22           HB1      ASN  22  39.460   6.961  -0.524
  161   HD21  ASN  22          HD21      ASN  22  42.495   8.637  -1.607
  162   HD22  ASN  22          HD22      ASN  22  41.845  10.261  -1.356
  163    H    HIS  23           HN       HIS  23  39.612   5.416   1.754
  164    HA   HIS  23           HA       HIS  23  39.935   6.743   4.291
  165    HB2  HIS  23           HB2      HIS  23  38.876   8.620   3.030
  166    HB3  HIS  23           HB1      HIS  23  37.479   7.569   2.690
  167    HD1  HIS  23           HD1      HIS  23  39.006   6.983   6.008
  168    HD2  HIS  23           HD2      HIS  23  36.015   9.475   4.413
  169    HE1  HIS  23           HE1      HIS  23  37.642   7.887   7.970
  170    H    TYR  24           HN       TYR  24  36.651   6.467   3.959
  171    HA   TYR  24           HA       TYR  24  35.179   4.878   4.805
  172    HB2  TYR  24           HB2      TYR  24  36.945   3.114   3.063
  173    HB3  TYR  24           HB1      TYR  24  35.382   2.610   3.752
  174    HD1  TYR  24           HD1      TYR  24  33.275   3.562   2.949
  175    HD2  TYR  24           HD2      TYR  24  37.058   4.852   1.319
  176    HE1  TYR  24           HE1      TYR  24  32.083   4.674   1.064
  177    HE2  TYR  24           HE2      TYR  24  35.866   5.965  -0.565
  178    HH   TYR  24           HH       TYR  24  33.552   6.918  -0.972
  179    H    LEU  25           HN       LEU  25  37.920   5.333   6.157
  180    HA   LEU  25           HA       LEU  25  38.667   2.843   7.380
  181    HB2  LEU  25           HB2      LEU  25  39.861   5.214   7.271
  182    HB3  LEU  25           HB1      LEU  25  38.997   5.507   8.794
  183    HG   LEU  25           HG       LEU  25  40.940   3.228   8.200
  184   HD11  LEU  25          HD11      LEU  25  41.055   5.556  10.169
  185   HD12  LEU  25          HD12      LEU  25  41.951   5.466   8.633
  186   HD13  LEU  25          HD13      LEU  25  42.306   4.311   9.941
  187   HD21  LEU  25          HD21      LEU  25  39.115   3.792  10.574
  188   HD22  LEU  25          HD22      LEU  25  40.586   2.801  10.730
  189   HD23  LEU  25          HD23      LEU  25  39.279   2.285   9.640
  Start of MODEL   64
    1    H1   GLY   1           HT1      GLY   1  67.641  18.316  -3.402
    2    H2   GLY   1           HT2      GLY   1  67.965  17.044  -4.482
    3    H3   GLY   1           HT3      GLY   1  68.698  17.072  -2.949
    4    HA2  GLY   1           HA1      GLY   1  66.763  16.592  -1.845
    5    HA3  GLY   1           HA2      GLY   1  65.787  17.006  -3.269
    6    H    TRP   2           HN       TRP   2  66.075  14.523  -1.536
    7    HA   TRP   2           HA       TRP   2  67.364  12.445  -2.945
    8    HB2  TRP   2           HB2      TRP   2  66.265  12.304  -0.669
    9    HB3  TRP   2           HB1      TRP   2  64.696  12.206  -1.503
   10    HD1  TRP   2           HD1      TRP   2  68.114  10.371  -1.539
   11    HE1  TRP   2           HE1      TRP   2  67.711   7.845  -2.012
   12    HE3  TRP   2           HE3      TRP   2  63.039  10.477  -2.208
   13    HZ2  TRP   2           HZ2      TRP   2  65.471   6.135  -2.600
   14    HZ3  TRP   2           HZ3      TRP   2  61.790   8.386  -2.724
   15    HH2  TRP   2           HH2      TRP   2  63.000   6.217  -2.921
   16    H    GLY   3           HN       GLY   3  63.807  12.941  -2.990
   17    HA2  GLY   3           HA1      GLY   3  63.529  13.151  -5.799
   18    HA3  GLY   3           HA2      GLY   3  63.464  11.425  -5.393
   19    H    SER   4           HN       SER   4  62.380  12.723  -2.657
   20    HA   SER   4           HA       SER   4  59.737  13.650  -3.388
   21    HB2  SER   4           HB2      SER   4  58.414  11.730  -2.813
   22    HB3  SER   4           HB1      SER   4  59.610  11.194  -4.014
   23    HG   SER   4           HG       SER   4  59.413   9.815  -2.135
   24    H    ILE   5           HN       ILE   5  60.837  15.145  -1.838
   25    HA   ILE   5           HA       ILE   5  61.083  14.240   0.942
   26    HB   ILE   5           HB       ILE   5  60.976  17.126  -0.032
   27   HG12  ILE   5          HG12      ILE   5  63.319  15.167  -0.019
   28   HG13  ILE   5          HG11      ILE   5  62.580  15.925  -1.449
   29   HG21  ILE   5          HG21      ILE   5  62.241  17.594   1.948
   30   HG22  ILE   5          HG22      ILE   5  62.593  15.870   2.223
   31   HG23  ILE   5          HG23      ILE   5  60.945  16.493   2.466
   32   HD11  ILE   5           HD1      ILE   5  64.500  17.255  -1.021
   33   HD12  ILE   5           HD2      ILE   5  64.238  17.224   0.738
   34   HD13  ILE   5           HD3      ILE   5  63.167  18.191  -0.304
   35    H    PHE   6           HN       PHE   6  58.771  16.143  -1.001
   36    HA   PHE   6           HA       PHE   6  57.056  16.685   1.326
   37    HB2  PHE   6           HB2      PHE   6  56.577  17.046  -1.659
   38    HB3  PHE   6           HB1      PHE   6  55.536  17.673  -0.357
   39    HD1  PHE   6           HD1      PHE   6  58.918  17.893  -1.914
   40    HD2  PHE   6           HD2      PHE   6  56.172  19.617   0.936
   41    HE1  PHE   6           HE1      PHE   6  60.388  19.895  -1.708
   42    HE2  PHE   6           HE2      PHE   6  57.642  21.619   1.142
   43    HZ   PHE   6           HZ       PHE   6  59.730  21.775  -0.209
   44    H    LYS   7           HN       LYS   7  57.623  13.873   0.857
   45    HA   LYS   7           HA       LYS   7  56.489  11.850   0.708
   46    HB2  LYS   7           HB2      LYS   7  54.100  13.602   1.407
   47    HB3  LYS   7           HB1      LYS   7  54.191  11.832   1.584
   48    HG2  LYS   7           HG2      LYS   7  56.121  12.108   3.140
   49    HG3  LYS   7           HG1      LYS   7  55.958  13.875   3.003
   50    HD2  LYS   7           HD2      LYS   7  53.697  13.782   3.938
   51    HD3  LYS   7           HD1      LYS   7  53.752  12.002   3.971
   52    HE2  LYS   7           HE2      LYS   7  54.261  13.188   6.193
   53    HE3  LYS   7           HE1      LYS   7  55.459  11.987   5.651
   54    HZ1  LYS   7           HZ1      LYS   7  56.472  14.084   6.396
   55    HZ2  LYS   7           HZ2      LYS   7  55.648  14.920   5.168
   56    HZ3  LYS   7           HZ3      LYS   7  56.816  13.751   4.769
   57    H    HIS   8           HN       HIS   8  57.008  12.155  -1.687
   58    HA   HIS   8           HA       HIS   8  56.333  12.042  -3.913
   59    HB2  HIS   8           HB2      HIS   8  54.016  10.668  -2.507
   60    HB3  HIS   8           HB1      HIS   8  54.242  10.659  -4.272
   61    HD1  HIS   8           HD1      HIS   8  55.782   9.403  -1.032
   62    HD2  HIS   8           HD2      HIS   8  56.343   8.989  -5.182
   63    HE1  HIS   8           HE1      HIS   8  57.441   7.493  -1.389
   64    H    GLY   9           HN       GLY   9  55.406  14.390  -2.189
   65    HA2  GLY   9           HA1      GLY   9  54.320  16.369  -2.753
   66    HA3  GLY   9           HA2      GLY   9  53.789  15.625  -4.273
   67    H    ARG  10           HN       ARG  10  53.236  15.118  -0.755
   68    HA   ARG  10           HA       ARG  10  51.267  14.734   0.401
   69    HB2  ARG  10           HB2      ARG  10  50.314  16.661  -1.750
   70    HB3  ARG  10           HB1      ARG  10  49.231  16.055  -0.482
   71    HG2  ARG  10           HG2      ARG  10  50.168  18.196   0.232
   72    HG3  ARG  10           HG1      ARG  10  50.824  16.899   1.254
   73    HD2  ARG  10           HD2      ARG  10  52.494  18.665   0.380
   74    HD3  ARG  10           HD1      ARG  10  52.942  16.960   0.164
   75    HE   ARG  10           HE       ARG  10  52.847  17.335  -2.164
   76   HH11  ARG  10          HH11      ARG  10  50.394  17.848  -3.140
   77   HH12  ARG  10          HH12      ARG  10  50.243  19.559  -3.367
   78   HH21  ARG  10          HH21      ARG  10  52.915  20.338  -1.301
   79   HH22  ARG  10          HH22      ARG  10  51.672  20.968  -2.327
   80    H    HIS  11           HN       HIS  11  52.050  12.739  -1.417
   81    HA   HIS  11           HA       HIS  11  49.415  11.473  -1.803
   82    HB2  HIS  11           HB2      HIS  11  49.896  12.615  -4.005
   83    HB3  HIS  11           HB1      HIS  11  51.385  11.647  -4.121
   84    HD1  HIS  11           HD1      HIS  11  51.047   8.960  -4.120
   85    HD2  HIS  11           HD2      HIS  11  47.645  11.291  -4.939
   86    HE1  HIS  11           HE1      HIS  11  49.290   7.412  -5.142
   87    H    ALA  12           HN       ALA  12  50.293  10.635   0.023
   88    HA   ALA  12           HA       ALA  12  51.083   7.955  -0.285
   89    HB1  ALA  12           HB1      ALA  12  53.026  10.007   0.529
   90    HB2  ALA  12           HB2      ALA  12  53.240   8.954  -0.887
   91    HB3  ALA  12           HB3      ALA  12  53.358   8.287   0.756
   92    H    ALA  13           HN       ALA  13  51.166  11.051   1.292
   93    HA   ALA  13           HA       ALA  13  50.749  10.014   4.017
   94    HB1  ALA  13           HB1      ALA  13  50.043  12.612   2.543
   95    HB2  ALA  13           HB2      ALA  13  51.194  12.415   3.887
   96    HB3  ALA  13           HB3      ALA  13  49.444  12.268   4.182
   97    H    LYS  14           HN       LYS  14  50.074   9.678   0.902
   98    HA   LYS  14           HA       LYS  14  47.086   8.871   1.267
   99    HB2  LYS  14           HB2      LYS  14  47.975  10.671  -0.381
  100    HB3  LYS  14           HB1      LYS  14  48.833   9.289  -1.185
  101    HG2  LYS  14           HG2      LYS  14  46.852   8.538  -2.165
  102    HG3  LYS  14           HG1      LYS  14  45.861   8.895  -0.729
  103    HD2  LYS  14           HD2      LYS  14  45.669  11.218  -1.335
  104    HD3  LYS  14           HD1      LYS  14  46.918  11.062  -2.594
  105    HE2  LYS  14           HE2      LYS  14  44.491  11.075  -3.425
  106    HE3  LYS  14           HE1      LYS  14  45.491   9.707  -3.972
  107    HZ1  LYS  14           HZ1      LYS  14  43.784   9.571  -1.546
  108    HZ2  LYS  14           HZ2      LYS  14  44.505   8.289  -2.397
  109    HZ3  LYS  14           HZ3      LYS  14  43.211   9.148  -3.086
  110    H    HIS  15           HN       HIS  15  46.811   7.368  -0.905
  111    HA   HIS  15           HA       HIS  15  46.851   5.078  -1.373
  112    HB2  HIS  15           HB2      HIS  15  48.399   6.255  -2.962
  113    HB3  HIS  15           HB1      HIS  15  49.755   5.800  -1.902
  114    HD1  HIS  15           HD1      HIS  15  46.824   3.467  -2.429
  115    HD2  HIS  15           HD2      HIS  15  50.799   3.894  -3.737
  116    HE1  HIS  15           HE1      HIS  15  47.451   1.324  -3.670
  117    H    ILE  16           HN       ILE  16  47.743   5.858   1.454
  118    HA   ILE  16           HA       ILE  16  48.086   3.419   2.484
  119    HB   ILE  16           HB       ILE  16  50.250   2.962   1.496
  120   HG12  ILE  16          HG12      ILE  16  51.090   4.115   4.183
  121   HG13  ILE  16          HG11      ILE  16  49.970   2.738   4.123
  122   HG21  ILE  16          HG21      ILE  16  52.128   4.697   1.785
  123   HG22  ILE  16          HG22      ILE  16  50.884   5.826   2.321
  124   HG23  ILE  16          HG23      ILE  16  50.841   5.194   0.665
  125   HD11  ILE  16           HD1      ILE  16  52.813   2.858   3.025
  126   HD12  ILE  16           HD2      ILE  16  51.680   1.540   2.651
  127   HD13  ILE  16           HD3      ILE  16  52.188   1.828   4.329
  128    H    GLY  17           HN       GLY  17  49.089   6.574   2.581
  129    HA2  GLY  17           HA1      GLY  17  48.843   6.750   5.514
  130    HA3  GLY  17           HA2      GLY  17  49.118   8.097   4.395
  131    H    HIS  18           HN       HIS  18  46.991   6.544   2.661
  132    HA   HIS  18           HA       HIS  18  44.587   7.828   4.007
  133    HB2  HIS  18           HB2      HIS  18  45.393   7.293   1.137
  134    HB3  HIS  18           HB1      HIS  18  43.669   7.226   1.534
  135    HD1  HIS  18           HD1      HIS  18  43.352   9.408   0.044
  136    HD2  HIS  18           HD2      HIS  18  45.606   9.914   3.556
  137    HE1  HIS  18           HE1      HIS  18  43.552  11.920   0.466
  138    H    ALA  19           HN       ALA  19  46.274   4.980   3.545
  139    HA   ALA  19           HA       ALA  19  45.691   2.836   4.293
  140    HB1  ALA  19           HB1      ALA  19  43.690   4.100   5.494
  141    HB2  ALA  19           HB2      ALA  19  43.632   2.336   5.277
  142    HB3  ALA  19           HB3      ALA  19  42.712   3.397   4.180
  143    H    ALA  20           HN       ALA  20  45.664   4.151   1.540
  144    HA   ALA  20           HA       ALA  20  45.227   3.518  -0.654
  145    HB1  ALA  20           HB1      ALA  20  45.549   1.195  -1.163
  146    HB2  ALA  20           HB2      ALA  20  45.075   0.708   0.483
  147    HB3  ALA  20           HB3      ALA  20  46.605   1.578   0.217
  148    H    VAL  21           HN       VAL  21  42.999   3.751   1.511
  149    HA   VAL  21           HA       VAL  21  40.792   3.046  -0.342
  150    HB   VAL  21           HB       VAL  21  40.980   1.928   2.494
  151   HG11  VAL  21          HG11      VAL  21  38.693   2.495   2.193
  152   HG12  VAL  21          HG12      VAL  21  38.754   0.794   1.697
  153   HG13  VAL  21          HG13      VAL  21  38.716   2.077   0.466
  154   HG21  VAL  21          HG21      VAL  21  40.719  -0.282   1.185
  155   HG22  VAL  21          HG22      VAL  21  42.281   0.543   1.020
  156   HG23  VAL  21          HG23      VAL  21  41.071   0.664  -0.280
  157    H    ASN  22           HN       ASN  22  42.291   4.929   2.077
  158    HA   ASN  22           HA       ASN  22  41.581   7.179   2.567
  159    HB2  ASN  22           HB2      ASN  22  39.484   6.872   1.084
  160    HB3  ASN  22           HB1      ASN  22  38.679   6.290   2.567
  161   HD21  ASN  22          HD21      ASN  22  40.372   9.128   1.121
  162   HD22  ASN  22          HD22      ASN  22  39.662  10.302   2.235
  163    H    HIS  23           HN       HIS  23  40.093   4.253   3.790
  164    HA   HIS  23           HA       HIS  23  41.010   4.771   6.480
  165    HB2  HIS  23           HB2      HIS  23  39.094   6.379   6.394
  166    HB3  HIS  23           HB1      HIS  23  38.007   5.012   6.049
  167    HD1  HIS  23           HD1      HIS  23  40.930   5.133   8.532
  168    HD2  HIS  23           HD2      HIS  23  36.742   4.771   8.523
  169    HE1  HIS  23           HE1      HIS  23  40.209   4.582  10.919
  170    H    TYR  24           HN       TYR  24  41.761   2.719   6.591
  171    HA   TYR  24           HA       TYR  24  39.795   0.611   7.059
  172    HB2  TYR  24           HB2      TYR  24  39.906   0.624   4.561
  173    HB3  TYR  24           HB1      TYR  24  41.655   0.312   4.667
  174    HD1  TYR  24           HD1      TYR  24  38.292  -1.041   5.638
  175    HD2  TYR  24           HD2      TYR  24  42.481  -1.905   5.042
  176    HE1  TYR  24           HE1      TYR  24  37.830  -3.474   5.905
  177    HE2  TYR  24           HE2      TYR  24  42.016  -4.338   5.310
  178    HH   TYR  24           HH       TYR  24  40.447  -5.894   5.569
  179    H    LEU  25           HN       LEU  25  42.691   2.135   7.500
  180    HA   LEU  25           HA       LEU  25  44.514   1.632   8.830
  181    HB2  LEU  25           HB2      LEU  25  42.528   0.414  10.119
  182    HB3  LEU  25           HB1      LEU  25  43.349  -1.065   9.579
  183    HG   LEU  25           HG       LEU  25  44.557   1.200  11.232
  184   HD11  LEU  25          HD11      LEU  25  44.732  -0.523  12.973
  185   HD12  LEU  25          HD12      LEU  25  44.051  -1.741  11.869
  186   HD13  LEU  25          HD13      LEU  25  43.043  -0.386  12.432
  187   HD21  LEU  25          HD21      LEU  25  45.788  -1.267   9.934
  188   HD22  LEU  25          HD22      LEU  25  46.534  -0.467  11.339
  189   HD23  LEU  25          HD23      LEU  25  46.323   0.426   9.816
  Start of MODEL   65
    1    H1   GLY   1           HT1      GLY   1  62.476  20.467   3.206
    2    H2   GLY   1           HT2      GLY   1  63.650  19.900   2.117
    3    H3   GLY   1           HT3      GLY   1  63.469  19.163   3.636
    4    HA2  GLY   1           HA1      GLY   1  61.929  17.823   2.930
    5    HA3  GLY   1           HA2      GLY   1  61.026  19.189   2.246
    6    H    TRP   2           HN       TRP   2  64.356  18.455   1.361
    7    HA   TRP   2           HA       TRP   2  65.255  17.973  -0.727
    8    HB2  TRP   2           HB2      TRP   2  62.855  16.120  -0.972
    9    HB3  TRP   2           HB1      TRP   2  64.423  15.968  -1.800
   10    HD1  TRP   2           HD1      TRP   2  66.543  15.296  -0.304
   11    HE1  TRP   2           HE1      TRP   2  66.751  14.028   1.956
   12    HE3  TRP   2           HE3      TRP   2  61.700  15.710   1.303
   13    HZ2  TRP   2           HZ2      TRP   2  65.026  13.309   4.147
   14    HZ3  TRP   2           HZ3      TRP   2  61.003  14.726   3.482
   15    HH2  TRP   2           HH2      TRP   2  62.661  13.526   4.904
   16    H    GLY   3           HN       GLY   3  64.539  17.552  -3.192
   17    HA2  GLY   3           HA1      GLY   3  63.409  20.040  -4.047
   18    HA3  GLY   3           HA2      GLY   3  63.749  18.636  -5.077
   19    H    SER   4           HN       SER   4  61.945  17.151  -2.963
   20    HA   SER   4           HA       SER   4  59.620  17.026  -4.590
   21    HB2  SER   4           HB2      SER   4  60.038  16.368  -1.652
   22    HB3  SER   4           HB1      SER   4  58.559  15.971  -2.556
   23    HG   SER   4           HG       SER   4  60.304  14.326  -2.454
   24    H    ILE   5           HN       ILE   5  58.279  18.644  -5.046
   25    HA   ILE   5           HA       ILE   5  57.974  20.959  -3.350
   26    HB   ILE   5           HB       ILE   5  55.993  20.033  -5.474
   27   HG12  ILE   5          HG12      ILE   5  58.622  21.548  -5.823
   28   HG13  ILE   5          HG11      ILE   5  58.292  19.894  -6.388
   29   HG21  ILE   5          HG21      ILE   5  56.897  22.844  -4.729
   30   HG22  ILE   5          HG22      ILE   5  55.527  22.042  -3.928
   31   HG23  ILE   5          HG23      ILE   5  55.470  22.364  -5.676
   32   HD11  ILE   5           HD1      ILE   5  57.100  22.506  -7.378
   33   HD12  ILE   5           HD2      ILE   5  56.292  20.947  -7.683
   34   HD13  ILE   5           HD3      ILE   5  57.931  21.239  -8.310
   35    H    PHE   6           HN       PHE   6  56.174  17.933  -3.781
   36    HA   PHE   6           HA       PHE   6  54.985  18.167  -1.153
   37    HB2  PHE   6           HB2      PHE   6  52.617  18.316  -1.868
   38    HB3  PHE   6           HB1      PHE   6  53.525  19.789  -2.285
   39    HD1  PHE   6           HD1      PHE   6  53.833  20.453  -4.579
   40    HD2  PHE   6           HD2      PHE   6  52.175  16.578  -3.644
   41    HE1  PHE   6           HE1      PHE   6  53.230  20.132  -6.974
   42    HE2  PHE   6           HE2      PHE   6  51.574  16.258  -6.041
   43    HZ   PHE   6           HZ       PHE   6  52.166  18.005  -7.716
   44    H    LYS   7           HN       LYS   7  55.746  16.610  -4.070
   45    HA   LYS   7           HA       LYS   7  54.072  14.347  -4.112
   46    HB2  LYS   7           HB2      LYS   7  55.840  14.905  -5.798
   47    HB3  LYS   7           HB1      LYS   7  57.072  14.377  -4.627
   48    HG2  LYS   7           HG2      LYS   7  56.183  12.121  -4.598
   49    HG3  LYS   7           HG1      LYS   7  54.776  12.612  -5.573
   50    HD2  LYS   7           HD2      LYS   7  56.279  13.190  -7.457
   51    HD3  LYS   7           HD1      LYS   7  57.686  12.690  -6.485
   52    HE2  LYS   7           HE2      LYS   7  56.880  10.399  -6.383
   53    HE3  LYS   7           HE1      LYS   7  55.344  10.856  -7.158
   54    HZ1  LYS   7           HZ1      LYS   7  56.627  10.003  -8.882
   55    HZ2  LYS   7           HZ2      LYS   7  58.057  10.743  -8.342
   56    HZ3  LYS   7           HZ3      LYS   7  56.829  11.677  -9.052
   57    H    HIS   8           HN       HIS   8  57.317  14.526  -2.564
   58    HA   HIS   8           HA       HIS   8  56.732  12.113  -0.981
   59    HB2  HIS   8           HB2      HIS   8  59.012  12.682  -1.900
   60    HB3  HIS   8           HB1      HIS   8  59.077  14.041  -0.754
   61    HD1  HIS   8           HD1      HIS   8  57.204  11.525   0.947
   62    HD2  HIS   8           HD2      HIS   8  61.297  12.055   0.130
   63    HE1  HIS   8           HE1      HIS   8  58.504  10.071   2.598
   64    H    GLY   9           HN       GLY   9  54.892  14.273  -0.552
   65    HA2  GLY   9           HA1      GLY   9  55.048  14.386   2.352
   66    HA3  GLY   9           HA2      GLY   9  55.369  15.961   1.598
   67    H    ARG  10           HN       ARG  10  53.294  13.756  -0.085
   68    HA   ARG  10           HA       ARG  10  50.814  14.598   1.160
   69    HB2  ARG  10           HB2      ARG  10  51.715  16.659  -0.214
   70    HB3  ARG  10           HB1      ARG  10  51.190  15.728  -1.634
   71    HG2  ARG  10           HG2      ARG  10  48.905  15.517  -0.549
   72    HG3  ARG  10           HG1      ARG  10  49.469  16.627   0.722
   73    HD2  ARG  10           HD2      ARG  10  48.310  17.957  -0.932
   74    HD3  ARG  10           HD1      ARG  10  50.051  18.284  -1.112
   75    HE   ARG  10           HE       ARG  10  49.925  17.325  -3.263
   76   HH11  ARG  10          HH11      ARG  10  47.000  17.935  -3.343
   77   HH12  ARG  10          HH12      ARG  10  46.311  16.389  -3.711
   78   HH21  ARG  10          HH21      ARG  10  49.169  14.619  -2.858
   79   HH22  ARG  10          HH22      ARG  10  47.540  14.511  -3.436
   80    H    HIS  11           HN       HIS  11  52.511  12.346  -0.102
   81    HA   HIS  11           HA       HIS  11  50.180  10.970  -1.318
   82    HB2  HIS  11           HB2      HIS  11  52.819  11.418  -2.769
   83    HB3  HIS  11           HB1      HIS  11  51.672  10.131  -3.210
   84    HD1  HIS  11           HD1      HIS  11  49.461  10.795  -4.359
   85    HD2  HIS  11           HD2      HIS  11  51.853  14.084  -3.282
   86    HE1  HIS  11           HE1      HIS  11  48.485  12.857  -5.510
   87    H    ALA  12           HN       ALA  12  50.175   8.901  -1.259
   88    HA   ALA  12           HA       ALA  12  50.582   6.782  -0.514
   89    HB1  ALA  12           HB1      ALA  12  52.936   7.375  -1.250
   90    HB2  ALA  12           HB2      ALA  12  52.767   6.137   0.022
   91    HB3  ALA  12           HB3      ALA  12  53.130   7.814   0.438
   92    H    ALA  13           HN       ALA  13  51.696   9.580   1.324
   93    HA   ALA  13           HA       ALA  13  51.212   8.329   3.926
   94    HB1  ALA  13           HB1      ALA  13  50.909  10.663   4.694
   95    HB2  ALA  13           HB2      ALA  13  50.819  11.240   3.013
   96    HB3  ALA  13           HB3      ALA  13  52.356  10.619   3.661
   97    H    LYS  14           HN       LYS  14  50.239   8.518   0.908
   98    HA   LYS  14           HA       LYS  14  47.172   8.593   1.527
   99    HB2  LYS  14           HB2      LYS  14  48.411  10.205  -0.125
  100    HB3  LYS  14           HB1      LYS  14  48.692   8.715  -1.101
  101    HG2  LYS  14           HG2      LYS  14  46.481   8.670  -1.833
  102    HG3  LYS  14           HG1      LYS  14  45.821   9.196  -0.268
  103    HD2  LYS  14           HD2      LYS  14  46.334  11.512  -0.748
  104    HD3  LYS  14           HD1      LYS  14  47.273  11.063  -2.192
  105    HE2  LYS  14           HE2      LYS  14  45.059  11.854  -2.881
  106    HE3  LYS  14           HE1      LYS  14  45.186  10.108  -3.204
  107    HZ1  LYS  14           HZ1      LYS  14  43.346   9.905  -1.999
  108    HZ2  LYS  14           HZ2      LYS  14  43.420  11.509  -1.445
  109    HZ3  LYS  14           HZ3      LYS  14  44.267  10.285  -0.627
  110    H    HIS  15           HN       HIS  15  46.238   7.444  -0.636
  111    HA   HIS  15           HA       HIS  15  45.550   5.283  -1.234
  112    HB2  HIS  15           HB2      HIS  15  47.137   6.104  -2.975
  113    HB3  HIS  15           HB1      HIS  15  48.455   5.257  -2.131
  114    HD1  HIS  15           HD1      HIS  15  45.229   3.474  -1.935
  115    HD2  HIS  15           HD2      HIS  15  48.496   3.593  -4.582
  116    HE1  HIS  15           HE1      HIS  15  45.071   1.408  -3.433
  117    H    ILE  16           HN       ILE  16  47.016   5.514   1.469
  118    HA   ILE  16           HA       ILE  16  46.745   2.978   2.306
  119    HB   ILE  16           HB       ILE  16  48.505   2.052   0.998
  120   HG12  ILE  16          HG12      ILE  16  49.929   2.680   3.612
  121   HG13  ILE  16          HG11      ILE  16  48.531   1.585   3.558
  122   HG21  ILE  16          HG21      ILE  16  50.071   4.522   1.851
  123   HG22  ILE  16          HG22      ILE  16  49.617   4.080   0.195
  124   HG23  ILE  16          HG23      ILE  16  50.838   3.136   1.071
  125   HD11  ILE  16           HD1      ILE  16  50.364   0.111   3.356
  126   HD12  ILE  16           HD2      ILE  16  51.278   1.223   2.316
  127   HD13  ILE  16           HD3      ILE  16  49.877   0.344   1.663
  128    H    GLY  17           HN       GLY  17  48.661   5.675   2.456
  129    HA2  GLY  17           HA1      GLY  17  48.793   5.630   5.400
  130    HA3  GLY  17           HA2      GLY  17  49.328   6.949   4.340
  131    H    HIS  18           HN       HIS  18  46.672   6.253   2.807
  132    HA   HIS  18           HA       HIS  18  45.004   8.200   4.386
  133    HB2  HIS  18           HB2      HIS  18  45.202   7.313   1.539
  134    HB3  HIS  18           HB1      HIS  18  43.536   7.530   2.108
  135    HD1  HIS  18           HD1      HIS  18  43.259   9.645   0.587
  136    HD2  HIS  18           HD2      HIS  18  46.290   9.984   3.481
  137    HE1  HIS  18           HE1      HIS  18  43.879  12.118   0.754
  138    H    ALA  19           HN       ALA  19  44.888   4.870   3.001
  139    HA   ALA  19           HA       ALA  19  43.634   3.594   5.119
  140    HB1  ALA  19           HB1      ALA  19  41.648   5.205   3.517
  141    HB2  ALA  19           HB2      ALA  19  41.669   4.851   5.263
  142    HB3  ALA  19           HB3      ALA  19  41.150   3.602   4.111
  143    H    ALA  20           HN       ALA  20  45.015   3.635   2.281
  144    HA   ALA  20           HA       ALA  20  45.355   2.069   0.604
  145    HB1  ALA  20           HB1      ALA  20  43.883   0.093   2.376
  146    HB2  ALA  20           HB2      ALA  20  45.561   0.599   2.682
  147    HB3  ALA  20           HB3      ALA  20  45.146  -0.239   1.168
  148    H    VAL  21           HN       VAL  21  42.596   3.436   1.309
  149    HA   VAL  21           HA       VAL  21  41.175   2.277  -1.047
  150    HB   VAL  21           HB       VAL  21  39.885   2.688   1.692
  151   HG11  VAL  21          HG11      VAL  21  38.225   3.250   0.090
  152   HG12  VAL  21          HG12      VAL  21  37.922   1.528   0.400
  153   HG13  VAL  21          HG13      VAL  21  38.794   2.026  -1.070
  154   HG21  VAL  21          HG21      VAL  21  40.503   0.172   0.076
  155   HG22  VAL  21          HG22      VAL  21  39.486   0.201   1.536
  156   HG23  VAL  21          HG23      VAL  21  41.208   0.629   1.645
  157    H    ASN  22           HN       ASN  22  42.301   4.784   0.873
  158    HA   ASN  22           HA       ASN  22  42.370   7.057   0.112
  159    HB2  ASN  22           HB2      ASN  22  40.857   6.483  -1.898
  160    HB3  ASN  22           HB1      ASN  22  39.483   6.843  -0.819
  161   HD21  ASN  22          HD21      ASN  22  38.890   9.013  -0.580
  162   HD22  ASN  22          HD22      ASN  22  39.877  10.366  -1.141
  163    H    HIS  23           HN       HIS  23  39.591   5.457   1.566
  164    HA   HIS  23           HA       HIS  23  39.834   6.974   4.002
  165    HB2  HIS  23           HB2      HIS  23  38.830   8.774   2.638
  166    HB3  HIS  23           HB1      HIS  23  37.479   7.698   2.210
  167    HD1  HIS  23           HD1      HIS  23  36.026   6.765   4.323
  168    HD2  HIS  23           HD2      HIS  23  38.533  10.048   5.102
  169    HE1  HIS  23           HE1      HIS  23  35.212   7.848   6.489
  170    H    TYR  24           HN       TYR  24  39.705   5.035   5.046
  171    HA   TYR  24           HA       TYR  24  37.018   3.957   5.423
  172    HB2  TYR  24           HB2      TYR  24  37.744   2.846   3.283
  173    HB3  TYR  24           HB1      TYR  24  39.102   2.122   4.177
  174    HD1  TYR  24           HD1      TYR  24  38.757   0.277   5.704
  175    HD2  TYR  24           HD2      TYR  24  35.383   2.286   3.908
  176    HE1  TYR  24           HE1      TYR  24  37.248  -1.533   6.512
  177    HE2  TYR  24           HE2      TYR  24  33.875   0.474   4.717
  178    HH   TYR  24           HH       TYR  24  34.953  -2.037   6.880
  179    H    LEU  25           HN       LEU  25  40.067   4.721   6.402
  180    HA   LEU  25           HA       LEU  25  41.342   4.200   8.275
  181    HB2  LEU  25           HB2      LEU  25  38.755   3.261   9.555
  182    HB3  LEU  25           HB1      LEU  25  40.142   4.075  10.317
  183    HG   LEU  25           HG       LEU  25  38.198   5.295   8.305
  184   HD11  LEU  25          HD11      LEU  25  37.548   6.725  10.192
  185   HD12  LEU  25          HD12      LEU  25  38.752   5.933  11.236
  186   HD13  LEU  25          HD13      LEU  25  37.349   5.014  10.639
  187   HD21  LEU  25          HD21      LEU  25  40.334   6.285   7.852
  188   HD22  LEU  25          HD22      LEU  25  40.766   6.333   9.580
  189   HD23  LEU  25          HD23      LEU  25  39.516   7.429   8.942
  Start of MODEL   66
    1    H1   GLY   1           HT1      GLY   1  63.390  23.551  -1.628
    2    H2   GLY   1           HT2      GLY   1  64.997  23.089  -1.323
    3    H3   GLY   1           HT3      GLY   1  64.454  24.637  -0.879
    4    HA2  GLY   1           HA1      GLY   1  64.414  23.592   1.100
    5    HA3  GLY   1           HA2      GLY   1  62.751  23.382   0.517
    6    H    TRP   2           HN       TRP   2  62.075  21.455   1.187
    7    HA   TRP   2           HA       TRP   2  63.728  19.223   1.746
    8    HB2  TRP   2           HB2      TRP   2  60.808  19.315   0.892
    9    HB3  TRP   2           HB1      TRP   2  61.621  17.893   1.591
   10    HD1  TRP   2           HD1      TRP   2  62.221  17.947   4.152
   11    HE1  TRP   2           HE1      TRP   2  61.495  19.462   6.137
   12    HE3  TRP   2           HE3      TRP   2  60.138  21.802   1.504
   13    HZ2  TRP   2           HZ2      TRP   2  60.186  22.002   6.492
   14    HZ3  TRP   2           HZ3      TRP   2  59.157  23.762   2.686
   15    HH2  TRP   2           HH2      TRP   2  59.179  23.865   5.176
   16    H    GLY   3           HN       GLY   3  64.259  17.346   0.633
   17    HA2  GLY   3           HA1      GLY   3  64.823  17.695  -2.160
   18    HA3  GLY   3           HA2      GLY   3  64.981  16.187  -1.235
   19    H    SER   4           HN       SER   4  62.186  16.143  -0.387
   20    HA   SER   4           HA       SER   4  61.109  14.821  -2.768
   21    HB2  SER   4           HB2      SER   4  59.983  15.348   0.006
   22    HB3  SER   4           HB1      SER   4  59.120  14.442  -1.256
   23    HG   SER   4           HG       SER   4  61.747  13.683  -0.840
   24    H    ILE   5           HN       ILE   5  60.297  15.970  -4.399
   25    HA   ILE   5           HA       ILE   5  59.283  18.659  -4.068
   26    HB   ILE   5           HB       ILE   5  58.679  16.793  -6.401
   27   HG12  ILE   5          HG12      ILE   5  61.177  18.466  -5.860
   28   HG13  ILE   5          HG11      ILE   5  61.096  16.689  -5.902
   29   HG21  ILE   5          HG21      ILE   5  59.208  19.793  -6.375
   30   HG22  ILE   5          HG22      ILE   5  57.579  19.112  -6.159
   31   HG23  ILE   5          HG23      ILE   5  58.472  18.817  -7.669
   32   HD11  ILE   5           HD1      ILE   5  60.770  18.655  -8.193
   33   HD12  ILE   5           HD2      ILE   5  60.152  16.988  -8.314
   34   HD13  ILE   5           HD3      ILE   5  61.890  17.280  -8.061
   35    H    PHE   6           HN       PHE   6  57.807  18.154  -2.244
   36    HA   PHE   6           HA       PHE   6  55.672  17.794  -1.407
   37    HB2  PHE   6           HB2      PHE   6  55.007  18.451  -4.302
   38    HB3  PHE   6           HB1      PHE   6  53.789  18.311  -3.011
   39    HD1  PHE   6           HD1      PHE   6  53.633  19.973  -1.229
   40    HD2  PHE   6           HD2      PHE   6  56.679  20.270  -4.272
   41    HE1  PHE   6           HE1      PHE   6  54.120  22.309  -0.514
   42    HE2  PHE   6           HE2      PHE   6  57.166  22.607  -3.556
   43    HZ   PHE   6           HZ       PHE   6  55.846  23.645  -1.715
   44    H    LYS   7           HN       LYS   7  57.229  15.577  -2.995
   45    HA   LYS   7           HA       LYS   7  55.131  13.804  -3.944
   46    HB2  LYS   7           HB2      LYS   7  58.054  13.409  -3.211
   47    HB3  LYS   7           HB1      LYS   7  57.028  12.072  -3.777
   48    HG2  LYS   7           HG2      LYS   7  57.134  14.643  -5.396
   49    HG3  LYS   7           HG1      LYS   7  58.478  13.488  -5.517
   50    HD2  LYS   7           HD2      LYS   7  56.852  11.682  -6.102
   51    HD3  LYS   7           HD1      LYS   7  55.535  12.876  -6.056
   52    HE2  LYS   7           HE2      LYS   7  57.989  13.086  -7.850
   53    HE3  LYS   7           HE1      LYS   7  56.405  12.466  -8.374
   54    HZ1  LYS   7           HZ1      LYS   7  56.827  15.158  -7.179
   55    HZ2  LYS   7           HZ2      LYS   7  55.406  14.561  -7.892
   56    HZ3  LYS   7           HZ3      LYS   7  56.778  14.861  -8.848
   57    H    HIS   8           HN       HIS   8  57.347  13.566  -1.118
   58    HA   HIS   8           HA       HIS   8  55.572  11.606   0.164
   59    HB2  HIS   8           HB2      HIS   8  58.003  13.068   1.267
   60    HB3  HIS   8           HB1      HIS   8  57.231  11.619   1.956
   61    HD1  HIS   8           HD1      HIS   8  57.010  11.246  -1.605
   62    HD2  HIS   8           HD2      HIS   8  60.107  10.751   1.198
   63    HE1  HIS   8           HE1      HIS   8  58.782   9.754  -2.684
   64    H    GLY   9           HN       GLY   9  53.806  13.419  -0.133
   65    HA2  GLY   9           HA1      GLY   9  53.225  14.353   2.547
   66    HA3  GLY   9           HA2      GLY   9  53.672  15.694   1.473
   67    H    ARG  10           HN       ARG  10  52.551  14.020  -0.836
   68    HA   ARG  10           HA       ARG  10  49.621  14.508  -0.283
   69    HB2  ARG  10           HB2      ARG  10  51.126  15.035  -2.880
   70    HB3  ARG  10           HB1      ARG  10  49.395  15.319  -2.576
   71    HG2  ARG  10           HG2      ARG  10  49.936  16.982  -0.853
   72    HG3  ARG  10           HG1      ARG  10  51.675  16.663  -1.062
   73    HD2  ARG  10           HD2      ARG  10  51.507  17.390  -3.438
   74    HD3  ARG  10           HD1      ARG  10  49.782  17.754  -3.191
   75    HE   ARG  10           HE       ARG  10  51.958  19.471  -2.442
   76   HH11  ARG  10          HH11      ARG  10  51.048  18.724   0.279
   77   HH12  ARG  10          HH12      ARG  10  49.769  19.853   0.575
   78   HH21  ARG  10          HH21      ARG  10  49.396  20.715  -2.762
   79   HH22  ARG  10          HH22      ARG  10  48.834  20.981  -1.146
   80    H    HIS  11           HN       HIS  11  51.849  12.195  -0.667
   81    HA   HIS  11           HA       HIS  11  49.863  10.314  -1.776
   82    HB2  HIS  11           HB2      HIS  11  52.601  10.570  -3.079
   83    HB3  HIS  11           HB1      HIS  11  51.303   9.435  -3.523
   84    HD1  HIS  11           HD1      HIS  11  52.302  13.087  -3.706
   85    HD2  HIS  11           HD2      HIS  11  49.216  10.573  -5.065
   86    HE1  HIS  11           HE1      HIS  11  50.906  14.429  -5.373
   87    H    ALA  12           HN       ALA  12  50.107   8.322  -1.313
   88    HA   ALA  12           HA       ALA  12  50.718   6.448  -0.162
   89    HB1  ALA  12           HB1      ALA  12  53.048   7.967   0.693
   90    HB2  ALA  12           HB2      ALA  12  53.022   7.197  -0.897
   91    HB3  ALA  12           HB3      ALA  12  52.931   6.221   0.590
   92    H    ALA  13           HN       ALA  13  51.350   9.659   1.150
   93    HA   ALA  13           HA       ALA  13  50.831   8.862   3.919
   94    HB1  ALA  13           HB1      ALA  13  49.834  11.325   3.864
   95    HB2  ALA  13           HB2      ALA  13  50.653  11.441   2.288
   96    HB3  ALA  13           HB3      ALA  13  51.600  11.137   3.765
   97    H    LYS  14           HN       LYS  14  50.065   8.349   0.881
   98    HA   LYS  14           HA       LYS  14  46.974   8.135   1.331
   99    HB2  LYS  14           HB2      LYS  14  48.120   9.570  -0.537
  100    HB3  LYS  14           HB1      LYS  14  48.660   7.980  -1.196
  101    HG2  LYS  14           HG2      LYS  14  46.541   7.502  -2.028
  102    HG3  LYS  14           HG1      LYS  14  45.700   8.198  -0.626
  103    HD2  LYS  14           HD2      LYS  14  46.095  10.474  -1.505
  104    HD3  LYS  14           HD1      LYS  14  46.977   9.791  -2.893
  105    HE2  LYS  14           HE2      LYS  14  44.892   8.484  -3.477
  106    HE3  LYS  14           HE1      LYS  14  44.037   9.382  -2.200
  107    HZ1  LYS  14           HZ1      LYS  14  44.955  10.278  -4.812
  108    HZ2  LYS  14           HZ2      LYS  14  45.194  11.378  -3.537
  109    HZ3  LYS  14           HZ3      LYS  14  43.634  10.798  -3.885
  110    H    HIS  15           HN       HIS  15  46.349   6.499  -0.624
  111    HA   HIS  15           HA       HIS  15  45.982   4.196  -0.824
  112    HB2  HIS  15           HB2      HIS  15  48.886   4.561  -1.625
  113    HB3  HIS  15           HB1      HIS  15  47.879   3.158  -2.053
  114    HD1  HIS  15           HD1      HIS  15  48.785   6.534  -3.166
  115    HD2  HIS  15           HD2      HIS  15  45.511   3.943  -3.669
  116    HE1  HIS  15           HE1      HIS  15  47.402   7.424  -5.122
  117    H    ILE  16           HN       ILE  16  47.097   5.075   1.875
  118    HA   ILE  16           HA       ILE  16  47.158   2.747   3.176
  119    HB   ILE  16           HB       ILE  16  49.111   1.846   2.093
  120   HG12  ILE  16          HG12      ILE  16  50.159   3.077   4.677
  121   HG13  ILE  16          HG11      ILE  16  49.050   1.692   4.626
  122   HG21  ILE  16          HG21      ILE  16  50.287   4.613   2.581
  123   HG22  ILE  16          HG22      ILE  16  50.050   3.828   1.008
  124   HG23  ILE  16          HG23      ILE  16  51.292   3.233   2.126
  125   HD11  ILE  16           HD1      ILE  16  51.966   1.832   3.854
  126   HD12  ILE  16           HD2      ILE  16  50.927   0.701   2.957
  127   HD13  ILE  16           HD3      ILE  16  51.086   0.557   4.722
  128    H    GLY  17           HN       GLY  17  48.599   5.706   2.814
  129    HA2  GLY  17           HA1      GLY  17  48.594   6.206   5.737
  130    HA3  GLY  17           HA2      GLY  17  49.066   7.356   4.472
  131    H    HIS  18           HN       HIS  18  46.622   6.013   2.985
  132    HA   HIS  18           HA       HIS  18  44.627   8.012   4.042
  133    HB2  HIS  18           HB2      HIS  18  45.153   6.670   1.426
  134    HB3  HIS  18           HB1      HIS  18  43.432   6.795   1.837
  135    HD1  HIS  18           HD1      HIS  18  43.101   8.566  -0.075
  136    HD2  HIS  18           HD2      HIS  18  45.794   9.751   2.930
  137    HE1  HIS  18           HE1      HIS  18  43.460  11.083  -0.322
  138    H    ALA  19           HN       ALA  19  45.120   4.456   3.612
  139    HA   ALA  19           HA       ALA  19  42.905   4.104   5.604
  140    HB1  ALA  19           HB1      ALA  19  41.710   2.462   4.200
  141    HB2  ALA  19           HB2      ALA  19  42.773   2.872   2.835
  142    HB3  ALA  19           HB3      ALA  19  41.677   4.099   3.511
  143    H    ALA  20           HN       ALA  20  45.857   3.588   5.389
  144    HA   ALA  20           HA       ALA  20  47.298   1.937   6.141
  145    HB1  ALA  20           HB1      ALA  20  46.497   0.385   7.728
  146    HB2  ALA  20           HB2      ALA  20  44.874   0.348   7.003
  147    HB3  ALA  20           HB3      ALA  20  45.425   1.796   7.879
  148    H    VAL  21           HN       VAL  21  45.005   1.339   3.700
  149    HA   VAL  21           HA       VAL  21  46.671  -0.899   2.683
  150    HB   VAL  21           HB       VAL  21  43.655  -1.210   3.051
  151   HG11  VAL  21          HG11      VAL  21  44.361  -2.296   1.015
  152   HG12  VAL  21          HG12      VAL  21  44.219  -3.572   2.244
  153   HG13  VAL  21          HG13      VAL  21  45.822  -2.945   1.794
  154   HG21  VAL  21          HG21      VAL  21  46.047  -2.484   4.452
  155   HG22  VAL  21          HG22      VAL  21  44.399  -3.148   4.535
  156   HG23  VAL  21          HG23      VAL  21  44.738  -1.535   5.195
  157    H    ASN  22           HN       ASN  22  44.280   1.656   2.250
  158    HA   ASN  22           HA       ASN  22  45.088   2.068  -0.470
  159    HB2  ASN  22           HB2      ASN  22  42.764   1.399  -1.471
  160    HB3  ASN  22           HB1      ASN  22  43.968   0.121  -1.182
  161   HD21  ASN  22          HD21      ASN  22  42.036  -1.375  -1.049
  162   HD22  ASN  22          HD22      ASN  22  41.161  -1.463   0.483
  163    H    HIS  23           HN       HIS  23  41.662   2.119   0.336
  164    HA   HIS  23           HA       HIS  23  41.725   4.895   1.306
  165    HB2  HIS  23           HB2      HIS  23  41.992   5.158  -1.165
  166    HB3  HIS  23           HB1      HIS  23  40.462   4.279  -1.395
  167    HD1  HIS  23           HD1      HIS  23  38.937   6.136  -2.192
  168    HD2  HIS  23           HD2      HIS  23  41.090   7.187   1.263
  169    HE1  HIS  23           HE1      HIS  23  37.979   8.346  -1.341
  170    H    TYR  24           HN       TYR  24  38.908   4.571  -0.396
  171    HA   TYR  24           HA       TYR  24  36.729   4.238   0.343
  172    HB2  TYR  24           HB2      TYR  24  37.968   1.696   1.471
  173    HB3  TYR  24           HB1      TYR  24  36.241   1.966   1.142
  174    HD1  TYR  24           HD1      TYR  24  39.543   1.271  -0.330
  175    HD2  TYR  24           HD2      TYR  24  35.426   2.237  -1.195
  176    HE1  TYR  24           HE1      TYR  24  39.880   0.583  -2.700
  177    HE2  TYR  24           HE2      TYR  24  35.763   1.549  -3.566
  178    HH   TYR  24           HH       TYR  24  38.436   1.267  -5.090
  179    H    LEU  25           HN       LEU  25  38.865   5.406   2.278
  180    HA   LEU  25           HA       LEU  25  38.923   6.121   4.488
  181    HB2  LEU  25           HB2      LEU  25  35.908   5.768   4.518
  182    HB3  LEU  25           HB1      LEU  25  36.894   7.008   5.331
  183    HG   LEU  25           HG       LEU  25  36.448   6.721   2.326
  184   HD11  LEU  25          HD11      LEU  25  35.345   8.933   2.593
  185   HD12  LEU  25          HD12      LEU  25  35.623   8.852   4.349
  186   HD13  LEU  25          HD13      LEU  25  34.538   7.679   3.563
  187   HD21  LEU  25          HD21      LEU  25  38.246   8.548   3.975
  188   HD22  LEU  25          HD22      LEU  25  37.715   8.973   2.329
  189   HD23  LEU  25          HD23      LEU  25  38.696   7.514   2.598
  Start of MODEL   67
    1    H1   GLY   1           HT1      GLY   1  68.879  17.198  -6.587
    2    H2   GLY   1           HT2      GLY   1  69.338  15.940  -7.632
    3    H3   GLY   1           HT3      GLY   1  69.733  15.866  -5.981
    4    HA2  GLY   1           HA1      GLY   1  67.845  14.457  -6.739
    5    HA3  GLY   1           HA2      GLY   1  67.578  15.499  -5.327
    6    H    TRP   2           HN       TRP   2  65.504  14.445  -6.923
    7    HA   TRP   2           HA       TRP   2  64.631  16.428  -8.860
    8    HB2  TRP   2           HB2      TRP   2  63.145  14.218  -7.386
    9    HB3  TRP   2           HB1      TRP   2  62.447  15.203  -8.696
   10    HD1  TRP   2           HD1      TRP   2  63.226  14.729 -11.143
   11    HE1  TRP   2           HE1      TRP   2  64.632  12.855 -12.270
   12    HE3  TRP   2           HE3      TRP   2  65.213  12.576  -6.944
   13    HZ2  TRP   2           HZ2      TRP   2  66.375  10.722 -11.431
   14    HZ3  TRP   2           HZ3      TRP   2  66.746  10.622  -7.131
   15    HH2  TRP   2           HH2      TRP   2  67.328   9.695  -9.369
   16    H    GLY   3           HN       GLY   3  62.721  17.770  -8.674
   17    HA2  GLY   3           HA1      GLY   3  62.795  19.378  -6.292
   18    HA3  GLY   3           HA2      GLY   3  61.619  19.509  -7.614
   19    H    SER   4           HN       SER   4  61.065  16.501  -7.123
   20    HA   SER   4           HA       SER   4  59.327  15.378  -6.063
   21    HB2  SER   4           HB2      SER   4  59.482  15.255  -3.660
   22    HB3  SER   4           HB1      SER   4  61.135  15.410  -4.295
   23    HG   SER   4           HG       SER   4  59.489  17.357  -3.056
   24    H    ILE   5           HN       ILE   5  57.920  16.919  -7.336
   25    HA   ILE   5           HA       ILE   5  56.725  19.201  -6.114
   26    HB   ILE   5           HB       ILE   5  55.355  17.277  -8.038
   27   HG12  ILE   5          HG12      ILE   5  57.724  18.126  -8.736
   28   HG13  ILE   5          HG11      ILE   5  56.389  18.355  -9.879
   29   HG21  ILE   5          HG21      ILE   5  53.801  18.869  -7.152
   30   HG22  ILE   5          HG22      ILE   5  54.243  19.448  -8.775
   31   HG23  ILE   5          HG23      ILE   5  54.957  20.208  -7.333
   32   HD11  ILE   5           HD1      ILE   5  57.918  20.371  -9.566
   33   HD12  ILE   5           HD2      ILE   5  57.273  20.519  -7.918
   34   HD13  ILE   5           HD3      ILE   5  56.188  20.692  -9.316
   35    H    PHE   6           HN       PHE   6  56.484  18.494  -3.893
   36    HA   PHE   6           HA       PHE   6  55.213  17.715  -2.118
   37    HB2  PHE   6           HB2      PHE   6  53.005  17.962  -4.199
   38    HB3  PHE   6           HB1      PHE   6  52.742  17.750  -2.451
   39    HD1  PHE   6           HD1      PHE   6  53.449  19.516  -0.843
   40    HD2  PHE   6           HD2      PHE   6  53.758  20.084  -5.110
   41    HE1  PHE   6           HE1      PHE   6  53.724  21.968  -0.497
   42    HE2  PHE   6           HE2      PHE   6  54.033  22.536  -4.764
   43    HZ   PHE   6           HZ       PHE   6  53.941  23.485  -2.463
   44    H    LYS   7           HN       LYS   7  56.221  15.799  -4.380
   45    HA   LYS   7           HA       LYS   7  54.423  13.573  -4.445
   46    HB2  LYS   7           HB2      LYS   7  57.460  13.665  -4.662
   47    HB3  LYS   7           HB1      LYS   7  56.446  12.262  -5.079
   48    HG2  LYS   7           HG2      LYS   7  55.204  13.712  -6.717
   49    HG3  LYS   7           HG1      LYS   7  56.356  15.024  -6.368
   50    HD2  LYS   7           HD2      LYS   7  58.230  13.477  -7.035
   51    HD3  LYS   7           HD1      LYS   7  57.007  12.281  -7.529
   52    HE2  LYS   7           HE2      LYS   7  56.097  13.797  -9.193
   53    HE3  LYS   7           HE1      LYS   7  57.129  15.127  -8.613
   54    HZ1  LYS   7           HZ1      LYS   7  58.826  13.008  -9.145
   55    HZ2  LYS   7           HZ2      LYS   7  58.648  14.434 -10.052
   56    HZ3  LYS   7           HZ3      LYS   7  57.746  13.050 -10.452
   57    H    HIS   8           HN       HIS   8  57.532  13.765  -2.649
   58    HA   HIS   8           HA       HIS   8  56.592  11.693  -0.777
   59    HB2  HIS   8           HB2      HIS   8  58.963  11.857  -1.604
   60    HB3  HIS   8           HB1      HIS   8  59.128  13.373  -0.685
   61    HD1  HIS   8           HD1      HIS   8  60.431  12.861   1.384
   62    HD2  HIS   8           HD2      HIS   8  57.590   9.879   0.525
   63    HE1  HIS   8           HE1      HIS   8  60.502  11.168   3.296
   64    H    GLY   9           HN       GLY   9  54.737  13.503  -0.438
   65    HA2  GLY   9           HA1      GLY   9  54.937  14.250   2.292
   66    HA3  GLY   9           HA2      GLY   9  55.325  15.679   1.315
   67    H    ARG  10           HN       ARG  10  53.221  13.441  -0.209
   68    HA   ARG  10           HA       ARG  10  50.738  14.465   0.919
   69    HB2  ARG  10           HB2      ARG  10  51.716  16.369  -0.586
   70    HB3  ARG  10           HB1      ARG  10  51.259  15.324  -1.950
   71    HG2  ARG  10           HG2      ARG  10  48.918  15.291  -1.165
   72    HG3  ARG  10           HG1      ARG  10  49.362  16.270   0.253
   73    HD2  ARG  10           HD2      ARG  10  50.221  18.032  -1.393
   74    HD3  ARG  10           HD1      ARG  10  49.430  17.088  -2.678
   75    HE   ARG  10           HE       ARG  10  47.575  17.615  -0.527
   76   HH11  ARG  10          HH11      ARG  10  46.754  17.846  -3.339
   77   HH12  ARG  10          HH12      ARG  10  46.625  19.556  -3.575
   78   HH21  ARG  10          HH21      ARG  10  48.477  20.352  -0.754
   79   HH22  ARG  10          HH22      ARG  10  47.600  20.976  -2.112
   80    H    HIS  11           HN       HIS  11  52.549  12.181  -0.527
   81    HA   HIS  11           HA       HIS  11  50.119  10.712  -1.481
   82    HB2  HIS  11           HB2      HIS  11  52.733  11.016  -3.012
   83    HB3  HIS  11           HB1      HIS  11  51.494   9.793  -3.385
   84    HD1  HIS  11           HD1      HIS  11  49.068  11.840  -2.634
   85    HD2  HIS  11           HD2      HIS  11  52.125  12.398  -5.467
   86    HE1  HIS  11           HE1      HIS  11  48.244  13.583  -4.311
   87    H    ALA  12           HN       ALA  12  50.100   8.647  -1.341
   88    HA   ALA  12           HA       ALA  12  50.502   6.555  -0.513
   89    HB1  ALA  12           HB1      ALA  12  52.702   5.915  -0.013
   90    HB2  ALA  12           HB2      ALA  12  53.088   7.603   0.316
   91    HB3  ALA  12           HB3      ALA  12  52.832   7.078  -1.350
   92    H    ALA  13           HN       ALA  13  51.690   9.417   1.174
   93    HA   ALA  13           HA       ALA  13  51.263   8.276   3.838
   94    HB1  ALA  13           HB1      ALA  13  50.792  10.738   4.392
   95    HB2  ALA  13           HB2      ALA  13  51.110  11.123   2.683
   96    HB3  ALA  13           HB3      ALA  13  52.413  10.471   3.705
   97    H    LYS  14           HN       LYS  14  50.215   8.349   0.837
   98    HA   LYS  14           HA       LYS  14  47.170   8.486   1.534
   99    HB2  LYS  14           HB2      LYS  14  48.371  10.015  -0.216
  100    HB3  LYS  14           HB1      LYS  14  48.620   8.486  -1.136
  101    HG2  LYS  14           HG2      LYS  14  46.396   8.425  -1.816
  102    HG3  LYS  14           HG1      LYS  14  45.775   9.009  -0.254
  103    HD2  LYS  14           HD2      LYS  14  46.237  11.301  -0.827
  104    HD3  LYS  14           HD1      LYS  14  47.198  10.821  -2.247
  105    HE2  LYS  14           HE2      LYS  14  44.237  10.172  -1.929
  106    HE3  LYS  14           HE1      LYS  14  44.840  11.616  -2.776
  107    HZ1  LYS  14           HZ1      LYS  14  46.226   9.313  -3.666
  108    HZ2  LYS  14           HZ2      LYS  14  45.263  10.392  -4.558
  109    HZ3  LYS  14           HZ3      LYS  14  44.557   9.047  -3.797
  110    H    HIS  15           HN       HIS  15  46.167   7.259  -0.562
  111    HA   HIS  15           HA       HIS  15  45.437   5.087  -1.043
  112    HB2  HIS  15           HB2      HIS  15  47.029   5.838  -2.843
  113    HB3  HIS  15           HB1      HIS  15  48.313   4.927  -2.015
  114    HD1  HIS  15           HD1      HIS  15  48.573   2.553  -2.734
  115    HD2  HIS  15           HD2      HIS  15  44.665   3.968  -3.375
  116    HE1  HIS  15           HE1      HIS  15  47.276   0.697  -3.918
  117    H    ILE  16           HN       ILE  16  46.943   5.416   1.606
  118    HA   ILE  16           HA       ILE  16  46.682   2.924   2.558
  119    HB   ILE  16           HB       ILE  16  48.403   1.930   1.254
  120   HG12  ILE  16          HG12      ILE  16  49.863   2.646   3.826
  121   HG13  ILE  16          HG11      ILE  16  48.467   1.547   3.818
  122   HG21  ILE  16          HG21      ILE  16  49.532   3.910   0.353
  123   HG22  ILE  16          HG22      ILE  16  50.752   2.988   1.252
  124   HG23  ILE  16          HG23      ILE  16  50.011   4.412   1.986
  125   HD11  ILE  16           HD1      ILE  16  50.286   0.059   3.643
  126   HD12  ILE  16           HD2      ILE  16  51.213   1.146   2.590
  127   HD13  ILE  16           HD3      ILE  16  49.816   0.258   1.941
  128    H    GLY  17           HN       GLY  17  48.610   5.617   2.560
  129    HA2  GLY  17           HA1      GLY  17  48.799   5.681   5.501
  130    HA3  GLY  17           HA2      GLY  17  49.316   6.959   4.383
  131    H    HIS  18           HN       HIS  18  46.637   6.217   2.924
  132    HA   HIS  18           HA       HIS  18  44.982   8.183   4.515
  133    HB2  HIS  18           HB2      HIS  18  45.136   7.335   1.640
  134    HB3  HIS  18           HB1      HIS  18  43.504   7.685   2.243
  135    HD1  HIS  18           HD1      HIS  18  46.384   9.559   3.765
  136    HD2  HIS  18           HD2      HIS  18  43.450  10.172   0.816
  137    HE1  HIS  18           HE1      HIS  18  46.414  12.043   3.165
  138    H    ALA  19           HN       ALA  19  44.764   4.874   3.025
  139    HA   ALA  19           HA       ALA  19  43.377   3.705   5.178
  140    HB1  ALA  19           HB1      ALA  19  40.980   3.717   4.000
  141    HB2  ALA  19           HB2      ALA  19  41.564   5.255   3.325
  142    HB3  ALA  19           HB3      ALA  19  41.455   5.038   5.089
  143    H    ALA  20           HN       ALA  20  44.971   3.516   2.452
  144    HA   ALA  20           HA       ALA  20  45.371   1.822   0.913
  145    HB1  ALA  20           HB1      ALA  20  45.324   0.488   3.098
  146    HB2  ALA  20           HB2      ALA  20  45.020  -0.426   1.601
  147    HB3  ALA  20           HB3      ALA  20  43.662   0.024   2.660
  148    H    VAL  21           HN       VAL  21  42.619   3.340   1.317
  149    HA   VAL  21           HA       VAL  21  41.366   2.129  -1.101
  150    HB   VAL  21           HB       VAL  21  39.845   2.671   1.495
  151   HG11  VAL  21          HG11      VAL  21  38.991   1.939  -1.333
  152   HG12  VAL  21          HG12      VAL  21  38.370   3.234  -0.282
  153   HG13  VAL  21          HG13      VAL  21  37.968   1.541   0.068
  154   HG21  VAL  21          HG21      VAL  21  40.540   0.090   0.016
  155   HG22  VAL  21          HG22      VAL  21  39.378   0.189   1.361
  156   HG23  VAL  21          HG23      VAL  21  41.090   0.574   1.637
  157    H    ASN  22           HN       ASN  22  42.392   4.661   0.828
  158    HA   ASN  22           HA       ASN  22  42.634   6.896   0.001
  159    HB2  ASN  22           HB2      ASN  22  41.303   6.301  -2.125
  160    HB3  ASN  22           HB1      ASN  22  39.845   6.756  -1.202
  161   HD21  ASN  22          HD21      ASN  22  42.712   7.979  -2.862
  162   HD22  ASN  22          HD22      ASN  22  42.346   9.689  -2.618
  163    H    HIS  23           HN       HIS  23  39.645   5.494   1.245
  164    HA   HIS  23           HA       HIS  23  39.739   7.211   3.583
  165    HB2  HIS  23           HB2      HIS  23  38.826   8.845   1.963
  166    HB3  HIS  23           HB1      HIS  23  37.506   7.715   1.574
  167    HD1  HIS  23           HD1      HIS  23  35.546   7.536   3.197
  168    HD2  HIS  23           HD2      HIS  23  38.689   9.920   4.654
  169    HE1  HIS  23           HE1      HIS  23  34.702   8.697   5.311
  170    H    TYR  24           HN       TYR  24  39.599   5.314   4.735
  171    HA   TYR  24           HA       TYR  24  36.888   4.275   5.085
  172    HB2  TYR  24           HB2      TYR  24  37.718   3.004   3.066
  173    HB3  TYR  24           HB1      TYR  24  39.016   2.340   4.087
  174    HD1  TYR  24           HD1      TYR  24  38.579   0.569   5.657
  175    HD2  TYR  24           HD2      TYR  24  35.306   2.563   3.674
  176    HE1  TYR  24           HE1      TYR  24  37.004  -1.160   6.519
  177    HE2  TYR  24           HE2      TYR  24  33.731   0.836   4.534
  178    HH   TYR  24           HH       TYR  24  34.883  -1.877   6.554
  179    H    LEU  25           HN       LEU  25  39.888   5.122   6.133
  180    HA   LEU  25           HA       LEU  25  41.031   4.826   8.124
  181    HB2  LEU  25           HB2      LEU  25  38.542   5.366   8.839
  182    HB3  LEU  25           HB1      LEU  25  38.516   3.671   9.372
  183    HG   LEU  25           HG       LEU  25  40.502   5.816  10.261
  184   HD11  LEU  25          HD11      LEU  25  38.261   4.356  11.730
  185   HD12  LEU  25          HD12      LEU  25  38.240   6.062  11.226
  186   HD13  LEU  25          HD13      LEU  25  39.395   5.513  12.464
  187   HD21  LEU  25          HD21      LEU  25  40.298   2.826  10.800
  188   HD22  LEU  25          HD22      LEU  25  41.089   3.922  11.958
  189   HD23  LEU  25          HD23      LEU  25  41.722   3.772  10.305
  Start of MODEL   68
    1    H1   GLY   1           HT1      GLY   1  70.682  18.158  -3.027
    2    H2   GLY   1           HT2      GLY   1  71.414  19.187  -4.165
    3    H3   GLY   1           HT3      GLY   1  71.591  17.502  -4.297
    4    HA2  GLY   1           HA1      GLY   1  69.610  19.171  -5.343
    5    HA3  GLY   1           HA2      GLY   1  69.882  17.438  -5.610
    6    H    TRP   2           HN       TRP   2  67.887  16.592  -5.471
    7    HA   TRP   2           HA       TRP   2  66.643  16.529  -2.805
    8    HB2  TRP   2           HB2      TRP   2  65.242  17.862  -5.155
    9    HB3  TRP   2           HB1      TRP   2  64.418  17.321  -3.674
   10    HD1  TRP   2           HD1      TRP   2  66.200  20.216  -5.101
   11    HE1  TRP   2           HE1      TRP   2  66.744  21.995  -3.284
   12    HE3  TRP   2           HE3      TRP   2  65.227  17.425  -0.922
   13    HZ2  TRP   2           HZ2      TRP   2  66.746  22.152  -0.409
   14    HZ3  TRP   2           HZ3      TRP   2  65.507  18.409   1.348
   15    HH2  TRP   2           HH2      TRP   2  66.265  20.768   1.608
   16    H    GLY   3           HN       GLY   3  64.270  15.441  -3.250
   17    HA2  GLY   3           HA1      GLY   3  64.317  13.478  -5.412
   18    HA3  GLY   3           HA2      GLY   3  64.710  12.779  -3.829
   19    H    SER   4           HN       SER   4  62.574  15.541  -4.135
   20    HA   SER   4           HA       SER   4  60.110  14.038  -4.292
   21    HB2  SER   4           HB2      SER   4  59.345  14.162  -2.022
   22    HB3  SER   4           HB1      SER   4  60.956  13.411  -1.974
   23    HG   SER   4           HG       SER   4  60.486  15.222  -0.461
   24    H    ILE   5           HN       ILE   5  59.579  15.635  -5.778
   25    HA   ILE   5           HA       ILE   5  59.770  18.451  -5.133
   26    HB   ILE   5           HB       ILE   5  59.685  17.456  -7.475
   27   HG12  ILE   5          HG12      ILE   5  57.709  19.644  -6.694
   28   HG13  ILE   5          HG11      ILE   5  59.418  19.855  -7.128
   29   HG21  ILE   5          HG21      ILE   5  57.596  16.792  -8.428
   30   HG22  ILE   5          HG22      ILE   5  56.677  17.397  -7.029
   31   HG23  ILE   5          HG23      ILE   5  57.692  15.945  -6.867
   32   HD11  ILE   5           HD1      ILE   5  58.791  18.749  -9.391
   33   HD12  ILE   5           HD2      ILE   5  58.231  20.414  -9.111
   34   HD13  ILE   5           HD3      ILE   5  57.101  19.054  -8.921
   35    H    PHE   6           HN       PHE   6  57.180  16.011  -4.987
   36    HA   PHE   6           HA       PHE   6  55.798  17.551  -2.926
   37    HB2  PHE   6           HB2      PHE   6  54.618  17.336  -5.722
   38    HB3  PHE   6           HB1      PHE   6  53.597  17.559  -4.283
   39    HD1  PHE   6           HD1      PHE   6  54.523  19.488  -2.601
   40    HD2  PHE   6           HD2      PHE   6  55.277  19.302  -6.853
   41    HE1  PHE   6           HE1      PHE   6  54.975  21.934  -2.632
   42    HE2  PHE   6           HE2      PHE   6  55.729  21.749  -6.876
   43    HZ   PHE   6           HZ       PHE   6  55.516  23.075  -4.780
   44    H    LYS   7           HN       LYS   7  56.590  14.765  -4.646
   45    HA   LYS   7           HA       LYS   7  54.462  12.991  -4.306
   46    HB2  LYS   7           HB2      LYS   7  57.342  12.293  -3.629
   47    HB3  LYS   7           HB1      LYS   7  56.078  11.211  -4.257
   48    HG2  LYS   7           HG2      LYS   7  57.365  13.555  -5.729
   49    HG3  LYS   7           HG1      LYS   7  57.583  11.827  -6.079
   50    HD2  LYS   7           HD2      LYS   7  54.986  11.776  -6.390
   51    HD3  LYS   7           HD1      LYS   7  55.112  13.549  -6.491
   52    HE2  LYS   7           HE2      LYS   7  56.692  13.362  -8.365
   53    HE3  LYS   7           HE1      LYS   7  56.656  11.585  -8.244
   54    HZ1  LYS   7           HZ1      LYS   7  54.225  11.720  -8.642
   55    HZ2  LYS   7           HZ2      LYS   7  55.157  12.264  -9.954
   56    HZ3  LYS   7           HZ3      LYS   7  54.387  13.383  -8.934
   57    H    HIS   8           HN       HIS   8  57.167  13.095  -1.945
   58    HA   HIS   8           HA       HIS   8  55.454  11.944   0.122
   59    HB2  HIS   8           HB2      HIS   8  57.883  11.479   0.002
   60    HB3  HIS   8           HB1      HIS   8  58.222  13.197   0.324
   61    HD1  HIS   8           HD1      HIS   8  56.449  10.196   1.934
   62    HD2  HIS   8           HD2      HIS   8  58.138  13.890   3.024
   63    HE1  HIS   8           HE1      HIS   8  56.487  10.294   4.487
   64    H    GLY   9           HN       GLY   9  53.821  13.773  -0.258
   65    HA2  GLY   9           HA1      GLY   9  53.999  15.542   2.026
   66    HA3  GLY   9           HA2      GLY   9  54.234  16.427   0.506
   67    H    ARG  10           HN       ARG  10  52.444  14.218  -0.747
   68    HA   ARG  10           HA       ARG  10  49.812  14.779   0.435
   69    HB2  ARG  10           HB2      ARG  10  48.907  15.904  -1.580
   70    HB3  ARG  10           HB1      ARG  10  50.180  16.877  -0.803
   71    HG2  ARG  10           HG2      ARG  10  51.836  15.851  -2.424
   72    HG3  ARG  10           HG1      ARG  10  50.455  15.115  -3.274
   73    HD2  ARG  10           HD2      ARG  10  51.133  17.266  -4.322
   74    HD3  ARG  10           HD1      ARG  10  49.482  17.352  -3.659
   75    HE   ARG  10           HE       ARG  10  51.088  18.274  -1.587
   76   HH11  ARG  10          HH11      ARG  10  49.981  20.522  -1.698
   77   HH12  ARG  10          HH12      ARG  10  50.663  21.541  -2.920
   78   HH21  ARG  10          HH21      ARG  10  52.267  18.943  -4.564
   79   HH22  ARG  10          HH22      ARG  10  51.958  20.646  -4.545
   80    H    HIS  11           HN       HIS  11  51.679  12.566  -0.470
   81    HA   HIS  11           HA       HIS  11  49.581  10.908  -1.643
   82    HB2  HIS  11           HB2      HIS  11  50.455  12.018  -3.694
   83    HB3  HIS  11           HB1      HIS  11  52.090  11.448  -3.283
   84    HD1  HIS  11           HD1      HIS  11  52.646   8.953  -3.624
   85    HD2  HIS  11           HD2      HIS  11  48.699   9.982  -4.645
   86    HE1  HIS  11           HE1      HIS  11  51.623   6.947  -4.828
   87    H    ALA  12           HN       ALA  12  49.853   8.862  -1.526
   88    HA   ALA  12           HA       ALA  12  50.590   6.840  -0.765
   89    HB1  ALA  12           HB1      ALA  12  53.060   8.222  -0.085
   90    HB2  ALA  12           HB2      ALA  12  52.761   7.692  -1.744
   91    HB3  ALA  12           HB3      ALA  12  52.890   6.509  -0.418
   92    H    ALA  13           HN       ALA  13  51.487   9.820   0.898
   93    HA   ALA  13           HA       ALA  13  51.404   8.607   3.560
   94    HB1  ALA  13           HB1      ALA  13  52.155  10.880   3.672
   95    HB2  ALA  13           HB2      ALA  13  50.415  11.054   4.007
   96    HB3  ALA  13           HB3      ALA  13  51.049  11.398   2.379
   97    H    LYS  14           HN       LYS  14  50.154   8.571   0.632
   98    HA   LYS  14           HA       LYS  14  47.172   8.271   1.530
   99    HB2  LYS  14           HB2      LYS  14  48.043   9.971  -0.262
  100    HB3  LYS  14           HB1      LYS  14  48.424   8.498  -1.229
  101    HG2  LYS  14           HG2      LYS  14  46.181   8.159  -1.758
  102    HG3  LYS  14           HG1      LYS  14  45.602   8.631  -0.143
  103    HD2  LYS  14           HD2      LYS  14  45.835  10.999  -0.705
  104    HD3  LYS  14           HD1      LYS  14  46.574  10.590  -2.272
  105    HE2  LYS  14           HE2      LYS  14  44.502   9.483  -2.993
  106    HE3  LYS  14           HE1      LYS  14  43.760   9.793  -1.406
  107    HZ1  LYS  14           HZ1      LYS  14  44.510  11.742  -3.508
  108    HZ2  LYS  14           HZ2      LYS  14  44.281  12.226  -1.895
  109    HZ3  LYS  14           HZ3      LYS  14  43.003  11.515  -2.761
  110    H    HIS  15           HN       HIS  15  46.205   6.943  -0.520
  111    HA   HIS  15           HA       HIS  15  45.750   4.693  -0.996
  112    HB2  HIS  15           HB2      HIS  15  48.509   5.158  -2.185
  113    HB3  HIS  15           HB1      HIS  15  47.412   3.833  -2.642
  114    HD1  HIS  15           HD1      HIS  15  48.276   7.255  -3.515
  115    HD2  HIS  15           HD2      HIS  15  44.721   5.010  -3.487
  116    HE1  HIS  15           HE1      HIS  15  46.617   8.437  -5.057
  117    H    ILE  16           HN       ILE  16  47.369   5.202   1.554
  118    HA   ILE  16           HA       ILE  16  47.517   2.695   2.479
  119    HB   ILE  16           HB       ILE  16  49.268   1.940   1.049
  120   HG12  ILE  16          HG12      ILE  16  50.762   2.862   3.537
  121   HG13  ILE  16          HG11      ILE  16  49.569   1.548   3.576
  122   HG21  ILE  16          HG21      ILE  16  50.586   4.614   1.686
  123   HG22  ILE  16          HG22      ILE  16  50.042   4.066   0.092
  124   HG23  ILE  16          HG23      ILE  16  51.438   3.300   0.872
  125   HD11  ILE  16           HD1      ILE  16  51.024   0.552   1.580
  126   HD12  ILE  16           HD2      ILE  16  51.570   0.358   3.259
  127   HD13  ILE  16           HD3      ILE  16  52.286   1.620   2.236
  128    H    GLY  17           HN       GLY  17  49.128   5.590   2.391
  129    HA2  GLY  17           HA1      GLY  17  49.522   5.667   5.303
  130    HA3  GLY  17           HA2      GLY  17  49.774   7.009   4.170
  131    H    HIS  18           HN       HIS  18  47.083   5.950   2.933
  132    HA   HIS  18           HA       HIS  18  45.359   7.704   4.686
  133    HB2  HIS  18           HB2      HIS  18  45.339   6.813   1.822
  134    HB3  HIS  18           HB1      HIS  18  43.740   6.933   2.582
  135    HD1  HIS  18           HD1      HIS  18  46.526   9.242   3.673
  136    HD2  HIS  18           HD2      HIS  18  43.110   9.351   1.222
  137    HE1  HIS  18           HE1      HIS  18  46.106  11.687   3.062
  138    H    ALA  19           HN       ALA  19  45.527   4.378   3.306
  139    HA   ALA  19           HA       ALA  19  44.634   2.973   5.516
  140    HB1  ALA  19           HB1      ALA  19  42.084   2.671   4.754
  141    HB2  ALA  19           HB2      ALA  19  42.318   4.316   4.116
  142    HB3  ALA  19           HB3      ALA  19  42.553   3.988   5.851
  143    H    ALA  20           HN       ALA  20  45.676   3.183   2.511
  144    HA   ALA  20           HA       ALA  20  45.997   1.657   0.787
  145    HB1  ALA  20           HB1      ALA  20  46.692   0.255   2.805
  146    HB2  ALA  20           HB2      ALA  20  46.185  -0.654   1.362
  147    HB3  ALA  20           HB3      ALA  20  45.071  -0.477   2.739
  148    H    VAL  21           HN       VAL  21  43.234   2.676   1.843
  149    HA   VAL  21           HA       VAL  21  41.634   1.298  -0.262
  150    HB   VAL  21           HB       VAL  21  40.785   1.597   2.657
  151   HG11  VAL  21          HG11      VAL  21  38.816   2.059   1.418
  152   HG12  VAL  21          HG12      VAL  21  38.703   0.310   1.699
  153   HG13  VAL  21          HG13      VAL  21  39.248   0.922   0.119
  154   HG21  VAL  21          HG21      VAL  21  41.260  -0.838   0.872
  155   HG22  VAL  21          HG22      VAL  21  40.542  -0.909   2.500
  156   HG23  VAL  21          HG23      VAL  21  42.218  -0.357   2.293
  157    H    ASN  22           HN       ASN  22  42.756   3.943   1.429
  158    HA   ASN  22           HA       ASN  22  42.487   6.200   0.717
  159    HB2  ASN  22           HB2      ASN  22  39.577   5.642   0.043
  160    HB3  ASN  22           HB1      ASN  22  40.549   7.070  -0.369
  161   HD21  ASN  22          HD21      ASN  22  39.423   5.983  -2.566
  162   HD22  ASN  22          HD22      ASN  22  40.585   5.011  -3.477
  163    H    HIS  23           HN       HIS  23  40.023   4.359   2.436
  164    HA   HIS  23           HA       HIS  23  40.332   6.009   4.800
  165    HB2  HIS  23           HB2      HIS  23  38.922   7.540   3.439
  166    HB3  HIS  23           HB1      HIS  23  37.698   6.257   3.292
  167    HD1  HIS  23           HD1      HIS  23  39.720   7.173   6.415
  168    HD2  HIS  23           HD2      HIS  23  35.741   7.138   5.057
  169    HE1  HIS  23           HE1      HIS  23  38.235   7.829   8.389
  170    H    TYR  24           HN       TYR  24  40.624   4.127   5.914
  171    HA   TYR  24           HA       TYR  24  38.200   2.712   6.686
  172    HB2  TYR  24           HB2      TYR  24  38.779   1.633   4.467
  173    HB3  TYR  24           HB1      TYR  24  40.305   1.089   5.205
  174    HD1  TYR  24           HD1      TYR  24  36.592   0.814   5.344
  175    HD2  TYR  24           HD2      TYR  24  40.346  -0.706   6.837
  176    HE1  TYR  24           HE1      TYR  24  35.403  -1.124   6.361
  177    HE2  TYR  24           HE2      TYR  24  39.155  -2.644   7.854
  178    HH   TYR  24           HH       TYR  24  36.624  -2.915   8.756
  179    H    LEU  25           HN       LEU  25  41.210   3.916   7.196
  180    HA   LEU  25           HA       LEU  25  42.286   1.906   9.008
  181    HB2  LEU  25           HB2      LEU  25  43.818   3.432   7.943
  182    HB3  LEU  25           HB1      LEU  25  42.910   4.844   8.523
  183    HG   LEU  25           HG       LEU  25  43.570   4.428  10.817
  184   HD11  LEU  25          HD11      LEU  25  45.179   2.441  11.257
  185   HD12  LEU  25          HD12      LEU  25  44.597   1.788   9.706
  186   HD13  LEU  25          HD13      LEU  25  43.456   2.056  11.045
  187   HD21  LEU  25          HD21      LEU  25  46.016   4.623  10.634
  188   HD22  LEU  25          HD22      LEU  25  45.234   5.539   9.323
  189   HD23  LEU  25          HD23      LEU  25  45.965   3.951   8.986
  Start of MODEL   69
    1    H1   GLY   1           HT1      GLY   1  67.525  10.749  -1.413
    2    H2   GLY   1           HT2      GLY   1  68.077  12.257  -0.859
    3    H3   GLY   1           HT3      GLY   1  67.601  12.065  -2.479
    4    HA2  GLY   1           HA1      GLY   1  65.365  11.710  -1.867
    5    HA3  GLY   1           HA2      GLY   1  65.824  11.746  -0.154
    6    H    TRP   2           HN       TRP   2  65.797  13.679  -3.155
    7    HA   TRP   2           HA       TRP   2  66.301  16.183  -1.782
    8    HB2  TRP   2           HB2      TRP   2  66.681  15.701  -4.253
    9    HB3  TRP   2           HB1      TRP   2  64.918  15.795  -4.465
   10    HD1  TRP   2           HD1      TRP   2  67.631  17.987  -2.744
   11    HE1  TRP   2           HE1      TRP   2  67.149  20.486  -3.277
   12    HE3  TRP   2           HE3      TRP   2  63.400  17.411  -5.569
   13    HZ2  TRP   2           HZ2      TRP   2  65.182  21.999  -4.736
   14    HZ3  TRP   2           HZ3      TRP   2  62.237  19.397  -6.521
   15    HH2  TRP   2           HH2      TRP   2  63.123  21.688  -6.106
   16    H    GLY   3           HN       GLY   3  63.816  14.165  -1.346
   17    HA2  GLY   3           HA1      GLY   3  61.744  14.496  -0.357
   18    HA3  GLY   3           HA2      GLY   3  62.100  16.232  -0.277
   19    H    SER   4           HN       SER   4  62.596  15.309  -3.421
   20    HA   SER   4           HA       SER   4  61.392  15.735  -5.357
   21    HB2  SER   4           HB2      SER   4  59.002  14.739  -3.765
   22    HB3  SER   4           HB1      SER   4  59.199  14.733  -5.531
   23    HG   SER   4           HG       SER   4  59.708  12.732  -4.224
   24    H    ILE   5           HN       ILE   5  59.136  16.760  -6.147
   25    HA   ILE   5           HA       ILE   5  59.223  19.488  -5.115
   26    HB   ILE   5           HB       ILE   5  57.110  18.383  -7.010
   27   HG12  ILE   5          HG12      ILE   5  59.992  19.182  -7.627
   28   HG13  ILE   5          HG11      ILE   5  59.279  17.562  -7.816
   29   HG21  ILE   5          HG21      ILE   5  57.002  20.623  -7.821
   30   HG22  ILE   5          HG22      ILE   5  58.543  21.069  -7.047
   31   HG23  ILE   5          HG23      ILE   5  57.094  20.792  -6.053
   32   HD11  ILE   5           HD1      ILE   5  58.679  20.084  -9.402
   33   HD12  ILE   5           HD2      ILE   5  57.562  18.697  -9.394
   34   HD13  ILE   5           HD3      ILE   5  59.223  18.500 -10.003
   35    H    PHE   6           HN       PHE   6  56.746  16.888  -5.198
   36    HA   PHE   6           HA       PHE   6  55.664  17.830  -2.621
   37    HB2  PHE   6           HB2      PHE   6  54.083  18.066  -5.212
   38    HB3  PHE   6           HB1      PHE   6  53.310  17.994  -3.613
   39    HD1  PHE   6           HD1      PHE   6  54.378  19.638  -1.788
   40    HD2  PHE   6           HD2      PHE   6  54.624  20.209  -6.062
   41    HE1  PHE   6           HE1      PHE   6  54.796  22.068  -1.442
   42    HE2  PHE   6           HE2      PHE   6  55.042  22.638  -5.712
   43    HZ   PHE   6           HZ       PHE   6  55.101  23.573  -3.403
   44    H    LYS   7           HN       LYS   7  56.421  15.489  -4.875
   45    HA   LYS   7           HA       LYS   7  54.412  13.542  -4.691
   46    HB2  LYS   7           HB2      LYS   7  56.517  13.371  -6.041
   47    HB3  LYS   7           HB1      LYS   7  57.408  13.026  -4.539
   48    HG2  LYS   7           HG2      LYS   7  56.125  11.006  -4.157
   49    HG3  LYS   7           HG1      LYS   7  55.018  11.395  -5.496
   50    HD2  LYS   7           HD2      LYS   7  56.960  11.275  -7.080
   51    HD3  LYS   7           HD1      LYS   7  57.991  10.756  -5.725
   52    HE2  LYS   7           HE2      LYS   7  57.208   8.785  -6.958
   53    HE3  LYS   7           HE1      LYS   7  56.458   8.814  -5.344
   54    HZ1  LYS   7           HZ1      LYS   7  54.426   9.338  -6.200
   55    HZ2  LYS   7           HZ2      LYS   7  55.039   8.445  -7.509
   56    HZ3  LYS   7           HZ3      LYS   7  55.055  10.144  -7.554
   57    H    HIS   8           HN       HIS   8  57.393  13.310  -2.717
   58    HA   HIS   8           HA       HIS   8  55.931  11.795  -0.663
   59    HB2  HIS   8           HB2      HIS   8  58.301  11.302  -1.333
   60    HB3  HIS   8           HB1      HIS   8  58.781  12.862  -0.624
   61    HD1  HIS   8           HD1      HIS   8  56.126  10.595   0.890
   62    HD2  HIS   8           HD2      HIS   8  60.099  11.771   1.622
   63    HE1  HIS   8           HE1      HIS   8  56.764   9.724   3.206
   64    H    GLY   9           HN       GLY   9  54.437  13.816  -0.490
   65    HA2  GLY   9           HA1      GLY   9  55.179  15.136   2.015
   66    HA3  GLY   9           HA2      GLY   9  55.121  16.239   0.626
   67    H    ARG  10           HN       ARG  10  52.969  14.261  -0.483
   68    HA   ARG  10           HA       ARG  10  50.715  14.702   1.341
   69    HB2  ARG  10           HB2      ARG  10  49.440  16.095  -0.345
   70    HB3  ARG  10           HB1      ARG  10  50.786  16.940   0.457
   71    HG2  ARG  10           HG2      ARG  10  52.222  16.642  -1.466
   72    HG3  ARG  10           HG1      ARG  10  51.046  15.555  -2.244
   73    HD2  ARG  10           HD2      ARG  10  50.535  18.487  -1.571
   74    HD3  ARG  10           HD1      ARG  10  50.963  17.869  -3.185
   75    HE   ARG  10           HE       ARG  10  48.645  16.494  -2.112
   76   HH11  ARG  10          HH11      ARG  10  49.034  19.776  -2.412
   77   HH12  ARG  10          HH12      ARG  10  47.845  20.002  -3.650
   78   HH21  ARG  10          HH21      ARG  10  47.413  16.608  -4.223
   79   HH22  ARG  10          HH22      ARG  10  46.927  18.208  -4.675
   80    H    HIS  11           HN       HIS  11  52.196  12.621  -0.323
   81    HA   HIS  11           HA       HIS  11  49.734  11.299  -1.312
   82    HB2  HIS  11           HB2      HIS  11  52.155  11.760  -3.105
   83    HB3  HIS  11           HB1      HIS  11  50.771  10.710  -3.488
   84    HD1  HIS  11           HD1      HIS  11  48.373  12.363  -2.705
   85    HD2  HIS  11           HD2      HIS  11  51.700  13.973  -4.709
   86    HE1  HIS  11           HE1      HIS  11  47.609  14.523  -3.836
   87    H    ALA  12           HN       ALA  12  49.735   9.237  -1.357
   88    HA   ALA  12           HA       ALA  12  50.279   7.077  -0.829
   89    HB1  ALA  12           HB1      ALA  12  52.973   8.081  -0.357
   90    HB2  ALA  12           HB2      ALA  12  52.420   7.728  -1.996
   91    HB3  ALA  12           HB3      ALA  12  52.533   6.438  -0.773
   92    H    ALA  13           HN       ALA  13  51.625   9.808   0.923
   93    HA   ALA  13           HA       ALA  13  51.677   8.391   3.493
   94    HB1  ALA  13           HB1      ALA  13  50.962  10.897   4.174
   95    HB2  ALA  13           HB2      ALA  13  51.554  11.283   2.540
   96    HB3  ALA  13           HB3      ALA  13  52.653  10.558   3.738
   97    H    LYS  14           HN       LYS  14  50.202   8.703   0.689
   98    HA   LYS  14           HA       LYS  14  47.289   8.586   1.808
   99    HB2  LYS  14           HB2      LYS  14  48.226  10.361   0.075
  100    HB3  LYS  14           HB1      LYS  14  48.249   8.954  -1.046
  101    HG2  LYS  14           HG2      LYS  14  45.629   8.949   0.197
  102    HG3  LYS  14           HG1      LYS  14  45.962  10.658  -0.124
  103    HD2  LYS  14           HD2      LYS  14  46.281   8.484  -2.233
  104    HD3  LYS  14           HD1      LYS  14  44.791   9.425  -2.004
  105    HE2  LYS  14           HE2      LYS  14  46.009  11.518  -2.412
  106    HE3  LYS  14           HE1      LYS  14  47.539  10.625  -2.563
  107    HZ1  LYS  14           HZ1      LYS  14  46.022   9.322  -4.321
  108    HZ2  LYS  14           HZ2      LYS  14  46.989  10.658  -4.731
  109    HZ3  LYS  14           HZ3      LYS  14  45.328  10.865  -4.440
  110    H    HIS  15           HN       HIS  15  46.215   7.558  -0.554
  111    HA   HIS  15           HA       HIS  15  45.550   5.376  -1.140
  112    HB2  HIS  15           HB2      HIS  15  46.988   6.358  -2.956
  113    HB3  HIS  15           HB1      HIS  15  48.367   5.464  -2.276
  114    HD1  HIS  15           HD1      HIS  15  48.745   3.246  -3.339
  115    HD2  HIS  15           HD2      HIS  15  44.702   4.397  -3.499
  116    HE1  HIS  15           HE1      HIS  15  47.472   1.392  -4.551
  117    H    ILE  16           HN       ILE  16  47.102   5.510   1.466
  118    HA   ILE  16           HA       ILE  16  47.079   2.926   2.176
  119    HB   ILE  16           HB       ILE  16  48.797   2.183   0.712
  120   HG12  ILE  16          HG12      ILE  16  50.267   2.759   3.315
  121   HG13  ILE  16          HG11      ILE  16  48.995   1.526   3.182
  122   HG21  ILE  16          HG21      ILE  16  50.350   4.636   1.644
  123   HG22  ILE  16          HG22      ILE  16  49.744   4.362  -0.004
  124   HG23  ILE  16          HG23      ILE  16  51.050   3.355   0.651
  125   HD11  ILE  16           HD1      ILE  16  51.763   1.557   1.947
  126   HD12  ILE  16           HD2      ILE  16  50.465   0.648   1.138
  127   HD13  ILE  16           HD3      ILE  16  50.929   0.245   2.805
  128    H    GLY  17           HN       GLY  17  48.979   5.634   2.364
  129    HA2  GLY  17           HA1      GLY  17  49.304   5.487   5.261
  130    HA3  GLY  17           HA2      GLY  17  49.665   6.892   4.232
  131    H    HIS  18           HN       HIS  18  46.912   6.147   2.931
  132    HA   HIS  18           HA       HIS  18  45.305   7.852   4.838
  133    HB2  HIS  18           HB2      HIS  18  45.290   7.324   1.883
  134    HB3  HIS  18           HB1      HIS  18  43.694   7.538   2.630
  135    HD1  HIS  18           HD1      HIS  18  46.629   9.368   4.115
  136    HD2  HIS  18           HD2      HIS  18  43.431  10.153   1.499
  137    HE1  HIS  18           HE1      HIS  18  46.526  11.898   3.775
  138    H    ALA  19           HN       ALA  19  45.148   4.727   3.004
  139    HA   ALA  19           HA       ALA  19  43.979   3.234   5.074
  140    HB1  ALA  19           HB1      ALA  19  41.990   4.455   5.280
  141    HB2  ALA  19           HB2      ALA  19  41.505   3.238   4.083
  142    HB3  ALA  19           HB3      ALA  19  41.952   4.876   3.552
  143    H    ALA  20           HN       ALA  20  45.336   3.510   2.212
  144    HA   ALA  20           HA       ALA  20  45.708   2.052   0.443
  145    HB1  ALA  20           HB1      ALA  20  45.958   0.462   2.438
  146    HB2  ALA  20           HB2      ALA  20  45.587  -0.284   0.865
  147    HB3  ALA  20           HB3      ALA  20  44.303  -0.080   2.079
  148    H    VAL  21           HN       VAL  21  42.914   3.277   1.285
  149    HA   VAL  21           HA       VAL  21  41.523   2.329  -1.163
  150    HB   VAL  21           HB       VAL  21  40.177   2.341   1.582
  151   HG11  VAL  21          HG11      VAL  21  38.346   1.160   0.161
  152   HG12  VAL  21          HG12      VAL  21  39.224   1.780  -1.256
  153   HG13  VAL  21          HG13      VAL  21  38.543   2.911  -0.062
  154   HG21  VAL  21          HG21      VAL  21  39.992  -0.161   1.151
  155   HG22  VAL  21          HG22      VAL  21  41.647   0.411   1.446
  156   HG23  VAL  21          HG23      VAL  21  41.113   0.056  -0.214
  157    H    ASN  22           HN       ASN  22  42.530   4.601   1.083
  158    HA   ASN  22           HA       ASN  22  42.497   6.949   0.678
  159    HB2  ASN  22           HB2      ASN  22  41.090   6.560  -1.462
  160    HB3  ASN  22           HB1      ASN  22  39.666   6.768  -0.410
  161   HD21  ASN  22          HD21      ASN  22  39.978   8.659  -2.414
  162   HD22  ASN  22          HD22      ASN  22  40.537  10.184  -1.718
  163    H    HIS  23           HN       HIS  23  39.714   5.077   1.774
  164    HA   HIS  23           HA       HIS  23  39.732   6.509   4.341
  165    HB2  HIS  23           HB2      HIS  23  37.389   6.776   2.421
  166    HB3  HIS  23           HB1      HIS  23  37.295   7.132   4.162
  167    HD1  HIS  23           HD1      HIS  23  38.784   8.371   0.911
  168    HD2  HIS  23           HD2      HIS  23  38.759   9.464   4.971
  169    HE1  HIS  23           HE1      HIS  23  39.694  10.754   1.064
  170    H    TYR  24           HN       TYR  24  39.497   4.986   5.813
  171    HA   TYR  24           HA       TYR  24  38.703   2.322   5.246
  172    HB2  TYR  24           HB2      TYR  24  38.643   3.927   7.833
  173    HB3  TYR  24           HB1      TYR  24  38.305   2.182   7.756
  174    HD1  TYR  24           HD1      TYR  24  40.089   0.698   6.532
  175    HD2  TYR  24           HD2      TYR  24  40.892   4.659   8.051
  176    HE1  TYR  24           HE1      TYR  24  42.528   0.199   6.549
  177    HE2  TYR  24           HE2      TYR  24  43.331   4.157   8.069
  178    HH   TYR  24           HH       TYR  24  44.492   0.984   7.896
  179    H    LEU  25           HN       LEU  25  36.874   5.160   5.297
  180    HA   LEU  25           HA       LEU  25  34.408   4.238   6.420
  181    HB2  LEU  25           HB2      LEU  25  35.217   6.629   5.613
  182    HB3  LEU  25           HB1      LEU  25  34.482   6.153   4.068
  183    HG   LEU  25           HG       LEU  25  33.080   6.191   6.782
  184   HD11  LEU  25          HD11      LEU  25  31.795   8.065   5.786
  185   HD12  LEU  25          HD12      LEU  25  32.793   7.963   4.315
  186   HD13  LEU  25          HD13      LEU  25  33.533   8.442   5.862
  187   HD21  LEU  25          HD21      LEU  25  32.037   4.457   5.524
  188   HD22  LEU  25          HD22      LEU  25  32.209   5.344   3.990
  189   HD23  LEU  25          HD23      LEU  25  31.026   5.884   5.206
  Start of MODEL   70
    1    H1   GLY   1           HT1      GLY   1  64.248  15.282 -11.468
    2    H2   GLY   1           HT2      GLY   1  65.213  16.528 -12.102
    3    H3   GLY   1           HT3      GLY   1  63.539  16.754 -11.920
    4    HA2  GLY   1           HA1      GLY   1  65.252  17.701 -10.228
    5    HA3  GLY   1           HA2      GLY   1  63.643  17.125  -9.746
    6    H    TRP   2           HN       TRP   2  64.436  16.712  -7.634
    7    HA   TRP   2           HA       TRP   2  66.652  14.920  -7.168
    8    HB2  TRP   2           HB2      TRP   2  65.729  16.553  -5.498
    9    HB3  TRP   2           HB1      TRP   2  64.291  15.515  -5.342
   10    HD1  TRP   2           HD1      TRP   2  68.144  15.207  -5.020
   11    HE1  TRP   2           HE1      TRP   2  68.697  13.483  -3.153
   12    HE3  TRP   2           HE3      TRP   2  63.383  13.748  -3.831
   13    HZ2  TRP   2           HZ2      TRP   2  67.242  11.723  -1.398
   14    HZ3  TRP   2           HZ3      TRP   2  62.988  12.046  -2.057
   15    HH2  TRP   2           HH2      TRP   2  64.913  11.032  -0.841
   16    H    GLY   3           HN       GLY   3  63.126  14.405  -6.635
   17    HA2  GLY   3           HA1      GLY   3  62.838  12.027  -8.056
   18    HA3  GLY   3           HA2      GLY   3  63.479  11.529  -6.477
   19    H    SER   4           HN       SER   4  61.958  14.218  -5.633
   20    HA   SER   4           HA       SER   4  59.161  13.359  -5.798
   21    HB2  SER   4           HB2      SER   4  60.683  13.104  -3.178
   22    HB3  SER   4           HB1      SER   4  58.910  13.131  -3.303
   23    HG   SER   4           HG       SER   4  59.433  11.016  -3.422
   24    H    ILE   5           HN       ILE   5  58.787  15.421  -6.589
   25    HA   ILE   5           HA       ILE   5  59.766  17.815  -5.398
   26    HB   ILE   5           HB       ILE   5  58.650  17.576  -7.682
   27   HG12  ILE   5          HG12      ILE   5  57.256  19.825  -7.311
   28   HG13  ILE   5          HG11      ILE   5  57.949  19.757  -5.677
   29   HG21  ILE   5          HG21      ILE   5  56.265  17.552  -7.859
   30   HG22  ILE   5          HG22      ILE   5  56.056  17.835  -6.115
   31   HG23  ILE   5          HG23      ILE   5  56.680  16.272  -6.695
   32   HD11  ILE   5           HD1      ILE   5  60.219  19.771  -6.586
   33   HD12  ILE   5           HD2      ILE   5  59.308  21.119  -7.297
   34   HD13  ILE   5           HD3      ILE   5  59.595  19.644  -8.247
   35    H    PHE   6           HN       PHE   6  56.765  15.956  -4.845
   36    HA   PHE   6           HA       PHE   6  56.616  16.954  -2.099
   37    HB2  PHE   6           HB2      PHE   6  54.589  17.872  -4.177
   38    HB3  PHE   6           HB1      PHE   6  54.242  17.857  -2.432
   39    HD1  PHE   6           HD1      PHE   6  56.195  18.950  -0.922
   40    HD2  PHE   6           HD2      PHE   6  55.455  19.880  -5.076
   41    HE1  PHE   6           HE1      PHE   6  57.364  21.132  -0.646
   42    HE2  PHE   6           HE2      PHE   6  56.624  22.060  -4.794
   43    HZ   PHE   6           HZ       PHE   6  57.565  22.691  -2.576
   44    H    LYS   7           HN       LYS   7  56.737  14.451  -3.776
   45    HA   LYS   7           HA       LYS   7  54.138  13.169  -3.498
   46    HB2  LYS   7           HB2      LYS   7  56.814  11.751  -3.729
   47    HB3  LYS   7           HB1      LYS   7  55.216  11.206  -4.294
   48    HG2  LYS   7           HG2      LYS   7  56.824  13.556  -5.393
   49    HG3  LYS   7           HG1      LYS   7  56.537  11.997  -6.202
   50    HD2  LYS   7           HD2      LYS   7  54.008  12.540  -5.956
   51    HD3  LYS   7           HD1      LYS   7  54.533  14.199  -5.577
   52    HE2  LYS   7           HE2      LYS   7  55.792  14.271  -7.729
   53    HE3  LYS   7           HE1      LYS   7  55.188  12.642  -8.116
   54    HZ1  LYS   7           HZ1      LYS   7  53.449  14.991  -7.551
   55    HZ2  LYS   7           HZ2      LYS   7  52.950  13.455  -8.078
   56    HZ3  LYS   7           HZ3      LYS   7  53.858  14.457  -9.107
   57    H    HIS   8           HN       HIS   8  57.190  13.151  -1.631
   58    HA   HIS   8           HA       HIS   8  56.111  11.273   0.348
   59    HB2  HIS   8           HB2      HIS   8  58.210  11.715   1.551
   60    HB3  HIS   8           HB1      HIS   8  58.531  11.389  -0.168
   61    HD1  HIS   8           HD1      HIS   8  60.748  12.887   1.046
   62    HD2  HIS   8           HD2      HIS   8  57.318  14.849  -0.393
   63    HE1  HIS   8           HE1      HIS   8  61.378  15.331   0.653
   64    H    GLY   9           HN       GLY   9  54.213  13.152   0.187
   65    HA2  GLY   9           HA1      GLY   9  53.962  14.075   2.858
   66    HA3  GLY   9           HA2      GLY   9  54.543  15.433   1.873
   67    H    ARG  10           HN       ARG  10  52.949  13.655  -0.306
   68    HA   ARG  10           HA       ARG  10  50.191  14.545   0.411
   69    HB2  ARG  10           HB2      ARG  10  51.521  15.342  -2.211
   70    HB3  ARG  10           HB1      ARG  10  49.884  15.766  -1.658
   71    HG2  ARG  10           HG2      ARG  10  50.941  16.945   0.318
   72    HG3  ARG  10           HG1      ARG  10  52.528  16.663  -0.437
   73    HD2  ARG  10           HD2      ARG  10  51.748  18.896  -1.049
   74    HD3  ARG  10           HD1      ARG  10  51.716  17.854  -2.491
   75    HE   ARG  10           HE       ARG  10  49.157  17.783  -1.165
   76   HH11  ARG  10          HH11      ARG  10  47.520  19.215  -1.837
   77   HH12  ARG  10          HH12      ARG  10  47.858  20.340  -3.110
   78   HH21  ARG  10          HH21      ARG  10  51.206  19.473  -3.349
   79   HH22  ARG  10          HH22      ARG  10  49.943  20.486  -3.966
   80    H    HIS  11           HN       HIS  11  52.092  12.114  -0.335
   81    HA   HIS  11           HA       HIS  11  49.922  10.614  -1.611
   82    HB2  HIS  11           HB2      HIS  11  51.036  11.612  -3.603
   83    HB3  HIS  11           HB1      HIS  11  52.582  10.914  -3.066
   84    HD1  HIS  11           HD1      HIS  11  52.796   8.275  -3.068
   85    HD2  HIS  11           HD2      HIS  11  49.247   9.758  -4.769
   86    HE1  HIS  11           HE1      HIS  11  51.733   6.368  -4.393
   87    H    ALA  12           HN       ALA  12  49.987   8.567  -1.420
   88    HA   ALA  12           HA       ALA  12  50.485   6.506  -0.570
   89    HB1  ALA  12           HB1      ALA  12  52.792   7.124  -1.412
   90    HB2  ALA  12           HB2      ALA  12  52.704   5.965  -0.061
   91    HB3  ALA  12           HB3      ALA  12  53.027   7.674   0.238
   92    H    ALA  13           HN       ALA  13  51.517   9.450   1.069
   93    HA   ALA  13           HA       ALA  13  51.148   8.332   3.751
   94    HB1  ALA  13           HB1      ALA  13  52.189  10.625   3.421
   95    HB2  ALA  13           HB2      ALA  13  50.672  10.718   4.350
   96    HB3  ALA  13           HB3      ALA  13  50.690  11.160   2.624
   97    H    LYS  14           HN       LYS  14  50.114   8.291   0.740
   98    HA   LYS  14           HA       LYS  14  47.065   8.271   1.429
   99    HB2  LYS  14           HB2      LYS  14  48.179   9.845  -0.346
  100    HB3  LYS  14           HB1      LYS  14  48.507   8.318  -1.248
  101    HG2  LYS  14           HG2      LYS  14  46.293   8.156  -1.945
  102    HG3  LYS  14           HG1      LYS  14  45.639   8.625  -0.362
  103    HD2  LYS  14           HD2      LYS  14  44.967  10.328  -1.902
  104    HD3  LYS  14           HD1      LYS  14  46.286  11.039  -0.948
  105    HE2  LYS  14           HE2      LYS  14  47.885  10.407  -2.776
  106    HE3  LYS  14           HE1      LYS  14  46.510   9.816  -3.733
  107    HZ1  LYS  14           HZ1      LYS  14  45.540  12.110  -3.409
  108    HZ2  LYS  14           HZ2      LYS  14  46.893  12.011  -4.432
  109    HZ3  LYS  14           HZ3      LYS  14  47.065  12.594  -2.846
  110    H    HIS  15           HN       HIS  15  46.145   6.928  -0.686
  111    HA   HIS  15           HA       HIS  15  45.570   4.696  -1.121
  112    HB2  HIS  15           HB2      HIS  15  48.434   4.996  -2.091
  113    HB3  HIS  15           HB1      HIS  15  47.379   3.633  -2.535
  114    HD1  HIS  15           HD1      HIS  15  48.253   7.071  -3.483
  115    HD2  HIS  15           HD2      HIS  15  44.964   4.504  -3.992
  116    HE1  HIS  15           HE1      HIS  15  46.779   8.073  -5.315
  117    H    ILE  16           HN       ILE  16  46.988   5.184   1.558
  118    HA   ILE  16           HA       ILE  16  46.893   2.703   2.554
  119    HB   ILE  16           HB       ILE  16  48.698   1.769   1.322
  120   HG12  ILE  16          HG12      ILE  16  50.302   2.654   3.739
  121   HG13  ILE  16          HG11      ILE  16  48.830   1.703   4.007
  122   HG21  ILE  16          HG21      ILE  16  49.675   3.793   0.318
  123   HG22  ILE  16          HG22      ILE  16  50.959   2.981   1.231
  124   HG23  ILE  16          HG23      ILE  16  50.147   4.385   1.921
  125   HD11  ILE  16           HD1      ILE  16  51.192   0.885   2.256
  126   HD12  ILE  16           HD2      ILE  16  49.694  -0.053   2.458
  127   HD13  ILE  16           HD3      ILE  16  50.774   0.212   3.847
  128    H    GLY  17           HN       GLY  17  48.752   5.445   2.521
  129    HA2  GLY  17           HA1      GLY  17  48.886   5.625   5.448
  130    HA3  GLY  17           HA2      GLY  17  49.343   6.894   4.293
  131    H    HIS  18           HN       HIS  18  46.695   5.996   2.860
  132    HA   HIS  18           HA       HIS  18  44.980   7.966   4.353
  133    HB2  HIS  18           HB2      HIS  18  45.156   6.928   1.556
  134    HB3  HIS  18           HB1      HIS  18  43.495   7.132   2.145
  135    HD1  HIS  18           HD1      HIS  18  46.268   9.405   3.367
  136    HD2  HIS  18           HD2      HIS  18  43.030   9.508   0.686
  137    HE1  HIS  18           HE1      HIS  18  45.975  11.830   2.620
  138    H    ALA  19           HN       ALA  19  44.977   4.515   3.233
  139    HA   ALA  19           HA       ALA  19  43.354   3.774   5.545
  140    HB1  ALA  19           HB1      ALA  19  41.266   3.291   4.504
  141    HB2  ALA  19           HB2      ALA  19  41.919   3.630   2.881
  142    HB3  ALA  19           HB3      ALA  19  41.676   4.959   4.042
  143    H    ALA  20           HN       ALA  20  45.770   2.781   4.420
  144    HA   ALA  20           HA       ALA  20  46.710   0.720   3.941
  145    HB1  ALA  20           HB1      ALA  20  45.597  -1.240   4.583
  146    HB2  ALA  20           HB2      ALA  20  44.000  -0.611   4.119
  147    HB3  ALA  20           HB3      ALA  20  44.810   0.006   5.577
  148    H    VAL  21           HN       VAL  21  44.070   2.020   2.121
  149    HA   VAL  21           HA       VAL  21  45.168   0.737  -0.328
  150    HB   VAL  21           HB       VAL  21  42.182   0.636   0.284
  151   HG11  VAL  21          HG11      VAL  21  43.934  -0.518  -1.931
  152   HG12  VAL  21          HG12      VAL  21  42.738   0.790  -2.098
  153   HG13  VAL  21          HG13      VAL  21  42.202  -0.866  -1.724
  154   HG21  VAL  21          HG21      VAL  21  44.333  -1.521   0.453
  155   HG22  VAL  21          HG22      VAL  21  42.589  -1.866   0.403
  156   HG23  VAL  21          HG23      VAL  21  43.275  -0.951   1.766
  157    H    ASN  22           HN       ASN  22  42.996   3.032   1.269
  158    HA   ASN  22           HA       ASN  22  43.634   5.367   0.064
  159    HB2  ASN  22           HB2      ASN  22  43.408   4.771  -2.211
  160    HB3  ASN  22           HB1      ASN  22  41.986   3.749  -1.905
  161   HD21  ASN  22          HD21      ASN  22  40.319   4.728  -3.090
  162   HD22  ASN  22          HD22      ASN  22  39.918   6.446  -2.987
  163    H    HIS  23           HN       HIS  23  40.766   3.267   0.489
  164    HA   HIS  23           HA       HIS  23  39.717   5.092   2.525
  165    HB2  HIS  23           HB2      HIS  23  39.026   6.217   0.388
  166    HB3  HIS  23           HB1      HIS  23  38.120   4.747  -0.041
  167    HD1  HIS  23           HD1      HIS  23  35.745   4.690   0.712
  168    HD2  HIS  23           HD2      HIS  23  38.078   7.308   3.032
  169    HE1  HIS  23           HE1      HIS  23  34.187   5.803   2.405
  170    H    TYR  24           HN       TYR  24  40.521   2.263   2.168
  171    HA   TYR  24           HA       TYR  24  38.046   0.701   2.161
  172    HB2  TYR  24           HB2      TYR  24  40.265  -0.202   1.435
  173    HB3  TYR  24           HB1      TYR  24  40.826  -0.083   3.121
  174    HD1  TYR  24           HD1      TYR  24  38.430  -1.767   0.822
  175    HD2  TYR  24           HD2      TYR  24  40.042  -1.629   4.824
  176    HE1  TYR  24           HE1      TYR  24  37.357  -3.957   1.331
  177    HE2  TYR  24           HE2      TYR  24  38.970  -3.821   5.331
  178    HH   TYR  24           HH       TYR  24  37.082  -5.576   2.864
  179    H    LEU  25           HN       LEU  25  39.480   2.773   4.387
  180    HA   LEU  25           HA       LEU  25  39.172   3.100   6.661
  181    HB2  LEU  25           HB2      LEU  25  36.743   1.289   6.460
  182    HB3  LEU  25           HB1      LEU  25  37.000   2.689   7.529
  183    HG   LEU  25           HG       LEU  25  36.681   2.756   4.496
  184   HD11  LEU  25          HD11      LEU  25  34.940   3.782   6.782
  185   HD12  LEU  25          HD12      LEU  25  34.578   2.389   5.734
  186   HD13  LEU  25          HD13      LEU  25  34.617   4.032   5.051
  187   HD21  LEU  25          HD21      LEU  25  36.627   5.303   4.976
  188   HD22  LEU  25          HD22      LEU  25  38.217   4.509   5.033
  189   HD23  LEU  25          HD23      LEU  25  37.365   4.904   6.546
  Start of MODEL   71
    1    H1   GLY   1           HT1      GLY   1  64.790  20.807  -1.331
    2    H2   GLY   1           HT2      GLY   1  65.152  20.972   0.320
    3    H3   GLY   1           HT3      GLY   1  64.061  22.040  -0.425
    4    HA2  GLY   1           HA1      GLY   1  63.435  19.818   0.958
    5    HA3  GLY   1           HA2      GLY   1  62.371  20.716  -0.144
    6    H    TRP   2           HN       TRP   2  65.280  19.016  -1.191
    7    HA   TRP   2           HA       TRP   2  65.532  17.242  -2.661
    8    HB2  TRP   2           HB2      TRP   2  62.922  16.166  -1.542
    9    HB3  TRP   2           HB1      TRP   2  64.289  15.251  -2.220
   10    HD1  TRP   2           HD1      TRP   2  62.917  16.435   0.984
   11    HE1  TRP   2           HE1      TRP   2  64.632  16.175   2.920
   12    HE3  TRP   2           HE3      TRP   2  67.124  15.525  -1.785
   13    HZ2  TRP   2           HZ2      TRP   2  67.448  15.644   3.195
   14    HZ3  TRP   2           HZ3      TRP   2  69.315  15.144  -0.664
   15    HH2  TRP   2           HH2      TRP   2  69.480  15.202   1.821
   16    H    GLY   3           HN       GLY   3  64.412  15.952  -4.465
   17    HA2  GLY   3           HA1      GLY   3  63.131  17.883  -6.198
   18    HA3  GLY   3           HA2      GLY   3  63.424  16.169  -6.553
   19    H    SER   4           HN       SER   4  61.899  16.087  -3.673
   20    HA   SER   4           HA       SER   4  59.415  15.174  -4.838
   21    HB2  SER   4           HB2      SER   4  58.682  14.905  -2.517
   22    HB3  SER   4           HB1      SER   4  60.346  14.307  -2.703
   23    HG   SER   4           HG       SER   4  60.917  15.749  -1.293
   24    H    ILE   5           HN       ILE   5  58.636  16.919  -6.094
   25    HA   ILE   5           HA       ILE   5  58.172  19.540  -5.018
   26    HB   ILE   5           HB       ILE   5  56.516  18.215  -7.207
   27   HG12  ILE   5          HG12      ILE   5  59.287  19.490  -7.361
   28   HG13  ILE   5          HG11      ILE   5  58.887  17.788  -7.685
   29   HG21  ILE   5          HG21      ILE   5  57.476  21.094  -6.945
   30   HG22  ILE   5          HG22      ILE   5  55.937  20.536  -6.249
   31   HG23  ILE   5          HG23      ILE   5  56.198  20.453  -8.005
   32   HD11  ILE   5           HD1      ILE   5  57.251  18.723  -9.487
   33   HD12  ILE   5           HD2      ILE   5  58.995  18.772  -9.842
   34   HD13  ILE   5           HD3      ILE   5  58.156  20.247  -9.309
   35    H    PHE   6           HN       PHE   6  56.350  16.520  -4.932
   36    HA   PHE   6           HA       PHE   6  54.687  17.512  -2.772
   37    HB2  PHE   6           HB2      PHE   6  52.502  17.233  -4.008
   38    HB3  PHE   6           HB1      PHE   6  53.452  18.655  -4.502
   39    HD1  PHE   6           HD1      PHE   6  54.243  18.885  -6.753
   40    HD2  PHE   6           HD2      PHE   6  52.641  15.109  -5.406
   41    HE1  PHE   6           HE1      PHE   6  54.278  18.034  -9.095
   42    HE2  PHE   6           HE2      PHE   6  52.676  14.260  -7.748
   43    HZ   PHE   6           HZ       PHE   6  53.553  15.701  -9.582
   44    H    LYS   7           HN       LYS   7  56.186  15.164  -4.539
   45    HA   LYS   7           HA       LYS   7  54.521  12.905  -4.481
   46    HB2  LYS   7           HB2      LYS   7  57.500  13.131  -3.900
   47    HB3  LYS   7           HB1      LYS   7  56.648  11.596  -4.190
   48    HG2  LYS   7           HG2      LYS   7  56.007  12.290  -6.423
   49    HG3  LYS   7           HG1      LYS   7  56.616  13.938  -6.137
   50    HD2  LYS   7           HD2      LYS   7  58.907  13.113  -5.949
   51    HD3  LYS   7           HD1      LYS   7  58.346  11.429  -6.072
   52    HE2  LYS   7           HE2      LYS   7  59.214  12.235  -8.248
   53    HE3  LYS   7           HE1      LYS   7  57.472  11.884  -8.346
   54    HZ1  LYS   7           HZ1      LYS   7  58.535  14.596  -7.763
   55    HZ2  LYS   7           HZ2      LYS   7  56.956  14.164  -8.217
   56    HZ3  LYS   7           HZ3      LYS   7  58.225  14.055  -9.340
   57    H    HIS   8           HN       HIS   8  57.146  12.981  -2.107
   58    HA   HIS   8           HA       HIS   8  55.451  11.626  -0.147
   59    HB2  HIS   8           HB2      HIS   8  57.904  11.190  -0.429
   60    HB3  HIS   8           HB1      HIS   8  58.228  12.824   0.198
   61    HD1  HIS   8           HD1      HIS   8  55.281  11.541   1.870
   62    HD2  HIS   8           HD2      HIS   8  59.419  10.949   2.325
   63    HE1  HIS   8           HE1      HIS   8  55.667  10.630   4.226
   64    H    GLY   9           HN       GLY   9  53.888  13.599  -0.377
   65    HA2  GLY   9           HA1      GLY   9  54.046  15.027   2.125
   66    HA3  GLY   9           HA2      GLY   9  54.446  16.099   0.770
   67    H    ARG  10           HN       ARG  10  52.596  14.273  -0.919
   68    HA   ARG  10           HA       ARG  10  49.935  15.036   0.181
   69    HB2  ARG  10           HB2      ARG  10  51.052  16.094  -2.448
   70    HB3  ARG  10           HB1      ARG  10  49.328  16.131  -2.009
   71    HG2  ARG  10           HG2      ARG  10  49.984  17.396   0.094
   72    HG3  ARG  10           HG1      ARG  10  51.631  17.514  -0.571
   73    HD2  ARG  10           HD2      ARG  10  50.699  18.621  -2.607
   74    HD3  ARG  10           HD1      ARG  10  49.080  18.568  -1.869
   75    HE   ARG  10           HE       ARG  10  50.966  19.854  -0.095
   76   HH11  ARG  10          HH11      ARG  10  48.198  20.331  -1.845
   77   HH12  ARG  10          HH12      ARG  10  48.469  22.005  -2.197
   78   HH21  ARG  10          HH21      ARG  10  51.735  21.992  -1.032
   79   HH22  ARG  10          HH22      ARG  10  50.471  22.947  -1.736
   80    H    HIS  11           HN       HIS  11  51.793  12.698  -0.856
   81    HA   HIS  11           HA       HIS  11  49.540  11.140  -1.882
   82    HB2  HIS  11           HB2      HIS  11  50.346  12.279  -3.965
   83    HB3  HIS  11           HB1      HIS  11  51.950  11.556  -3.694
   84    HD1  HIS  11           HD1      HIS  11  52.052   8.863  -3.667
   85    HD2  HIS  11           HD2      HIS  11  48.463  10.530  -5.087
   86    HE1  HIS  11           HE1      HIS  11  50.816   7.031  -4.947
   87    H    ALA  12           HN       ALA  12  49.730   9.088  -1.803
   88    HA   ALA  12           HA       ALA  12  50.439   7.024  -1.128
   89    HB1  ALA  12           HB1      ALA  12  53.008   8.292  -0.619
   90    HB2  ALA  12           HB2      ALA  12  52.565   7.802  -2.258
   91    HB3  ALA  12           HB3      ALA  12  52.742   6.593  -0.960
   92    H    ALA  13           HN       ALA  13  51.590   9.938   0.497
   93    HA   ALA  13           HA       ALA  13  51.651   8.687   3.144
   94    HB1  ALA  13           HB1      ALA  13  50.977  11.541   2.208
   95    HB2  ALA  13           HB2      ALA  13  52.559  11.018   2.834
   96    HB3  ALA  13           HB3      ALA  13  51.139  11.039   3.907
   97    H    LYS  14           HN       LYS  14  50.183   8.752   0.321
   98    HA   LYS  14           HA       LYS  14  47.267   8.577   1.441
   99    HB2  LYS  14           HB2      LYS  14  48.073  10.251  -0.403
  100    HB3  LYS  14           HB1      LYS  14  48.312   8.772  -1.405
  101    HG2  LYS  14           HG2      LYS  14  46.024   8.533  -1.761
  102    HG3  LYS  14           HG1      LYS  14  45.592   9.022  -0.107
  103    HD2  LYS  14           HD2      LYS  14  45.779  11.359  -0.657
  104    HD3  LYS  14           HD1      LYS  14  46.556  10.999  -2.216
  105    HE2  LYS  14           HE2      LYS  14  44.157  11.587  -2.505
  106    HE3  LYS  14           HE1      LYS  14  44.486   9.915  -3.016
  107    HZ1  LYS  14           HZ1      LYS  14  43.706  10.386  -0.226
  108    HZ2  LYS  14           HZ2      LYS  14  43.387   9.057  -1.233
  109    HZ3  LYS  14           HZ3      LYS  14  42.501  10.496  -1.414
  110    H    HIS  15           HN       HIS  15  46.087   7.311  -0.527
  111    HA   HIS  15           HA       HIS  15  45.486   5.092  -0.974
  112    HB2  HIS  15           HB2      HIS  15  46.713   6.029  -2.960
  113    HB3  HIS  15           HB1      HIS  15  48.184   5.221  -2.367
  114    HD1  HIS  15           HD1      HIS  15  48.488   2.795  -2.954
  115    HD2  HIS  15           HD2      HIS  15  44.555   4.128  -3.604
  116    HE1  HIS  15           HE1      HIS  15  47.210   0.882  -4.064
  117    H    ILE  16           HN       ILE  16  47.352   5.489   1.431
  118    HA   ILE  16           HA       ILE  16  47.455   2.953   2.305
  119    HB   ILE  16           HB       ILE  16  49.053   2.175   0.716
  120   HG12  ILE  16          HG12      ILE  16  51.076   1.683   2.027
  121   HG13  ILE  16          HG11      ILE  16  50.635   2.923   3.216
  122   HG21  ILE  16          HG21      ILE  16  50.519   4.773   1.304
  123   HG22  ILE  16          HG22      ILE  16  49.840   4.268  -0.254
  124   HG23  ILE  16          HG23      ILE  16  51.262   3.439   0.416
  125   HD11  ILE  16           HD1      ILE  16  48.678   1.690   3.898
  126   HD12  ILE  16           HD2      ILE  16  50.008   0.514   3.823
  127   HD13  ILE  16           HD3      ILE  16  48.811   0.588   2.508
  128    H    GLY  17           HN       GLY  17  49.175   5.780   2.130
  129    HA2  GLY  17           HA1      GLY  17  49.746   5.827   5.013
  130    HA3  GLY  17           HA2      GLY  17  49.982   7.165   3.871
  131    H    HIS  18           HN       HIS  18  47.191   6.222   2.786
  132    HA   HIS  18           HA       HIS  18  45.628   8.030   4.620
  133    HB2  HIS  18           HB2      HIS  18  45.440   7.142   1.772
  134    HB3  HIS  18           HB1      HIS  18  43.877   7.236   2.603
  135    HD1  HIS  18           HD1      HIS  18  43.215   9.312   1.135
  136    HD2  HIS  18           HD2      HIS  18  46.605   9.908   3.550
  137    HE1  HIS  18           HE1      HIS  18  43.659  11.825   1.217
  138    H    ALA  19           HN       ALA  19  45.536   4.693   3.231
  139    HA   ALA  19           HA       ALA  19  44.735   3.365   5.547
  140    HB1  ALA  19           HB1      ALA  19  42.146   3.143   4.905
  141    HB2  ALA  19           HB2      ALA  19  42.415   4.758   4.209
  142    HB3  ALA  19           HB3      ALA  19  42.712   4.471   5.940
  143    H    ALA  20           HN       ALA  20  45.690   3.432   2.530
  144    HA   ALA  20           HA       ALA  20  45.936   1.834   0.864
  145    HB1  ALA  20           HB1      ALA  20  46.485   0.447   2.957
  146    HB2  ALA  20           HB2      ALA  20  46.000  -0.453   1.501
  147    HB3  ALA  20           HB3      ALA  20  44.836  -0.206   2.824
  148    H    VAL  21           HN       VAL  21  43.187   3.006   1.928
  149    HA   VAL  21           HA       VAL  21  41.570   1.716  -0.224
  150    HB   VAL  21           HB       VAL  21  40.585   2.079   2.646
  151   HG11  VAL  21          HG11      VAL  21  38.612   0.704   1.622
  152   HG12  VAL  21          HG12      VAL  21  39.267   1.204   0.046
  153   HG13  VAL  21          HG13      VAL  21  38.720   2.429   1.215
  154   HG21  VAL  21          HG21      VAL  21  40.417  -0.439   2.594
  155   HG22  VAL  21          HG22      VAL  21  42.089   0.152   2.493
  156   HG23  VAL  21          HG23      VAL  21  41.262  -0.423   1.028
  157    H    ASN  22           HN       ASN  22  42.742   4.315   1.528
  158    HA   ASN  22           HA       ASN  22  42.557   6.575   0.751
  159    HB2  ASN  22           HB2      ASN  22  40.842   5.867  -1.040
  160    HB3  ASN  22           HB1      ASN  22  39.597   6.153   0.205
  161   HD21  ASN  22          HD21      ASN  22  41.767   7.682  -2.088
  162   HD22  ASN  22          HD22      ASN  22  41.342   9.346  -1.674
  163    H    HIS  23           HN       HIS  23  40.089   4.834   2.579
  164    HA   HIS  23           HA       HIS  23  40.465   6.700   4.841
  165    HB2  HIS  23           HB2      HIS  23  37.814   6.436   3.368
  166    HB3  HIS  23           HB1      HIS  23  37.948   7.051   5.031
  167    HD1  HIS  23           HD1      HIS  23  37.582   8.355   1.798
  168    HD2  HIS  23           HD2      HIS  23  40.317   9.172   4.887
  169    HE1  HIS  23           HE1      HIS  23  38.539  10.685   1.370
  170    H    TYR  24           HN       TYR  24  38.375   5.976   6.431
  171    HA   TYR  24           HA       TYR  24  37.637   4.293   7.829
  172    HB2  TYR  24           HB2      TYR  24  38.245   2.253   5.665
  173    HB3  TYR  24           HB1      TYR  24  36.983   2.209   6.917
  174    HD1  TYR  24           HD1      TYR  24  37.536   2.847   3.488
  175    HD2  TYR  24           HD2      TYR  24  35.383   4.392   6.897
  176    HE1  TYR  24           HE1      TYR  24  35.932   3.985   1.961
  177    HE2  TYR  24           HE2      TYR  24  33.781   5.530   5.367
  178    HH   TYR  24           HH       TYR  24  34.090   5.267   1.823
  179    H    LEU  25           HN       LEU  25  40.518   5.066   7.532
  180    HA   LEU  25           HA       LEU  25  42.589   4.368   8.307
  181    HB2  LEU  25           HB2      LEU  25  41.462   4.441  10.437
  182    HB3  LEU  25           HB1      LEU  25  40.695   2.865  10.153
  183    HG   LEU  25           HG       LEU  25  42.816   1.709  10.340
  184   HD11  LEU  25          HD11      LEU  25  44.906   3.139  10.919
  185   HD12  LEU  25          HD12      LEU  25  43.987   4.518  10.270
  186   HD13  LEU  25          HD13      LEU  25  44.372   3.130   9.223
  187   HD21  LEU  25          HD21      LEU  25  42.636   3.874  12.484
  188   HD22  LEU  25          HD22      LEU  25  43.462   2.306  12.649
  189   HD23  LEU  25          HD23      LEU  25  41.693   2.365  12.461
  Start of MODEL   72
    1    H1   GLY   1           HT1      GLY   1  66.994  11.738   2.840
    2    H2   GLY   1           HT2      GLY   1  65.534  11.484   2.008
    3    H3   GLY   1           HT3      GLY   1  66.235  13.031   2.051
    4    HA2  GLY   1           HA1      GLY   1  68.239  11.775   1.011
    5    HA3  GLY   1           HA2      GLY   1  66.935  10.691   0.485
    6    H    TRP   2           HN       TRP   2  65.947  11.149  -1.358
    7    HA   TRP   2           HA       TRP   2  66.705  13.276  -3.032
    8    HB2  TRP   2           HB2      TRP   2  64.020  11.843  -2.960
    9    HB3  TRP   2           HB1      TRP   2  64.682  12.758  -4.336
   10    HD1  TRP   2           HD1      TRP   2  66.598  11.657  -5.743
   11    HE1  TRP   2           HE1      TRP   2  67.595   9.259  -5.872
   12    HE3  TRP   2           HE3      TRP   2  64.567   9.706  -1.467
   13    HZ2  TRP   2           HZ2      TRP   2  67.504   6.841  -4.311
   14    HZ3  TRP   2           HZ3      TRP   2  65.036   7.351  -0.807
   15    HH2  TRP   2           HH2      TRP   2  66.502   5.918  -2.223
   16    H    GLY   3           HN       GLY   3  65.464  15.127  -3.811
   17    HA2  GLY   3           HA1      GLY   3  64.712  16.852  -1.660
   18    HA3  GLY   3           HA2      GLY   3  64.452  17.162  -3.388
   19    H    SER   4           HN       SER   4  62.878  14.648  -3.688
   20    HA   SER   4           HA       SER   4  60.619  14.123  -3.715
   21    HB2  SER   4           HB2      SER   4  60.861  15.103  -0.846
   22    HB3  SER   4           HB1      SER   4  59.452  14.240  -1.500
   23    HG   SER   4           HG       SER   4  61.164  12.947  -0.437
   24    H    ILE   5           HN       ILE   5  59.639  15.437  -5.163
   25    HA   ILE   5           HA       ILE   5  59.130  18.250  -4.593
   26    HB   ILE   5           HB       ILE   5  57.792  16.511  -6.709
   27   HG12  ILE   5          HG12      ILE   5  60.129  16.149  -7.052
   28   HG13  ILE   5          HG11      ILE   5  59.678  17.407  -8.216
   29   HG21  ILE   5          HG21      ILE   5  58.185  19.503  -6.325
   30   HG22  ILE   5          HG22      ILE   5  56.685  18.598  -6.614
   31   HG23  ILE   5          HG23      ILE   5  57.859  18.809  -7.929
   32   HD11  ILE   5           HD1      ILE   5  61.196  17.713  -5.598
   33   HD12  ILE   5           HD2      ILE   5  60.459  19.107  -6.422
   34   HD13  ILE   5           HD3      ILE   5  61.720  18.158  -7.238
   35    H    PHE   6           HN       PHE   6  58.124  17.656  -2.428
   36    HA   PHE   6           HA       PHE   6  56.228  17.467  -1.103
   37    HB2  PHE   6           HB2      PHE   6  54.728  18.435  -3.562
   38    HB3  PHE   6           HB1      PHE   6  54.276  18.650  -1.854
   39    HD1  PHE   6           HD1      PHE   6  56.339  19.891  -4.620
   40    HD2  PHE   6           HD2      PHE   6  55.664  20.119  -0.362
   41    HE1  PHE   6           HE1      PHE   6  57.660  22.002  -4.523
   42    HE2  PHE   6           HE2      PHE   6  56.985  22.230  -0.266
   43    HZ   PHE   6           HZ       PHE   6  57.931  23.202  -2.357
   44    H    LYS   7           HN       LYS   7  56.922  15.329  -3.339
   45    HA   LYS   7           HA       LYS   7  54.373  14.033  -3.836
   46    HB2  LYS   7           HB2      LYS   7  55.875  12.063  -4.454
   47    HB3  LYS   7           HB1      LYS   7  56.152  13.570  -5.359
   48    HG2  LYS   7           HG2      LYS   7  58.112  14.101  -4.092
   49    HG3  LYS   7           HG1      LYS   7  57.734  12.884  -2.852
   50    HD2  LYS   7           HD2      LYS   7  59.541  12.120  -4.394
   51    HD3  LYS   7           HD1      LYS   7  58.106  11.070  -4.462
   52    HE2  LYS   7           HE2      LYS   7  59.170  11.782  -6.716
   53    HE3  LYS   7           HE1      LYS   7  57.409  11.963  -6.551
   54    HZ1  LYS   7           HZ1      LYS   7  58.738  13.924  -7.472
   55    HZ2  LYS   7           HZ2      LYS   7  59.258  14.176  -5.874
   56    HZ3  LYS   7           HZ3      LYS   7  57.603  14.251  -6.254
   57    H    HIS   8           HN       HIS   8  56.802  13.910  -1.285
   58    HA   HIS   8           HA       HIS   8  55.539  11.520  -0.043
   59    HB2  HIS   8           HB2      HIS   8  58.037  11.890  -0.065
   60    HB3  HIS   8           HB1      HIS   8  57.784  13.286   1.011
   61    HD1  HIS   8           HD1      HIS   8  57.802  12.790   3.456
   62    HD2  HIS   8           HD2      HIS   8  56.905   9.385   1.157
   63    HE1  HIS   8           HE1      HIS   8  57.573  10.822   5.068
   64    H    GLY   9           HN       GLY   9  53.462  12.873   0.023
   65    HA2  GLY   9           HA1      GLY   9  52.748  13.429   2.643
   66    HA3  GLY   9           HA2      GLY   9  53.336  14.985   2.024
   67    H    ARG  10           HN       ARG  10  52.509  14.922  -0.600
   68    HA   ARG  10           HA       ARG  10  49.583  15.303  -0.231
   69    HB2  ARG  10           HB2      ARG  10  51.404  15.925  -2.591
   70    HB3  ARG  10           HB1      ARG  10  49.702  16.418  -2.420
   71    HG2  ARG  10           HG2      ARG  10  50.367  17.587  -0.255
   72    HG3  ARG  10           HG1      ARG  10  52.063  17.275  -0.698
   73    HD2  ARG  10           HD2      ARG  10  51.440  19.515  -1.455
   74    HD3  ARG  10           HD1      ARG  10  51.666  18.463  -2.874
   75    HE   ARG  10           HE       ARG  10  48.899  18.483  -1.994
   76   HH11  ARG  10          HH11      ARG  10  47.619  19.053  -3.835
   77   HH12  ARG  10          HH12      ARG  10  48.131  20.404  -4.792
   78   HH21  ARG  10          HH21      ARG  10  51.175  20.740  -3.163
   79   HH22  ARG  10          HH22      ARG  10  50.144  21.360  -4.411
   80    H    HIS  11           HN       HIS  11  51.564  12.781  -1.016
   81    HA   HIS  11           HA       HIS  11  49.373  11.250  -2.130
   82    HB2  HIS  11           HB2      HIS  11  50.085  12.484  -4.185
   83    HB3  HIS  11           HB1      HIS  11  51.721  11.814  -3.983
   84    HD1  HIS  11           HD1      HIS  11  48.099  10.670  -4.505
   85    HD2  HIS  11           HD2      HIS  11  52.027   9.271  -5.057
   86    HE1  HIS  11           HE1      HIS  11  47.945   8.427  -5.716
   87    H    ALA  12           HN       ALA  12  49.570   9.217  -2.020
   88    HA   ALA  12           HA       ALA  12  50.328   7.145  -1.406
   89    HB1  ALA  12           HB1      ALA  12  52.927   8.423  -1.112
   90    HB2  ALA  12           HB2      ALA  12  52.350   7.929  -2.708
   91    HB3  ALA  12           HB3      ALA  12  52.641   6.721  -1.429
   92    H    ALA  13           HN       ALA  13  51.617  10.056   0.122
   93    HA   ALA  13           HA       ALA  13  51.885   8.805   2.752
   94    HB1  ALA  13           HB1      ALA  13  51.368  11.644   1.719
   95    HB2  ALA  13           HB2      ALA  13  52.783  11.059   2.629
   96    HB3  ALA  13           HB3      ALA  13  51.211  11.242   3.446
   97    H    LYS  14           HN       LYS  14  50.188   8.892   0.048
   98    HA   LYS  14           HA       LYS  14  47.369   8.738   1.395
   99    HB2  LYS  14           HB2      LYS  14  48.037  10.384  -0.523
  100    HB3  LYS  14           HB1      LYS  14  48.190   8.898  -1.526
  101    HG2  LYS  14           HG2      LYS  14  45.882   8.672  -1.707
  102    HG3  LYS  14           HG1      LYS  14  45.580   9.171  -0.028
  103    HD2  LYS  14           HD2      LYS  14  45.805  11.518  -0.625
  104    HD3  LYS  14           HD1      LYS  14  46.334  11.094  -2.271
  105    HE2  LYS  14           HE2      LYS  14  43.948  11.726  -2.268
  106    HE3  LYS  14           HE1      LYS  14  44.137  10.007  -2.685
  107    HZ1  LYS  14           HZ1      LYS  14  42.377  10.421  -1.030
  108    HZ2  LYS  14           HZ2      LYS  14  43.542  11.030   0.046
  109    HZ3  LYS  14           HZ3      LYS  14  43.598   9.403  -0.438
  110    H    HIS  15           HN       HIS  15  46.024   7.467  -0.464
  111    HA   HIS  15           HA       HIS  15  45.367   5.242  -0.825
  112    HB2  HIS  15           HB2      HIS  15  46.411   6.172  -2.923
  113    HB3  HIS  15           HB1      HIS  15  47.923   5.352  -2.468
  114    HD1  HIS  15           HD1      HIS  15  45.203   3.299  -1.286
  115    HD2  HIS  15           HD2      HIS  15  47.125   3.843  -4.985
  116    HE1  HIS  15           HE1      HIS  15  44.606   1.295  -2.756
  117    H    ILE  16           HN       ILE  16  47.372   5.628   1.423
  118    HA   ILE  16           HA       ILE  16  47.581   3.111   2.276
  119    HB   ILE  16           HB       ILE  16  49.048   2.285   0.607
  120   HG12  ILE  16          HG12      ILE  16  51.141   3.115   2.643
  121   HG13  ILE  16          HG11      ILE  16  49.804   2.071   3.161
  122   HG21  ILE  16          HG21      ILE  16  49.728   4.377  -0.500
  123   HG22  ILE  16          HG22      ILE  16  51.202   3.552   0.032
  124   HG23  ILE  16          HG23      ILE  16  50.571   4.904   0.969
  125   HD11  ILE  16           HD1      ILE  16  50.386   0.480   1.292
  126   HD12  ILE  16           HD2      ILE  16  51.675   0.664   2.503
  127   HD13  ILE  16           HD3      ILE  16  51.808   1.489   0.934
  128    H    GLY  17           HN       GLY  17  49.366   5.883   1.937
  129    HA2  GLY  17           HA1      GLY  17  50.166   5.941   4.758
  130    HA3  GLY  17           HA2      GLY  17  50.324   7.271   3.592
  131    H    HIS  18           HN       HIS  18  47.441   6.388   2.749
  132    HA   HIS  18           HA       HIS  18  46.081   8.261   4.648
  133    HB2  HIS  18           HB2      HIS  18  45.635   7.260   1.883
  134    HB3  HIS  18           HB1      HIS  18  44.147   7.303   2.841
  135    HD1  HIS  18           HD1      HIS  18  46.939   9.803   3.430
  136    HD2  HIS  18           HD2      HIS  18  43.133   9.649   1.650
  137    HE1  HIS  18           HE1      HIS  18  46.267  12.202   2.859
  138    H    ALA  19           HN       ALA  19  45.845   4.818   3.500
  139    HA   ALA  19           HA       ALA  19  44.972   3.981   6.153
  140    HB1  ALA  19           HB1      ALA  19  42.792   3.907   4.048
  141    HB2  ALA  19           HB2      ALA  19  42.907   5.186   5.280
  142    HB3  ALA  19           HB3      ALA  19  42.668   3.495   5.774
  143    H    ALA  20           HN       ALA  20  46.927   3.090   4.251
  144    HA   ALA  20           HA       ALA  20  47.698   1.065   3.429
  145    HB1  ALA  20           HB1      ALA  20  45.235  -0.334   4.489
  146    HB2  ALA  20           HB2      ALA  20  46.491   0.272   5.593
  147    HB3  ALA  20           HB3      ALA  20  46.902  -0.938   4.355
  148    H    VAL  21           HN       VAL  21  44.589   2.324   2.612
  149    HA   VAL  21           HA       VAL  21  44.810   1.070  -0.074
  150    HB   VAL  21           HB       VAL  21  42.202   0.924   1.500
  151   HG11  VAL  21          HG11      VAL  21  43.132  -0.232  -1.166
  152   HG12  VAL  21          HG12      VAL  21  41.950   1.078  -0.939
  153   HG13  VAL  21          HG13      VAL  21  41.563  -0.573  -0.397
  154   HG21  VAL  21          HG21      VAL  21  42.657  -1.568   1.478
  155   HG22  VAL  21          HG22      VAL  21  43.748  -0.641   2.534
  156   HG23  VAL  21          HG23      VAL  21  44.313  -1.206   0.943
  157    H    ASN  22           HN       ASN  22  43.462   3.413   2.173
  158    HA   ASN  22           HA       ASN  22  43.556   5.735   0.877
  159    HB2  ASN  22           HB2      ASN  22  42.620   5.167  -1.220
  160    HB3  ASN  22           HB1      ASN  22  41.358   4.145  -0.492
  161   HD21  ASN  22          HD21      ASN  22  42.365   7.564   0.241
  162   HD22  ASN  22          HD22      ASN  22  40.763   8.244  -0.063
  163    H    HIS  23           HN       HIS  23  40.945   3.601   2.089
  164    HA   HIS  23           HA       HIS  23  40.629   5.193   4.485
  165    HB2  HIS  23           HB2      HIS  23  39.520   6.732   2.885
  166    HB3  HIS  23           HB1      HIS  23  38.418   5.420   2.402
  167    HD1  HIS  23           HD1      HIS  23  36.204   5.736   3.494
  168    HD2  HIS  23           HD2      HIS  23  39.380   6.761   6.057
  169    HE1  HIS  23           HE1      HIS  23  35.184   6.409   5.738
  170    H    TYR  24           HN       TYR  24  41.139   2.733   4.692
  171    HA   TYR  24           HA       TYR  24  38.926   0.902   4.301
  172    HB2  TYR  24           HB2      TYR  24  41.381   0.285   4.470
  173    HB3  TYR  24           HB1      TYR  24  41.268   0.602   6.217
  174    HD1  TYR  24           HD1      TYR  24  40.315  -1.022   7.697
  175    HD2  TYR  24           HD2      TYR  24  39.817  -1.446   3.430
  176    HE1  TYR  24           HE1      TYR  24  39.356  -3.299   8.034
  177    HE2  TYR  24           HE2      TYR  24  38.859  -3.721   3.767
  178    HH   TYR  24           HH       TYR  24  37.734  -4.898   6.555
  179    H    LEU  25           HN       LEU  25  39.724   3.268   6.694
  180    HA   LEU  25           HA       LEU  25  38.597   3.909   8.610
  181    HB2  LEU  25           HB2      LEU  25  36.594   3.234   7.010
  182    HB3  LEU  25           HB1      LEU  25  36.422   1.854   8.114
  183    HG   LEU  25           HG       LEU  25  36.355   4.811   8.874
  184   HD11  LEU  25          HD11      LEU  25  34.223   2.629   8.970
  185   HD12  LEU  25          HD12      LEU  25  34.313   3.927   7.754
  186   HD13  LEU  25          HD13      LEU  25  34.011   4.326   9.463
  187   HD21  LEU  25          HD21      LEU  25  37.373   3.707  10.728
  188   HD22  LEU  25          HD22      LEU  25  36.355   2.259  10.537
  189   HD23  LEU  25          HD23      LEU  25  35.647   3.773  11.150
  Start of MODEL   73
    1    H1   GLY   1           HT1      GLY   1  65.647  15.980   6.569
    2    H2   GLY   1           HT2      GLY   1  65.094  14.378   6.427
    3    H3   GLY   1           HT3      GLY   1  64.480  15.389   7.648
    4    HA2  GLY   1           HA1      GLY   1  62.835  15.311   6.055
    5    HA3  GLY   1           HA2      GLY   1  63.652  16.875   5.863
    6    H    TRP   2           HN       TRP   2  62.694  13.966   4.365
    7    HA   TRP   2           HA       TRP   2  64.581  13.580   2.326
    8    HB2  TRP   2           HB2      TRP   2  61.545  13.421   2.182
    9    HB3  TRP   2           HB1      TRP   2  62.653  12.766   0.953
   10    HD1  TRP   2           HD1      TRP   2  64.557  10.980   2.006
   11    HE1  TRP   2           HE1      TRP   2  64.197   9.074   3.737
   12    HE3  TRP   2           HE3      TRP   2  60.190  12.621   4.116
   13    HZ2  TRP   2           HZ2      TRP   2  62.261   8.386   5.755
   14    HZ3  TRP   2           HZ3      TRP   2  59.105  11.324   5.943
   15    HH2  TRP   2           HH2      TRP   2  60.136   9.210   6.764
   16    H    GLY   3           HN       GLY   3  64.962  14.415   0.294
   17    HA2  GLY   3           HA1      GLY   3  64.380  17.248  -0.008
   18    HA3  GLY   3           HA2      GLY   3  65.249  16.210  -1.156
   19    H    SER   4           HN       SER   4  62.433  14.635  -0.446
   20    HA   SER   4           HA       SER   4  61.310  14.846  -3.002
   21    HB2  SER   4           HB2      SER   4  59.997  14.311  -0.316
   22    HB3  SER   4           HB1      SER   4  59.152  14.133  -1.869
   23    HG   SER   4           HG       SER   4  60.273  12.216  -0.941
   24    H    ILE   5           HN       ILE   5  60.129  16.285  -4.098
   25    HA   ILE   5           HA       ILE   5  59.680  18.917  -2.918
   26    HB   ILE   5           HB       ILE   5  58.563  17.894  -5.563
   27   HG12  ILE   5          HG12      ILE   5  61.342  18.980  -4.911
   28   HG13  ILE   5          HG11      ILE   5  60.954  17.341  -5.485
   29   HG21  ILE   5          HG21      ILE   5  58.562  20.208  -6.192
   30   HG22  ILE   5          HG22      ILE   5  59.564  20.668  -4.794
   31   HG23  ILE   5          HG23      ILE   5  57.874  20.163  -4.553
   32   HD11  ILE   5           HD1      ILE   5  60.771  19.970  -6.994
   33   HD12  ILE   5           HD2      ILE   5  59.869  18.532  -7.534
   34   HD13  ILE   5           HD3      ILE   5  61.645  18.488  -7.445
   35    H    PHE   6           HN       PHE   6  58.344  17.889  -1.120
   36    HA   PHE   6           HA       PHE   6  56.275  17.558  -0.133
   37    HB2  PHE   6           HB2      PHE   6  55.421  19.297  -2.481
   38    HB3  PHE   6           HB1      PHE   6  54.378  18.888  -1.098
   39    HD1  PHE   6           HD1      PHE   6  54.942  19.681   1.189
   40    HD2  PHE   6           HD2      PHE   6  57.264  20.866  -2.250
   41    HE1  PHE   6           HE1      PHE   6  55.974  21.518   2.519
   42    HE2  PHE   6           HE2      PHE   6  58.295  22.704  -0.921
   43    HZ   PHE   6           HZ       PHE   6  57.701  22.986   1.482
   44    H    LYS   7           HN       LYS   7  57.237  15.801  -2.496
   45    HA   LYS   7           HA       LYS   7  54.786  14.846  -3.739
   46    HB2  LYS   7           HB2      LYS   7  57.507  13.505  -3.454
   47    HB3  LYS   7           HB1      LYS   7  56.197  12.993  -4.545
   48    HG2  LYS   7           HG2      LYS   7  56.362  14.995  -5.852
   49    HG3  LYS   7           HG1      LYS   7  57.377  15.798  -4.630
   50    HD2  LYS   7           HD2      LYS   7  58.731  15.017  -6.557
   51    HD3  LYS   7           HD1      LYS   7  59.196  14.184  -5.056
   52    HE2  LYS   7           HE2      LYS   7  58.094  12.175  -5.694
   53    HE3  LYS   7           HE1      LYS   7  57.142  12.994  -6.958
   54    HZ1  LYS   7           HZ1      LYS   7  59.788  13.481  -7.569
   55    HZ2  LYS   7           HZ2      LYS   7  58.736  12.412  -8.366
   56    HZ3  LYS   7           HZ3      LYS   7  59.743  11.847  -7.118
   57    H    HIS   8           HN       HIS   8  56.976  13.509  -1.218
   58    HA   HIS   8           HA       HIS   8  55.097  11.363  -0.578
   59    HB2  HIS   8           HB2      HIS   8  57.546  11.111  -0.291
   60    HB3  HIS   8           HB1      HIS   8  57.524  12.389   0.949
   61    HD1  HIS   8           HD1      HIS   8  54.967   9.574   0.493
   62    HD2  HIS   8           HD2      HIS   8  57.829  10.896   3.277
   63    HE1  HIS   8           HE1      HIS   8  54.748   8.099   2.568
   64    H    GLY   9           HN       GLY   9  53.339  13.152  -0.391
   65    HA2  GLY   9           HA1      GLY   9  52.665  13.325   2.406
   66    HA3  GLY   9           HA2      GLY   9  53.195  14.905   1.796
   67    H    ARG  10           HN       ARG  10  52.230  14.776  -0.825
   68    HA   ARG  10           HA       ARG  10  49.331  15.182  -0.290
   69    HB2  ARG  10           HB2      ARG  10  51.049  15.751  -2.740
   70    HB3  ARG  10           HB1      ARG  10  49.335  16.196  -2.556
   71    HG2  ARG  10           HG2      ARG  10  49.826  17.685  -0.727
   72    HG3  ARG  10           HG1      ARG  10  51.496  17.079  -0.598
   73    HD2  ARG  10           HD2      ARG  10  51.142  19.336  -1.824
   74    HD3  ARG  10           HD1      ARG  10  52.152  18.115  -2.634
   75    HE   ARG  10           HE       ARG  10  49.403  17.819  -3.448
   76   HH11  ARG  10          HH11      ARG  10  52.461  19.137  -4.153
   77   HH12  ARG  10          HH12      ARG  10  51.936  20.003  -5.559
   78   HH21  ARG  10          HH21      ARG  10  48.585  19.234  -5.103
   79   HH22  ARG  10          HH22      ARG  10  49.741  20.057  -6.097
   80    H    HIS  11           HN       HIS  11  51.272  12.648  -1.132
   81    HA   HIS  11           HA       HIS  11  49.016  11.080  -2.048
   82    HB2  HIS  11           HB2      HIS  11  49.833  10.488  -4.269
   83    HB3  HIS  11           HB1      HIS  11  49.606  12.250  -4.185
   84    HD1  HIS  11           HD1      HIS  11  51.513  13.550  -5.104
   85    HD2  HIS  11           HD2      HIS  11  52.733   9.806  -3.640
   86    HE1  HIS  11           HE1      HIS  11  54.034  13.371  -5.474
   87    H    ALA  12           HN       ALA  12  49.233   9.049  -1.930
   88    HA   ALA  12           HA       ALA  12  50.016   7.002  -1.304
   89    HB1  ALA  12           HB1      ALA  12  51.987   7.753  -2.706
   90    HB2  ALA  12           HB2      ALA  12  52.318   6.563  -1.421
   91    HB3  ALA  12           HB3      ALA  12  52.628   8.281  -1.160
   92    H    ALA  13           HN       ALA  13  51.366   9.941   0.116
   93    HA   ALA  13           HA       ALA  13  51.758   8.730   2.753
   94    HB1  ALA  13           HB1      ALA  13  51.295  11.538   1.647
   95    HB2  ALA  13           HB2      ALA  13  52.628  10.964   2.679
   96    HB3  ALA  13           HB3      ALA  13  51.008  11.217   3.373
   97    H    LYS  14           HN       LYS  14  49.946   8.762   0.128
   98    HA   LYS  14           HA       LYS  14  47.196   8.612   1.605
   99    HB2  LYS  14           HB2      LYS  14  47.767  10.257  -0.347
  100    HB3  LYS  14           HB1      LYS  14  47.881   8.762  -1.349
  101    HG2  LYS  14           HG2      LYS  14  45.566   8.536  -1.428
  102    HG3  LYS  14           HG1      LYS  14  45.340   9.021   0.267
  103    HD2  LYS  14           HD2      LYS  14  45.630  11.394  -0.365
  104    HD3  LYS  14           HD1      LYS  14  45.896  10.917  -2.060
  105    HE2  LYS  14           HE2      LYS  14  43.375  10.229  -0.492
  106    HE3  LYS  14           HE1      LYS  14  43.526  11.662  -1.538
  107    HZ1  LYS  14           HZ1      LYS  14  44.015  10.221  -3.402
  108    HZ2  LYS  14           HZ2      LYS  14  42.537   9.766  -2.698
  109    HZ3  LYS  14           HZ3      LYS  14  43.935   8.844  -2.414
  110    H    HIS  15           HN       HIS  15  45.775   7.314  -0.206
  111    HA   HIS  15           HA       HIS  15  45.135   5.081  -0.551
  112    HB2  HIS  15           HB2      HIS  15  46.076   5.962  -2.685
  113    HB3  HIS  15           HB1      HIS  15  47.657   5.276  -2.241
  114    HD1  HIS  15           HD1      HIS  15  44.053   4.207  -2.966
  115    HD2  HIS  15           HD2      HIS  15  47.928   2.578  -2.864
  116    HE1  HIS  15           HE1      HIS  15  43.895   1.810  -3.838
  117    H    ILE  16           HN       ILE  16  47.218   5.519   1.643
  118    HA   ILE  16           HA       ILE  16  47.451   3.011   2.531
  119    HB   ILE  16           HB       ILE  16  48.868   2.171   0.824
  120   HG12  ILE  16          HG12      ILE  16  51.016   3.027   2.790
  121   HG13  ILE  16          HG11      ILE  16  49.698   1.982   3.355
  122   HG21  ILE  16          HG21      ILE  16  51.003   3.441   0.178
  123   HG22  ILE  16          HG22      ILE  16  50.384   4.801   1.112
  124   HG23  ILE  16          HG23      ILE  16  49.506   4.249  -0.325
  125   HD11  ILE  16           HD1      ILE  16  51.638   1.387   1.075
  126   HD12  ILE  16           HD2      ILE  16  50.232   0.378   1.484
  127   HD13  ILE  16           HD3      ILE  16  51.555   0.576   2.654
  128    H    GLY  17           HN       GLY  17  49.193   5.796   2.096
  129    HA2  GLY  17           HA1      GLY  17  50.106   5.892   4.882
  130    HA3  GLY  17           HA2      GLY  17  50.208   7.208   3.694
  131    H    HIS  18           HN       HIS  18  47.282   6.286   2.999
  132    HA   HIS  18           HA       HIS  18  46.011   8.161   4.974
  133    HB2  HIS  18           HB2      HIS  18  45.429   7.205   2.205
  134    HB3  HIS  18           HB1      HIS  18  43.994   7.340   3.235
  135    HD1  HIS  18           HD1      HIS  18  46.941   9.665   3.726
  136    HD2  HIS  18           HD2      HIS  18  43.121   9.730   1.965
  137    HE1  HIS  18           HE1      HIS  18  46.400  12.099   3.170
  138    H    ALA  19           HN       ALA  19  45.750   4.742   3.774
  139    HA   ALA  19           HA       ALA  19  44.893   3.868   6.420
  140    HB1  ALA  19           HB1      ALA  19  42.704   3.776   4.328
  141    HB2  ALA  19           HB2      ALA  19  42.823   5.085   5.530
  142    HB3  ALA  19           HB3      ALA  19  42.592   3.405   6.065
  143    H    ALA  20           HN       ALA  20  46.863   2.975   4.593
  144    HA   ALA  20           HA       ALA  20  47.628   0.948   3.779
  145    HB1  ALA  20           HB1      ALA  20  45.052  -0.443   4.531
  146    HB2  ALA  20           HB2      ALA  20  46.161   0.124   5.800
  147    HB3  ALA  20           HB3      ALA  20  46.724  -1.050   4.586
  148    H    VAL  21           HN       VAL  21  44.522   2.257   2.853
  149    HA   VAL  21           HA       VAL  21  44.995   1.273   0.085
  150    HB   VAL  21           HB       VAL  21  42.320   0.826   1.484
  151   HG11  VAL  21          HG11      VAL  21  42.065   1.294  -0.891
  152   HG12  VAL  21          HG12      VAL  21  41.863  -0.455  -0.651
  153   HG13  VAL  21          HG13      VAL  21  43.393   0.184  -1.299
  154   HG21  VAL  21          HG21      VAL  21  42.909  -1.622   1.111
  155   HG22  VAL  21          HG22      VAL  21  43.894  -0.805   2.345
  156   HG23  VAL  21          HG23      VAL  21  44.564  -1.095   0.722
  157    H    ASN  22           HN       ASN  22  43.299   3.317   2.414
  158    HA   ASN  22           HA       ASN  22  43.402   5.733   1.171
  159    HB2  ASN  22           HB2      ASN  22  41.404   4.015  -0.288
  160    HB3  ASN  22           HB1      ASN  22  40.868   5.661   0.094
  161   HD21  ASN  22          HD21      ASN  22  41.806   4.226  -2.535
  162   HD22  ASN  22          HD22      ASN  22  42.973   5.376  -3.198
  163    H    HIS  23           HN       HIS  23  40.833   3.520   2.353
  164    HA   HIS  23           HA       HIS  23  40.562   5.008   4.824
  165    HB2  HIS  23           HB2      HIS  23  39.415   6.598   3.294
  166    HB3  HIS  23           HB1      HIS  23  38.298   5.300   2.808
  167    HD1  HIS  23           HD1      HIS  23  39.338   7.364   5.850
  168    HD2  HIS  23           HD2      HIS  23  36.192   4.873   4.591
  169    HE1  HIS  23           HE1      HIS  23  37.514   7.479   7.636
  170    H    TYR  24           HN       TYR  24  40.366   2.310   3.005
  171    HA   TYR  24           HA       TYR  24  37.992   1.058   4.171
  172    HB2  TYR  24           HB2      TYR  24  40.391  -0.061   2.670
  173    HB3  TYR  24           HB1      TYR  24  38.984  -1.028   3.175
  174    HD1  TYR  24           HD1      TYR  24  36.825  -0.787   2.078
  175    HD2  TYR  24           HD2      TYR  24  40.145   1.746   0.985
  176    HE1  TYR  24           HE1      TYR  24  35.580  -0.028   0.058
  177    HE2  TYR  24           HE2      TYR  24  38.900   2.506  -1.035
  178    HH   TYR  24           HH       TYR  24  35.856   2.367  -1.513
  179    H    LEU  25           HN       LEU  25  39.598   2.213   6.189
  180    HA   LEU  25           HA       LEU  25  41.263   0.151   7.407
  181    HB2  LEU  25           HB2      LEU  25  40.954   1.767   9.474
  182    HB3  LEU  25           HB1      LEU  25  41.904   2.302   8.073
  183    HG   LEU  25           HG       LEU  25  40.031   3.586   7.205
  184   HD11  LEU  25          HD11      LEU  25  38.123   2.221   7.727
  185   HD12  LEU  25          HD12      LEU  25  37.907   3.722   8.652
  186   HD13  LEU  25          HD13      LEU  25  38.489   2.252   9.469
  187   HD21  LEU  25          HD21      LEU  25  39.724   5.193   9.077
  188   HD22  LEU  25          HD22      LEU  25  41.415   4.654   8.943
  189   HD23  LEU  25          HD23      LEU  25  40.363   3.979  10.211
  Start of MODEL   74
    1    H1   GLY   1           HT1      GLY   1  64.553  21.596   0.066
    2    H2   GLY   1           HT2      GLY   1  64.343  20.040  -0.583
    3    H3   GLY   1           HT3      GLY   1  64.435  21.389  -1.612
    4    HA2  GLY   1           HA1      GLY   1  66.638  21.594  -1.446
    5    HA3  GLY   1           HA2      GLY   1  66.653  20.904   0.189
    6    H    TRP   2           HN       TRP   2  65.133  18.568  -0.315
    7    HA   TRP   2           HA       TRP   2  67.245  16.885  -1.391
    8    HB2  TRP   2           HB2      TRP   2  64.370  16.256  -0.611
    9    HB3  TRP   2           HB1      TRP   2  65.617  15.045  -0.992
   10    HD1  TRP   2           HD1      TRP   2  64.574  17.567   1.665
   11    HE1  TRP   2           HE1      TRP   2  65.951  17.181   3.838
   12    HE3  TRP   2           HE3      TRP   2  67.931  14.133  -0.107
   13    HZ2  TRP   2           HZ2      TRP   2  68.204  15.586   4.660
   14    HZ3  TRP   2           HZ3      TRP   2  69.685  13.192   1.389
   15    HH2  TRP   2           HH2      TRP   2  69.825  13.915   3.769
   16    H    GLY   3           HN       GLY   3  63.803  16.722  -2.306
   17    HA2  GLY   3           HA1      GLY   3  63.932  17.547  -4.962
   18    HA3  GLY   3           HA2      GLY   3  64.487  15.861  -4.989
   19    H    SER   4           HN       SER   4  62.371  16.496  -2.410
   20    HA   SER   4           HA       SER   4  59.879  16.034  -3.917
   21    HB2  SER   4           HB2      SER   4  61.097  13.874  -2.155
   22    HB3  SER   4           HB1      SER   4  59.386  13.909  -2.635
   23    HG   SER   4           HG       SER   4  61.293  12.847  -3.984
   24    H    ILE   5           HN       ILE   5  59.430  18.049  -2.871
   25    HA   ILE   5           HA       ILE   5  59.360  18.140   0.065
   26    HB   ILE   5           HB       ILE   5  58.331  20.053  -2.084
   27   HG12  ILE   5          HG12      ILE   5  60.224  21.466  -1.245
   28   HG13  ILE   5          HG11      ILE   5  60.700  20.147  -0.152
   29   HG21  ILE   5          HG21      ILE   5  58.280  20.216   0.957
   30   HG22  ILE   5          HG22      ILE   5  56.921  20.421  -0.173
   31   HG23  ILE   5          HG23      ILE   5  58.188  21.664  -0.074
   32   HD11  ILE   5           HD1      ILE   5  61.869  20.403  -2.532
   33   HD12  ILE   5           HD2      ILE   5  60.413  19.564  -3.115
   34   HD13  ILE   5           HD3      ILE   5  61.468  18.787  -1.908
   35    H    PHE   6           HN       PHE   6  56.705  19.054  -2.138
   36    HA   PHE   6           HA       PHE   6  54.723  18.092  -0.254
   37    HB2  PHE   6           HB2      PHE   6  54.285  18.761  -3.186
   38    HB3  PHE   6           HB1      PHE   6  53.104  18.836  -1.855
   39    HD1  PHE   6           HD1      PHE   6  55.801  20.583  -3.600
   40    HD2  PHE   6           HD2      PHE   6  53.416  20.527  -0.002
   41    HE1  PHE   6           HE1      PHE   6  56.476  22.932  -3.118
   42    HE2  PHE   6           HE2      PHE   6  54.092  22.877   0.480
   43    HZ   PHE   6           HZ       PHE   6  55.584  24.094  -1.101
   44    H    LYS   7           HN       LYS   7  56.219  16.809  -3.202
   45    HA   LYS   7           HA       LYS   7  54.448  14.742  -3.845
   46    HB2  LYS   7           HB2      LYS   7  57.491  14.707  -3.848
   47    HB3  LYS   7           HB1      LYS   7  56.462  13.511  -4.671
   48    HG2  LYS   7           HG2      LYS   7  55.428  15.304  -6.018
   49    HG3  LYS   7           HG1      LYS   7  56.428  16.518  -5.183
   50    HD2  LYS   7           HD2      LYS   7  58.475  15.493  -6.049
   51    HD3  LYS   7           HD1      LYS   7  57.533  14.180  -6.798
   52    HE2  LYS   7           HE2      LYS   7  58.181  15.999  -8.418
   53    HE3  LYS   7           HE1      LYS   7  56.423  15.752  -8.293
   54    HZ1  LYS   7           HZ1      LYS   7  57.620  17.681  -6.455
   55    HZ2  LYS   7           HZ2      LYS   7  56.128  17.729  -7.266
   56    HZ3  LYS   7           HZ3      LYS   7  57.560  18.133  -8.088
   57    H    HIS   8           HN       HIS   8  57.365  14.310  -1.778
   58    HA   HIS   8           HA       HIS   8  56.306  11.794  -0.720
   59    HB2  HIS   8           HB2      HIS   8  58.723  12.131  -1.012
   60    HB3  HIS   8           HB1      HIS   8  58.686  13.496   0.129
   61    HD1  HIS   8           HD1      HIS   8  60.380  12.094   1.652
   62    HD2  HIS   8           HD2      HIS   8  56.510  10.498   1.259
   63    HE1  HIS   8           HE1      HIS   8  60.103  10.313   3.462
   64    H    GLY   9           HN       GLY   9  54.236  13.124  -0.127
   65    HA2  GLY   9           HA1      GLY   9  53.933  13.088   2.648
   66    HA3  GLY   9           HA2      GLY   9  54.390  14.758   2.259
   67    H    ARG  10           HN       ARG  10  53.071  14.466  -0.446
   68    HA   ARG  10           HA       ARG  10  50.280  15.007   0.524
   69    HB2  ARG  10           HB2      ARG  10  51.693  16.723  -0.824
   70    HB3  ARG  10           HB1      ARG  10  51.409  15.665  -2.222
   71    HG2  ARG  10           HG2      ARG  10  48.979  15.899  -1.953
   72    HG3  ARG  10           HG1      ARG  10  49.209  16.858  -0.471
   73    HD2  ARG  10           HD2      ARG  10  48.777  18.338  -2.395
   74    HD3  ARG  10           HD1      ARG  10  50.434  18.576  -1.788
   75    HE   ARG  10           HE       ARG  10  51.191  17.844  -3.893
   76   HH11  ARG  10          HH11      ARG  10  47.865  17.723  -4.000
   77   HH12  ARG  10          HH12      ARG  10  47.759  16.465  -5.185
   78   HH21  ARG  10          HH21      ARG  10  51.147  15.732  -5.095
   79   HH22  ARG  10          HH22      ARG  10  49.617  15.336  -5.805
   80    H    HIS  11           HN       HIS  11  52.089  12.541  -0.718
   81    HA   HIS  11           HA       HIS  11  49.663  11.141  -1.657
   82    HB2  HIS  11           HB2      HIS  11  50.557  12.243  -3.729
   83    HB3  HIS  11           HB1      HIS  11  52.098  11.391  -3.469
   84    HD1  HIS  11           HD1      HIS  11  48.381  10.355  -3.485
   85    HD2  HIS  11           HD2      HIS  11  52.104   9.096  -4.983
   86    HE1  HIS  11           HE1      HIS  11  47.985   8.193  -4.790
   87    H    ALA  12           HN       ALA  12  49.670   9.094  -1.528
   88    HA   ALA  12           HA       ALA  12  50.216   6.982  -0.847
   89    HB1  ALA  12           HB1      ALA  12  52.911   8.020  -0.454
   90    HB2  ALA  12           HB2      ALA  12  52.355   7.545  -2.062
   91    HB3  ALA  12           HB3      ALA  12  52.473   6.349  -0.748
   92    H    ALA  13           HN       ALA  13  51.586   9.831   0.693
   93    HA   ALA  13           HA       ALA  13  51.644   8.612   3.363
   94    HB1  ALA  13           HB1      ALA  13  51.250  11.475   2.308
   95    HB2  ALA  13           HB2      ALA  13  52.690  10.842   3.143
   96    HB3  ALA  13           HB3      ALA  13  51.165  11.056   4.035
   97    H    LYS  14           HN       LYS  14  50.151   8.725   0.555
   98    HA   LYS  14           HA       LYS  14  47.241   8.710   1.698
   99    HB2  LYS  14           HB2      LYS  14  48.179  10.345  -0.166
  100    HB3  LYS  14           HB1      LYS  14  48.200   8.855  -1.179
  101    HG2  LYS  14           HG2      LYS  14  45.577   8.959   0.059
  102    HG3  LYS  14           HG1      LYS  14  45.919  10.634  -0.411
  103    HD2  LYS  14           HD2      LYS  14  46.566   9.740  -2.719
  104    HD3  LYS  14           HD1      LYS  14  45.887   8.178  -2.210
  105    HE2  LYS  14           HE2      LYS  14  44.170   9.443  -3.406
  106    HE3  LYS  14           HE1      LYS  14  43.723   9.337  -1.687
  107    HZ1  LYS  14           HZ1      LYS  14  43.864  11.533  -1.475
  108    HZ2  LYS  14           HZ2      LYS  14  43.956  11.629  -3.169
  109    HZ3  LYS  14           HZ3      LYS  14  45.377  11.607  -2.238
  110    H    HIS  15           HN       HIS  15  46.141   7.509  -0.555
  111    HA   HIS  15           HA       HIS  15  45.473   5.296  -0.995
  112    HB2  HIS  15           HB2      HIS  15  46.906   6.148  -2.873
  113    HB3  HIS  15           HB1      HIS  15  48.292   5.313  -2.133
  114    HD1  HIS  15           HD1      HIS  15  48.566   2.855  -2.612
  115    HD2  HIS  15           HD2      HIS  15  44.713   4.250  -3.557
  116    HE1  HIS  15           HE1      HIS  15  47.343   0.961  -3.814
  117    H    ILE  16           HN       ILE  16  47.050   5.618   1.590
  118    HA   ILE  16           HA       ILE  16  47.010   3.100   2.494
  119    HB   ILE  16           HB       ILE  16  48.711   2.230   1.066
  120   HG12  ILE  16          HG12      ILE  16  50.191   2.973   3.622
  121   HG13  ILE  16          HG11      ILE  16  48.922   1.730   3.562
  122   HG21  ILE  16          HG21      ILE  16  50.311   4.718   1.818
  123   HG22  ILE  16          HG22      ILE  16  49.673   4.353   0.199
  124   HG23  ILE  16          HG23      ILE  16  50.971   3.364   0.897
  125   HD11  ILE  16           HD1      ILE  16  51.699   1.692   2.351
  126   HD12  ILE  16           HD2      ILE  16  50.410   0.749   1.564
  127   HD13  ILE  16           HD3      ILE  16  50.847   0.423   3.255
  128    H    GLY  17           HN       GLY  17  48.937   5.796   2.449
  129    HA2  GLY  17           HA1      GLY  17  49.309   5.864   5.345
  130    HA3  GLY  17           HA2      GLY  17  49.664   7.183   4.208
  131    H    HIS  18           HN       HIS  18  46.878   6.370   3.016
  132    HA   HIS  18           HA       HIS  18  45.326   8.235   4.817
  133    HB2  HIS  18           HB2      HIS  18  45.241   7.473   1.914
  134    HB3  HIS  18           HB1      HIS  18  43.662   7.745   2.677
  135    HD1  HIS  18           HD1      HIS  18  43.394   9.930   1.207
  136    HD2  HIS  18           HD2      HIS  18  46.633  10.002   3.887
  137    HE1  HIS  18           HE1      HIS  18  44.156  12.359   1.416
  138    H    ALA  19           HN       ALA  19  45.155   4.975   3.270
  139    HA   ALA  19           HA       ALA  19  44.084   3.591   5.426
  140    HB1  ALA  19           HB1      ALA  19  41.961   5.221   4.032
  141    HB2  ALA  19           HB2      ALA  19  42.111   4.798   5.756
  142    HB3  ALA  19           HB3      ALA  19  41.534   3.586   4.592
  143    H    ALA  20           HN       ALA  20  45.260   3.740   2.497
  144    HA   ALA  20           HA       ALA  20  45.502   2.220   0.759
  145    HB1  ALA  20           HB1      ALA  20  44.143   0.175   2.540
  146    HB2  ALA  20           HB2      ALA  20  45.829   0.691   2.786
  147    HB3  ALA  20           HB3      ALA  20  45.353  -0.098   1.264
  148    H    VAL  21           HN       VAL  21  42.760   3.524   1.704
  149    HA   VAL  21           HA       VAL  21  41.237   2.479  -0.636
  150    HB   VAL  21           HB       VAL  21  40.069   2.654   2.183
  151   HG11  VAL  21          HG11      VAL  21  38.088   1.519   0.906
  152   HG12  VAL  21          HG12      VAL  21  38.879   2.125  -0.567
  153   HG13  VAL  21          HG13      VAL  21  38.328   3.265   0.684
  154   HG21  VAL  21          HG21      VAL  21  39.742   0.164   1.854
  155   HG22  VAL  21          HG22      VAL  21  41.447   0.652   1.953
  156   HG23  VAL  21          HG23      VAL  21  40.719   0.282   0.372
  157    H    ASN  22           HN       ASN  22  42.383   4.875   1.410
  158    HA   ASN  22           HA       ASN  22  42.361   7.193   0.786
  159    HB2  ASN  22           HB2      ASN  22  40.748   6.735  -1.159
  160    HB3  ASN  22           HB1      ASN  22  39.428   6.957   0.020
  161   HD21  ASN  22          HD21      ASN  22  39.265   9.095   1.120
  162   HD22  ASN  22          HD22      ASN  22  39.959  10.518   0.335
  163    H    HIS  23           HN       HIS  23  39.684   5.465   2.324
  164    HA   HIS  23           HA       HIS  23  40.081   6.834   4.826
  165    HB2  HIS  23           HB2      HIS  23  38.983   8.697   3.557
  166    HB3  HIS  23           HB1      HIS  23  37.572   7.644   3.302
  167    HD1  HIS  23           HD1      HIS  23  39.448   9.571   5.965
  168    HD2  HIS  23           HD2      HIS  23  36.034   7.136   5.663
  169    HE1  HIS  23           HE1      HIS  23  38.115   9.856   8.128
  170    H    TYR  24           HN       TYR  24  40.136   4.526   5.266
  171    HA   TYR  24           HA       TYR  24  37.601   3.031   4.996
  172    HB2  TYR  24           HB2      TYR  24  39.826   1.938   4.702
  173    HB3  TYR  24           HB1      TYR  24  40.184   2.269   6.414
  174    HD1  TYR  24           HD1      TYR  24  39.043   1.060   8.203
  175    HD2  TYR  24           HD2      TYR  24  38.054   0.338   4.065
  176    HE1  TYR  24           HE1      TYR  24  37.787  -0.988   8.861
  177    HE2  TYR  24           HE2      TYR  24  36.799  -1.710   4.722
  178    HH   TYR  24           HH       TYR  24  36.881  -3.316   7.275
  179    H    LEU  25           HN       LEU  25  39.037   5.191   7.223
  180    HA   LEU  25           HA       LEU  25  38.065   4.077   9.691
  181    HB2  LEU  25           HB2      LEU  25  38.367   7.041   9.093
  182    HB3  LEU  25           HB1      LEU  25  38.555   6.205  10.653
  183    HG   LEU  25           HG       LEU  25  40.368   5.924   8.213
  184   HD11  LEU  25          HD11      LEU  25  42.054   6.940   9.728
  185   HD12  LEU  25          HD12      LEU  25  40.811   7.103  10.992
  186   HD13  LEU  25          HD13      LEU  25  40.665   8.024   9.476
  187   HD21  LEU  25          HD21      LEU  25  41.770   4.588   9.946
  188   HD22  LEU  25          HD22      LEU  25  40.352   3.772   9.250
  189   HD23  LEU  25          HD23      LEU  25  40.264   4.467  10.887
  Start of MODEL   75
    1    H1   GLY   1           HT1      GLY   1  63.857  21.044   4.698
    2    H2   GLY   1           HT2      GLY   1  63.471  21.094   6.353
    3    H3   GLY   1           HT3      GLY   1  62.945  22.333   5.315
    4    HA2  GLY   1           HA1      GLY   1  61.858  19.725   5.813
    5    HA3  GLY   1           HA2      GLY   1  61.056  21.227   5.314
    6    H    TRP   2           HN       TRP   2  59.837  20.370   3.675
    7    HA   TRP   2           HA       TRP   2  59.390  19.478   1.577
    8    HB2  TRP   2           HB2      TRP   2  62.060  20.854   1.085
    9    HB3  TRP   2           HB1      TRP   2  61.059  20.168  -0.216
   10    HD1  TRP   2           HD1      TRP   2  58.879  21.432  -0.891
   11    HE1  TRP   2           HE1      TRP   2  57.872  23.758  -0.309
   12    HE3  TRP   2           HE3      TRP   2  61.875  22.639   3.083
   13    HZ2  TRP   2           HZ2      TRP   2  58.330  25.837   1.629
   14    HZ3  TRP   2           HZ3      TRP   2  61.572  24.799   4.283
   15    HH2  TRP   2           HH2      TRP   2  59.803  26.398   3.560
   16    H    GLY   3           HN       GLY   3  62.754  19.131   0.746
   17    HA2  GLY   3           HA1      GLY   3  64.060  17.251   0.403
   18    HA3  GLY   3           HA2      GLY   3  63.152  16.458   1.707
   19    H    SER   4           HN       SER   4  61.191  17.704  -0.798
   20    HA   SER   4           HA       SER   4  61.359  15.467  -2.630
   21    HB2  SER   4           HB2      SER   4  59.112  14.489  -2.054
   22    HB3  SER   4           HB1      SER   4  60.366  14.185  -0.832
   23    HG   SER   4           HG       SER   4  58.165  15.055  -0.185
   24    H    ILE   5           HN       ILE   5  59.842  15.629  -4.366
   25    HA   ILE   5           HA       ILE   5  59.033  18.401  -4.853
   26    HB   ILE   5           HB       ILE   5  58.324  15.968  -6.548
   27   HG12  ILE   5          HG12      ILE   5  60.883  17.636  -6.549
   28   HG13  ILE   5          HG11      ILE   5  60.752  15.935  -6.050
   29   HG21  ILE   5          HG21      ILE   5  58.956  18.828  -7.389
   30   HG22  ILE   5          HG22      ILE   5  57.308  18.301  -6.972
   31   HG23  ILE   5          HG23      ILE   5  58.162  17.551  -8.340
   32   HD11  ILE   5           HD1      ILE   5  60.432  17.122  -8.824
   33   HD12  ILE   5           HD2      ILE   5  59.768  15.517  -8.425
   34   HD13  ILE   5           HD3      ILE   5  61.517  15.819  -8.293
   35    H    PHE   6           HN       PHE   6  57.650  18.104  -2.734
   36    HA   PHE   6           HA       PHE   6  55.530  18.027  -1.808
   37    HB2  PHE   6           HB2      PHE   6  54.730  18.396  -4.723
   38    HB3  PHE   6           HB1      PHE   6  53.634  18.583  -3.334
   39    HD1  PHE   6           HD1      PHE   6  53.895  20.448  -1.751
   40    HD2  PHE   6           HD2      PHE   6  56.521  20.015  -5.150
   41    HE1  PHE   6           HE1      PHE   6  54.698  22.784  -1.427
   42    HE2  PHE   6           HE2      PHE   6  57.323  22.352  -4.825
   43    HZ   PHE   6           HZ       PHE   6  56.382  23.750  -2.989
   44    H    LYS   7           HN       LYS   7  56.855  15.562  -3.228
   45    HA   LYS   7           HA       LYS   7  54.640  13.847  -3.950
   46    HB2  LYS   7           HB2      LYS   7  57.016  13.476  -4.645
   47    HB3  LYS   7           HB1      LYS   7  57.413  13.075  -2.956
   48    HG2  LYS   7           HG2      LYS   7  55.850  11.196  -2.986
   49    HG3  LYS   7           HG1      LYS   7  55.302  11.636  -4.621
   50    HD2  LYS   7           HD2      LYS   7  57.585  11.245  -5.497
   51    HD3  LYS   7           HD1      LYS   7  58.140  10.809  -3.862
   52    HE2  LYS   7           HE2      LYS   7  55.863   9.379  -5.293
   53    HE3  LYS   7           HE1      LYS   7  57.556   8.833  -5.355
   54    HZ1  LYS   7           HZ1      LYS   7  56.054   9.285  -2.828
   55    HZ2  LYS   7           HZ2      LYS   7  57.578   8.559  -3.005
   56    HZ3  LYS   7           HZ3      LYS   7  56.187   7.774  -3.585
   57    H    HIS   8           HN       HIS   8  56.892  13.407  -1.194
   58    HA   HIS   8           HA       HIS   8  54.854  11.938   0.296
   59    HB2  HIS   8           HB2      HIS   8  57.545  13.041   1.198
   60    HB3  HIS   8           HB1      HIS   8  56.558  11.840   2.064
   61    HD1  HIS   8           HD1      HIS   8  59.481  11.814   0.200
   62    HD2  HIS   8           HD2      HIS   8  55.888   9.661  -0.176
   63    HE1  HIS   8           HE1      HIS   8  59.980   9.736  -1.201
   64    H    GLY   9           HN       GLY   9  55.074  15.119  -0.410
   65    HA2  GLY   9           HA1      GLY   9  54.534  16.210   2.277
   66    HA3  GLY   9           HA2      GLY   9  54.574  17.100   0.743
   67    H    ARG  10           HN       ARG  10  52.724  14.792  -0.296
   68    HA   ARG  10           HA       ARG  10  50.246  15.176   1.165
   69    HB2  ARG  10           HB2      ARG  10  49.085  16.454  -0.688
   70    HB3  ARG  10           HB1      ARG  10  50.268  17.402   0.246
   71    HG2  ARG  10           HG2      ARG  10  51.971  17.043  -1.497
   72    HG3  ARG  10           HG1      ARG  10  50.830  16.039  -2.424
   73    HD2  ARG  10           HD2      ARG  10  50.251  18.928  -1.654
   74    HD3  ARG  10           HD1      ARG  10  51.018  18.466  -3.193
   75    HE   ARG  10           HE       ARG  10  48.657  16.914  -2.939
   76   HH11  ARG  10          HH11      ARG  10  49.770  20.135  -3.433
   77   HH12  ARG  10          HH12      ARG  10  48.285  20.686  -4.134
   78   HH21  ARG  10          HH21      ARG  10  46.668  17.642  -3.747
   79   HH22  ARG  10          HH22      ARG  10  46.529  19.273  -4.313
   80    H    HIS  11           HN       HIS  11  51.928  13.073  -0.084
   81    HA   HIS  11           HA       HIS  11  49.723  11.612  -1.319
   82    HB2  HIS  11           HB2      HIS  11  50.601  12.926  -3.275
   83    HB3  HIS  11           HB1      HIS  11  52.183  12.151  -3.026
   84    HD1  HIS  11           HD1      HIS  11  48.699  10.557  -2.805
   85    HD2  HIS  11           HD2      HIS  11  52.260  10.227  -5.016
   86    HE1  HIS  11           HE1      HIS  11  48.434   8.565  -4.384
   87    H    ALA  12           HN       ALA  12  49.929   9.556  -1.444
   88    HA   ALA  12           HA       ALA  12  50.621   7.441  -0.931
   89    HB1  ALA  12           HB1      ALA  12  52.806   8.335  -1.862
   90    HB2  ALA  12           HB2      ALA  12  52.910   6.997  -0.690
   91    HB3  ALA  12           HB3      ALA  12  53.151   8.668  -0.174
   92    H    ALA  13           HN       ALA  13  51.665  10.193   1.020
   93    HA   ALA  13           HA       ALA  13  51.606   8.698   3.536
   94    HB1  ALA  13           HB1      ALA  13  51.132  10.931   4.526
   95    HB2  ALA  13           HB2      ALA  13  50.864  11.616   2.906
   96    HB3  ALA  13           HB3      ALA  13  52.494  11.093   3.393
   97    H    LYS  14           HN       LYS  14  50.280   9.021   0.665
   98    HA   LYS  14           HA       LYS  14  47.314   8.727   1.613
   99    HB2  LYS  14           HB2      LYS  14  48.192  10.578  -0.013
  100    HB3  LYS  14           HB1      LYS  14  48.501   9.206  -1.143
  101    HG2  LYS  14           HG2      LYS  14  46.236   8.992  -1.640
  102    HG3  LYS  14           HG1      LYS  14  45.714   9.306   0.031
  103    HD2  LYS  14           HD2      LYS  14  46.133  11.737  -0.316
  104    HD3  LYS  14           HD1      LYS  14  46.610  11.401  -1.999
  105    HE2  LYS  14           HE2      LYS  14  43.897  10.694  -0.799
  106    HE3  LYS  14           HE1      LYS  14  44.219  12.137  -1.791
  107    HZ1  LYS  14           HZ1      LYS  14  44.837  10.754  -3.622
  108    HZ2  LYS  14           HZ2      LYS  14  43.325  10.223  -3.056
  109    HZ3  LYS  14           HZ3      LYS  14  44.731   9.344  -2.684
  110    H    HIS  15           HN       HIS  15  46.250   7.653  -0.537
  111    HA   HIS  15           HA       HIS  15  45.700   5.482  -1.229
  112    HB2  HIS  15           HB2      HIS  15  47.022   6.621  -3.045
  113    HB3  HIS  15           HB1      HIS  15  48.467   5.767  -2.454
  114    HD1  HIS  15           HD1      HIS  15  48.923   3.812  -3.927
  115    HD2  HIS  15           HD2      HIS  15  44.802   4.404  -3.344
  116    HE1  HIS  15           HE1      HIS  15  47.705   1.900  -5.105
  117    H    ILE  16           HN       ILE  16  47.413   5.655   1.303
  118    HA   ILE  16           HA       ILE  16  47.506   3.052   1.938
  119    HB   ILE  16           HB       ILE  16  49.188   2.415   0.388
  120   HG12  ILE  16          HG12      ILE  16  50.792   3.022   2.903
  121   HG13  ILE  16          HG11      ILE  16  49.552   1.751   2.856
  122   HG21  ILE  16          HG21      ILE  16  49.999   4.610  -0.359
  123   HG22  ILE  16          HG22      ILE  16  51.393   3.727   0.287
  124   HG23  ILE  16          HG23      ILE  16  50.609   4.966   1.268
  125   HD11  ILE  16           HD1      ILE  16  52.217   1.869   1.414
  126   HD12  ILE  16           HD2      ILE  16  50.892   0.906   0.721
  127   HD13  ILE  16           HD3      ILE  16  51.503   0.540   2.349
  128    H    GLY  17           HN       GLY  17  49.216   5.885   2.124
  129    HA2  GLY  17           HA1      GLY  17  49.667   5.643   5.017
  130    HA3  GLY  17           HA2      GLY  17  49.927   7.097   4.029
  131    H    HIS  18           HN       HIS  18  47.214   6.257   2.731
  132    HA   HIS  18           HA       HIS  18  45.535   7.837   4.666
  133    HB2  HIS  18           HB2      HIS  18  45.493   7.245   1.733
  134    HB3  HIS  18           HB1      HIS  18  43.892   7.260   2.497
  135    HD1  HIS  18           HD1      HIS  18  46.665   9.483   3.801
  136    HD2  HIS  18           HD2      HIS  18  43.268   9.798   1.341
  137    HE1  HIS  18           HE1      HIS  18  46.199  11.971   3.461
  138    H    ALA  19           HN       ALA  19  45.487   4.692   2.868
  139    HA   ALA  19           HA       ALA  19  44.620   3.082   4.984
  140    HB1  ALA  19           HB1      ALA  19  42.588   4.201   5.406
  141    HB2  ALA  19           HB2      ALA  19  42.078   2.914   4.298
  142    HB3  ALA  19           HB3      ALA  19  42.321   4.567   3.685
  143    H    ALA  20           HN       ALA  20  45.731   3.489   2.067
  144    HA   ALA  20           HA       ALA  20  46.007   2.125   0.209
  145    HB1  ALA  20           HB1      ALA  20  45.984  -0.236   0.539
  146    HB2  ALA  20           HB2      ALA  20  44.815  -0.114   1.875
  147    HB3  ALA  20           HB3      ALA  20  46.483   0.466   2.095
  148    H    VAL  21           HN       VAL  21  43.269   3.254   1.278
  149    HA   VAL  21           HA       VAL  21  41.686   2.230  -1.037
  150    HB   VAL  21           HB       VAL  21  40.668   2.319   1.844
  151   HG11  VAL  21          HG11      VAL  21  39.286   1.948  -0.842
  152   HG12  VAL  21          HG12      VAL  21  38.841   3.028   0.501
  153   HG13  VAL  21          HG13      VAL  21  38.588   1.277   0.652
  154   HG21  VAL  21          HG21      VAL  21  42.013   0.318   1.384
  155   HG22  VAL  21          HG22      VAL  21  41.114   0.026  -0.124
  156   HG23  VAL  21          HG23      VAL  21  40.294  -0.136   1.447
  157    H    ASN  22           HN       ASN  22  42.862   4.634   0.998
  158    HA   ASN  22           HA       ASN  22  42.784   6.961   0.419
  159    HB2  ASN  22           HB2      ASN  22  41.167   6.464  -1.524
  160    HB3  ASN  22           HB1      ASN  22  39.854   6.672  -0.333
  161   HD21  ASN  22          HD21      ASN  22  39.743   8.817   0.818
  162   HD22  ASN  22          HD22      ASN  22  40.380  10.245  -0.005
  163    H    HIS  23           HN       HIS  23  40.201   5.139   1.939
  164    HA   HIS  23           HA       HIS  23  39.431   5.302   4.139
  165    HB2  HIS  23           HB2      HIS  23  41.684   6.673   4.532
  166    HB3  HIS  23           HB1      HIS  23  40.597   8.077   4.543
  167    HD1  HIS  23           HD1      HIS  23  40.778   4.596   6.192
  168    HD2  HIS  23           HD2      HIS  23  39.601   8.537   7.066
  169    HE1  HIS  23           HE1      HIS  23  39.974   4.631   8.617
  170    H    TYR  24           HN       TYR  24  38.748   6.970   1.471
  171    HA   TYR  24           HA       TYR  24  37.014   9.079   2.339
  172    HB2  TYR  24           HB2      TYR  24  37.811   8.844   0.018
  173    HB3  TYR  24           HB1      TYR  24  36.877   7.340  -0.158
  174    HD1  TYR  24           HD1      TYR  24  36.659  11.028   0.263
  175    HD2  TYR  24           HD2      TYR  24  34.455   7.378  -0.403
  176    HE1  TYR  24           HE1      TYR  24  34.641  12.358  -0.345
  177    HE2  TYR  24           HE2      TYR  24  32.437   8.708  -1.010
  178    HH   TYR  24           HH       TYR  24  32.406  11.685  -1.949
  179    H    LEU  25           HN       LEU  25  36.698   5.612   2.316
  180    HA   LEU  25           HA       LEU  25  33.761   5.634   2.442
  181    HB2  LEU  25           HB2      LEU  25  35.205   3.748   1.500
  182    HB3  LEU  25           HB1      LEU  25  35.662   3.380   3.177
  183    HG   LEU  25           HG       LEU  25  33.049   3.330   3.615
  184   HD11  LEU  25          HD11      LEU  25  33.211   2.940   0.589
  185   HD12  LEU  25          HD12      LEU  25  32.259   4.159   1.468
  186   HD13  LEU  25          HD13      LEU  25  31.823   2.443   1.581
  187   HD21  LEU  25          HD21      LEU  25  34.459   1.151   2.010
  188   HD22  LEU  25          HD22      LEU  25  32.992   0.924   2.994
  189   HD23  LEU  25          HD23      LEU  25  34.531   1.361   3.776
  Start of MODEL   76
    1    H1   GLY   1           HT1      GLY   1  61.034   2.459   0.105
    2    H2   GLY   1           HT2      GLY   1  60.133   3.225   1.325
    3    H3   GLY   1           HT3      GLY   1  61.532   2.344   1.721
    4    HA2  GLY   1           HA1      GLY   1  62.175   4.535   1.834
    5    HA3  GLY   1           HA2      GLY   1  62.792   3.915   0.291
    6    H    TRP   2           HN       TRP   2  61.510   6.555   1.627
    7    HA   TRP   2           HA       TRP   2  59.398   7.210  -0.260
    8    HB2  TRP   2           HB2      TRP   2  59.700   9.528   0.645
    9    HB3  TRP   2           HB1      TRP   2  59.473   8.300   1.912
   10    HD1  TRP   2           HD1      TRP   2  62.032  10.705   0.471
   11    HE1  TRP   2           HE1      TRP   2  64.130  10.795   2.005
   12    HE3  TRP   2           HE3      TRP   2  60.899   6.831   3.621
   13    HZ2  TRP   2           HZ2      TRP   2  65.150   9.362   4.285
   14    HZ3  TRP   2           HZ3      TRP   2  62.448   6.209   5.468
   15    HH2  TRP   2           HH2      TRP   2  64.570   7.470   5.804
   16    H    GLY   3           HN       GLY   3  59.965   9.742  -1.151
   17    HA2  GLY   3           HA1      GLY   3  62.526   9.750  -2.587
   18    HA3  GLY   3           HA2      GLY   3  61.117   9.422  -3.616
   19    H    SER   4           HN       SER   4  60.513  11.368  -0.845
   20    HA   SER   4           HA       SER   4  61.254  13.934  -1.877
   21    HB2  SER   4           HB2      SER   4  59.682  13.709  -3.638
   22    HB3  SER   4           HB1      SER   4  58.480  12.937  -2.582
   23    HG   SER   4           HG       SER   4  59.298  15.640  -2.723
   24    H    ILE   5           HN       ILE   5  61.008  15.467  -0.336
   25    HA   ILE   5           HA       ILE   5  60.286  14.645   2.307
   26    HB   ILE   5           HB       ILE   5  60.338  17.512   1.275
   27   HG12  ILE   5          HG12      ILE   5  62.427  16.064   0.702
   28   HG13  ILE   5          HG11      ILE   5  62.693  17.598   1.547
   29   HG21  ILE   5          HG21      ILE   5  59.450  17.394   3.496
   30   HG22  ILE   5          HG22      ILE   5  61.142  17.919   3.660
   31   HG23  ILE   5          HG23      ILE   5  60.695  16.233   4.012
   32   HD11  ILE   5           HD1      ILE   5  64.007  15.611   2.453
   33   HD12  ILE   5           HD2      ILE   5  62.465  14.927   3.005
   34   HD13  ILE   5           HD3      ILE   5  63.032  16.479   3.657
   35    H    PHE   6           HN       PHE   6  58.502  16.358  -0.247
   36    HA   PHE   6           HA       PHE   6  56.213  16.918   1.479
   37    HB2  PHE   6           HB2      PHE   6  56.566  16.963  -1.544
   38    HB3  PHE   6           HB1      PHE   6  55.098  17.503  -0.692
   39    HD1  PHE   6           HD1      PHE   6  58.589  18.298  -1.528
   40    HD2  PHE   6           HD2      PHE   6  55.188  19.451   0.868
   41    HE1  PHE   6           HE1      PHE   6  59.640  20.517  -1.101
   42    HE2  PHE   6           HE2      PHE   6  56.240  21.670   1.292
   43    HZ   PHE   6           HZ       PHE   6  58.488  22.183   0.350
   44    H    LYS   7           HN       LYS   7  57.394  14.044   0.608
   45    HA   LYS   7           HA       LYS   7  56.468  11.929   0.389
   46    HB2  LYS   7           HB2      LYS   7  53.807  13.122   1.232
   47    HB3  LYS   7           HB1      LYS   7  54.422  11.476   1.512
   48    HG2  LYS   7           HG2      LYS   7  55.448  14.060   2.771
   49    HG3  LYS   7           HG1      LYS   7  54.599  12.729   3.590
   50    HD2  LYS   7           HD2      LYS   7  56.539  11.217   2.800
   51    HD3  LYS   7           HD1      LYS   7  57.401  12.724   2.402
   52    HE2  LYS   7           HE2      LYS   7  57.002  13.493   4.777
   53    HE3  LYS   7           HE1      LYS   7  56.351  11.875   5.134
   54    HZ1  LYS   7           HZ1      LYS   7  58.923  12.520   5.386
   55    HZ2  LYS   7           HZ2      LYS   7  58.931  11.946   3.786
   56    HZ3  LYS   7           HZ3      LYS   7  58.386  10.948   5.048
   57    H    HIS   8           HN       HIS   8  56.829  12.474  -1.962
   58    HA   HIS   8           HA       HIS   8  56.083  12.499  -4.163
   59    HB2  HIS   8           HB2      HIS   8  53.927  10.812  -2.837
   60    HB3  HIS   8           HB1      HIS   8  54.122  10.972  -4.600
   61    HD1  HIS   8           HD1      HIS   8  55.449   9.201  -1.616
   62    HD2  HIS   8           HD2      HIS   8  56.754  10.001  -5.533
   63    HE1  HIS   8           HE1      HIS   8  57.368   7.592  -2.123
   64    H    GLY   9           HN       GLY   9  55.245  14.746  -2.492
   65    HA2  GLY   9           HA1      GLY   9  53.914  16.616  -2.775
   66    HA3  GLY   9           HA2      GLY   9  53.385  15.933  -4.325
   67    H    ARG  10           HN       ARG  10  52.990  15.151  -0.838
   68    HA   ARG  10           HA       ARG  10  51.095  14.543   0.346
   69    HB2  ARG  10           HB2      ARG  10  49.961  16.568  -1.617
   70    HB3  ARG  10           HB1      ARG  10  48.957  15.808  -0.360
   71    HG2  ARG  10           HG2      ARG  10  49.839  17.954   0.454
   72    HG3  ARG  10           HG1      ARG  10  50.552  16.615   1.379
   73    HD2  ARG  10           HD2      ARG  10  52.650  16.824   0.304
   74    HD3  ARG  10           HD1      ARG  10  51.965  17.726  -1.070
   75    HE   ARG  10           HE       ARG  10  52.839  18.872   1.456
   76   HH11  ARG  10          HH11      ARG  10  50.102  19.792   1.588
   77   HH12  ARG  10          HH12      ARG  10  50.075  21.188   0.564
   78   HH21  ARG  10          HH21      ARG  10  53.033  20.383  -1.057
   79   HH22  ARG  10          HH22      ARG  10  51.735  21.523  -0.934
   80    H    HIS  11           HN       HIS  11  51.869  12.630  -1.409
   81    HA   HIS  11           HA       HIS  11  49.288  11.337  -1.984
   82    HB2  HIS  11           HB2      HIS  11  49.855  12.566  -4.116
   83    HB3  HIS  11           HB1      HIS  11  51.388  11.672  -4.174
   84    HD1  HIS  11           HD1      HIS  11  50.151   8.878  -3.189
   85    HD2  HIS  11           HD2      HIS  11  48.626  11.287  -6.280
   86    HE1  HIS  11           HE1      HIS  11  48.838   7.357  -4.765
   87    H    ALA  12           HN       ALA  12  50.138  10.518  -0.122
   88    HA   ALA  12           HA       ALA  12  50.947   7.852  -0.367
   89    HB1  ALA  12           HB1      ALA  12  52.908   9.921   0.349
   90    HB2  ALA  12           HB2      ALA  12  53.110   8.790  -1.008
   91    HB3  ALA  12           HB3      ALA  12  53.231   8.215   0.669
   92    H    ALA  13           HN       ALA  13  51.022  10.986   1.111
   93    HA   ALA  13           HA       ALA  13  50.637  10.039   3.871
   94    HB1  ALA  13           HB1      ALA  13  51.023  12.428   3.729
   95    HB2  ALA  13           HB2      ALA  13  49.257  12.289   3.906
   96    HB3  ALA  13           HB3      ALA  13  49.972  12.585   2.302
   97    H    LYS  14           HN       LYS  14  49.956   9.607   0.759
   98    HA   LYS  14           HA       LYS  14  46.989   8.765   1.181
   99    HB2  LYS  14           HB2      LYS  14  47.797  10.510  -0.563
  100    HB3  LYS  14           HB1      LYS  14  48.686   9.124  -1.325
  101    HG2  LYS  14           HG2      LYS  14  46.704   8.322  -2.275
  102    HG3  LYS  14           HG1      LYS  14  45.770   8.553  -0.786
  103    HD2  LYS  14           HD2      LYS  14  44.772   9.959  -2.447
  104    HD3  LYS  14           HD1      LYS  14  45.644  11.031  -1.336
  105    HE2  LYS  14           HE2      LYS  14  47.189  11.649  -2.958
  106    HE3  LYS  14           HE1      LYS  14  47.172  10.054  -3.744
  107    HZ1  LYS  14           HZ1      LYS  14  44.623  11.210  -3.973
  108    HZ2  LYS  14           HZ2      LYS  14  45.729  10.827  -5.204
  109    HZ3  LYS  14           HZ3      LYS  14  45.769  12.359  -4.469
  110    H    HIS  15           HN       HIS  15  46.745   7.140  -0.957
  111    HA   HIS  15           HA       HIS  15  46.819   4.825  -1.272
  112    HB2  HIS  15           HB2      HIS  15  48.315   5.935  -2.952
  113    HB3  HIS  15           HB1      HIS  15  49.697   5.575  -1.890
  114    HD1  HIS  15           HD1      HIS  15  50.862   3.449  -2.455
  115    HD2  HIS  15           HD2      HIS  15  46.757   3.269  -3.350
  116    HE1  HIS  15           HE1      HIS  15  50.411   1.164  -3.506
  117    H    ILE  16           HN       ILE  16  47.701   5.765   1.487
  118    HA   ILE  16           HA       ILE  16  48.129   3.401   2.659
  119    HB   ILE  16           HB       ILE  16  50.251   2.952   1.663
  120   HG12  ILE  16          HG12      ILE  16  51.841   2.990   3.532
  121   HG13  ILE  16          HG11      ILE  16  50.828   4.160   4.402
  122   HG21  ILE  16          HG21      ILE  16  50.810   5.173   0.747
  123   HG22  ILE  16          HG22      ILE  16  52.131   4.651   1.816
  124   HG23  ILE  16          HG23      ILE  16  50.946   5.823   2.395
  125   HD11  ILE  16           HD1      ILE  16  49.055   2.556   4.669
  126   HD12  ILE  16           HD2      ILE  16  50.556   1.694   5.071
  127   HD13  ILE  16           HD3      ILE  16  49.787   1.448   3.487
  128    H    GLY  17           HN       GLY  17  49.230   6.527   2.639
  129    HA2  GLY  17           HA1      GLY  17  48.938   6.862   5.530
  130    HA3  GLY  17           HA2      GLY  17  49.172   8.159   4.342
  131    H    HIS  18           HN       HIS  18  47.029   6.526   2.713
  132    HA   HIS  18           HA       HIS  18  44.685   7.968   3.964
  133    HB2  HIS  18           HB2      HIS  18  45.409   7.026   1.204
  134    HB3  HIS  18           HB1      HIS  18  43.693   6.892   1.635
  135    HD1  HIS  18           HD1      HIS  18  45.687   9.673   3.191
  136    HD2  HIS  18           HD2      HIS  18  43.065   9.126  -0.053
  137    HE1  HIS  18           HE1      HIS  18  45.036  11.992   2.339
  138    H    ALA  19           HN       ALA  19  45.696   4.691   2.789
  139    HA   ALA  19           HA       ALA  19  44.547   3.238   4.889
  140    HB1  ALA  19           HB1      ALA  19  42.502   4.018   2.803
  141    HB2  ALA  19           HB2      ALA  19  42.314   3.877   4.570
  142    HB3  ALA  19           HB3      ALA  19  42.389   2.415   3.567
  143    H    ALA  20           HN       ALA  20  46.319   3.481   2.263
  144    HA   ALA  20           HA       ALA  20  47.387   1.948   0.887
  145    HB1  ALA  20           HB1      ALA  20  47.748  -0.247   1.702
  146    HB2  ALA  20           HB2      ALA  20  46.203  -0.269   2.584
  147    HB3  ALA  20           HB3      ALA  20  47.543   0.748   3.162
  148    H    VAL  21           HN       VAL  21  44.250   2.474   1.033
  149    HA   VAL  21           HA       VAL  21  43.677   0.887  -1.420
  150    HB   VAL  21           HB       VAL  21  41.810   0.899   0.999
  151   HG11  VAL  21          HG11      VAL  21  40.487   0.761  -0.984
  152   HG12  VAL  21          HG12      VAL  21  40.679  -0.925  -0.467
  153   HG13  VAL  21          HG13      VAL  21  41.665  -0.289  -1.803
  154   HG21  VAL  21          HG21      VAL  21  43.705  -0.545   1.486
  155   HG22  VAL  21          HG22      VAL  21  43.634  -1.269  -0.138
  156   HG23  VAL  21          HG23      VAL  21  42.337  -1.585   1.039
  157    H    ASN  22           HN       ASN  22  43.599   3.628   0.510
  158    HA   ASN  22           HA       ASN  22  43.091   5.796  -0.363
  159    HB2  ASN  22           HB2      ASN  22  42.239   4.767  -2.566
  160    HB3  ASN  22           HB1      ASN  22  40.643   4.678  -1.776
  161   HD21  ASN  22          HD21      ASN  22  40.009   6.273  -3.555
  162   HD22  ASN  22          HD22      ASN  22  40.335   7.984  -3.261
  163    H    HIS  23           HN       HIS  23  40.684   3.430   0.685
  164    HA   HIS  23           HA       HIS  23  40.013   4.878   3.053
  165    HB2  HIS  23           HB2      HIS  23  37.633   5.498   2.420
  166    HB3  HIS  23           HB1      HIS  23  38.887   6.516   1.680
  167    HD1  HIS  23           HD1      HIS  23  39.381   6.201  -0.874
  168    HD2  HIS  23           HD2      HIS  23  36.166   3.923   0.595
  169    HE1  HIS  23           HE1      HIS  23  38.119   5.272  -2.893
  170    H    TYR  24           HN       TYR  24  40.627   2.417   3.126
  171    HA   TYR  24           HA       TYR  24  38.834   0.397   2.356
  172    HB2  TYR  24           HB2      TYR  24  41.064   0.013   3.393
  173    HB3  TYR  24           HB1      TYR  24  40.401   0.533   4.962
  174    HD1  TYR  24           HD1      TYR  24  40.210  -2.055   2.287
  175    HD2  TYR  24           HD2      TYR  24  38.924  -0.901   6.244
  176    HE1  TYR  24           HE1      TYR  24  39.321  -4.352   2.669
  177    HE2  TYR  24           HE2      TYR  24  38.037  -3.198   6.624
  178    HH   TYR  24           HH       TYR  24  37.899  -5.547   3.962
  179    H    LEU  25           HN       LEU  25  38.647   2.671   5.064
  180    HA   LEU  25           HA       LEU  25  36.655   1.414   6.610
  181    HB2  LEU  25           HB2      LEU  25  37.981   3.690   6.905
  182    HB3  LEU  25           HB1      LEU  25  36.559   4.407   6.117
  183    HG   LEU  25           HG       LEU  25  36.574   2.716   8.663
  184   HD11  LEU  25          HD11      LEU  25  35.926   5.652   8.134
  185   HD12  LEU  25          HD12      LEU  25  37.377   5.033   8.958
  186   HD13  LEU  25          HD13      LEU  25  35.774   4.828   9.704
  187   HD21  LEU  25          HD21      LEU  25  34.093   3.490   8.686
  188   HD22  LEU  25          HD22      LEU  25  34.525   2.181   7.564
  189   HD23  LEU  25          HD23      LEU  25  34.317   3.842   6.955
  Start of MODEL   77
    1    H1   GLY   1           HT1      GLY   1  56.595  16.961   7.818
    2    H2   GLY   1           HT2      GLY   1  56.008  16.925   6.223
    3    H3   GLY   1           HT3      GLY   1  55.723  18.279   7.209
    4    HA2  GLY   1           HA1      GLY   1  57.411  18.827   5.696
    5    HA3  GLY   1           HA2      GLY   1  58.104  18.676   7.323
    6    H    TRP   2           HN       TRP   2  59.272  16.756   7.886
    7    HA   TRP   2           HA       TRP   2  60.935  15.211   7.410
    8    HB2  TRP   2           HB2      TRP   2  58.854  13.936   6.728
    9    HB3  TRP   2           HB1      TRP   2  59.171  14.443   5.052
   10    HD1  TRP   2           HD1      TRP   2  60.795  13.003   3.709
   11    HE1  TRP   2           HE1      TRP   2  62.456  11.067   4.216
   12    HE3  TRP   2           HE3      TRP   2  60.539  13.040   8.821
   13    HZ2  TRP   2           HZ2      TRP   2  63.510   9.738   6.544
   14    HZ3  TRP   2           HZ3      TRP   2  61.880  11.429  10.165
   15    HH2  TRP   2           HH2      TRP   2  63.365   9.779   9.032
   16    H    GLY   3           HN       GLY   3  60.551  17.885   5.719
   17    HA2  GLY   3           HA1      GLY   3  61.943  19.010   4.250
   18    HA3  GLY   3           HA2      GLY   3  63.092  17.664   4.385
   19    H    SER   4           HN       SER   4  60.074  16.473   3.525
   20    HA   SER   4           HA       SER   4  60.921  15.574   0.970
   21    HB2  SER   4           HB2      SER   4  58.704  14.785   0.681
   22    HB3  SER   4           HB1      SER   4  58.960  14.760   2.439
   23    HG   SER   4           HG       SER   4  57.055  15.983   1.152
   24    H    ILE   5           HN       ILE   5  58.749  16.168  -0.739
   25    HA   ILE   5           HA       ILE   5  58.700  19.098  -1.119
   26    HB   ILE   5           HB       ILE   5  59.567  18.803  -3.540
   27   HG12  ILE   5          HG12      ILE   5  60.734  16.273  -2.282
   28   HG13  ILE   5          HG11      ILE   5  59.440  16.297  -3.501
   29   HG21  ILE   5          HG21      ILE   5  61.853  19.186  -2.885
   30   HG22  ILE   5          HG22      ILE   5  61.644  18.276  -1.371
   31   HG23  ILE   5          HG23      ILE   5  60.848  19.854  -1.581
   32   HD11  ILE   5           HD1      ILE   5  61.398  15.942  -4.784
   33   HD12  ILE   5           HD2      ILE   5  62.355  17.084  -3.814
   34   HD13  ILE   5           HD3      ILE   5  61.120  17.692  -4.945
   35    H    PHE   6           HN       PHE   6  56.511  17.970  -0.536
   36    HA   PHE   6           HA       PHE   6  54.339  17.728  -1.302
   37    HB2  PHE   6           HB2      PHE   6  55.223  17.822  -4.199
   38    HB3  PHE   6           HB1      PHE   6  53.714  18.403  -3.459
   39    HD1  PHE   6           HD1      PHE   6  54.339  20.097  -1.307
   40    HD2  PHE   6           HD2      PHE   6  56.585  19.597  -4.963
   41    HE1  PHE   6           HE1      PHE   6  55.320  22.367  -1.017
   42    HE2  PHE   6           HE2      PHE   6  57.563  21.868  -4.670
   43    HZ   PHE   6           HZ       PHE   6  56.916  23.261  -2.709
   44    H    LYS   7           HN       LYS   7  56.917  15.877  -2.861
   45    HA   LYS   7           HA       LYS   7  55.354  13.766  -3.939
   46    HB2  LYS   7           HB2      LYS   7  58.144  13.780  -2.725
   47    HB3  LYS   7           HB1      LYS   7  57.443  12.379  -3.571
   48    HG2  LYS   7           HG2      LYS   7  57.172  13.686  -5.616
   49    HG3  LYS   7           HG1      LYS   7  57.715  15.163  -4.785
   50    HD2  LYS   7           HD2      LYS   7  59.925  14.123  -4.372
   51    HD3  LYS   7           HD1      LYS   7  59.386  12.645  -5.204
   52    HE2  LYS   7           HE2      LYS   7  59.138  13.825  -7.301
   53    HE3  LYS   7           HE1      LYS   7  59.401  15.396  -6.510
   54    HZ1  LYS   7           HZ1      LYS   7  61.327  13.346  -7.270
   55    HZ2  LYS   7           HZ2      LYS   7  61.607  14.109  -5.779
   56    HZ3  LYS   7           HZ3      LYS   7  61.502  15.032  -7.201
   57    H    HIS   8           HN       HIS   8  57.371  13.274  -1.037
   58    HA   HIS   8           HA       HIS   8  55.474  11.285  -0.025
   59    HB2  HIS   8           HB2      HIS   8  57.963  12.514   1.230
   60    HB3  HIS   8           HB1      HIS   8  57.073  11.107   1.859
   61    HD1  HIS   8           HD1      HIS   8  57.408  11.499  -1.864
   62    HD2  HIS   8           HD2      HIS   8  59.294   9.385   1.246
   63    HE1  HIS   8           HE1      HIS   8  58.924   9.748  -2.943
   64    H    GLY   9           HN       GLY   9  53.756  13.142  -0.135
   65    HA2  GLY   9           HA1      GLY   9  53.200  13.845   2.634
   66    HA3  GLY   9           HA2      GLY   9  53.624  15.261   1.652
   67    H    ARG  10           HN       ARG  10  52.510  14.437  -0.810
   68    HA   ARG  10           HA       ARG  10  49.587  14.702  -0.149
   69    HB2  ARG  10           HB2      ARG  10  51.231  15.415  -2.609
   70    HB3  ARG  10           HB1      ARG  10  49.453  15.456  -2.572
   71    HG2  ARG  10           HG2      ARG  10  49.493  17.076  -0.728
   72    HG3  ARG  10           HG1      ARG  10  51.270  16.994  -0.667
   73    HD2  ARG  10           HD2      ARG  10  50.387  18.986  -1.945
   74    HD3  ARG  10           HD1      ARG  10  51.454  17.932  -2.901
   75    HE   ARG  10           HE       ARG  10  49.604  17.433  -4.280
   76   HH11  ARG  10          HH11      ARG  10  48.604  18.627  -1.205
   77   HH12  ARG  10          HH12      ARG  10  46.939  18.773  -1.655
   78   HH21  ARG  10          HH21      ARG  10  47.441  17.663  -4.900
   79   HH22  ARG  10          HH22      ARG  10  46.280  18.227  -3.746
   80    H    HIS  11           HN       HIS  11  51.841  12.411  -0.901
   81    HA   HIS  11           HA       HIS  11  49.743  10.567  -1.895
   82    HB2  HIS  11           HB2      HIS  11  52.338  11.096  -3.404
   83    HB3  HIS  11           HB1      HIS  11  51.256   9.715  -3.706
   84    HD1  HIS  11           HD1      HIS  11  48.988  10.160  -4.871
   85    HD2  HIS  11           HD2      HIS  11  51.336  13.605  -4.313
   86    HE1  HIS  11           HE1      HIS  11  47.918  12.040  -6.231
   87    H    ALA  12           HN       ALA  12  50.003   8.566  -1.482
   88    HA   ALA  12           HA       ALA  12  50.711   6.659  -0.433
   89    HB1  ALA  12           HB1      ALA  12  52.956   7.434  -1.340
   90    HB2  ALA  12           HB2      ALA  12  52.972   6.402   0.113
   91    HB3  ALA  12           HB3      ALA  12  53.112   8.155   0.251
   92    H    ALA  13           HN       ALA  13  51.452   9.853   0.882
   93    HA   ALA  13           HA       ALA  13  51.177   8.991   3.670
   94    HB1  ALA  13           HB1      ALA  13  50.539  11.359   4.050
   95    HB2  ALA  13           HB2      ALA  13  50.393  11.630   2.297
   96    HB3  ALA  13           HB3      ALA  13  51.991  11.336   3.023
   97    H    LYS  14           HN       LYS  14  50.156   8.542   0.693
   98    HA   LYS  14           HA       LYS  14  47.116   8.310   1.395
   99    HB2  LYS  14           HB2      LYS  14  48.099   9.773  -0.541
  100    HB3  LYS  14           HB1      LYS  14  48.567   8.194  -1.273
  101    HG2  LYS  14           HG2      LYS  14  46.376   7.742  -1.914
  102    HG3  LYS  14           HG1      LYS  14  45.672   8.403  -0.421
  103    HD2  LYS  14           HD2      LYS  14  45.924  10.686  -1.270
  104    HD3  LYS  14           HD1      LYS  14  46.766  10.086  -2.720
  105    HE2  LYS  14           HE2      LYS  14  44.438  10.503  -3.304
  106    HE3  LYS  14           HE1      LYS  14  44.705   8.744  -3.282
  107    HZ1  LYS  14           HZ1      LYS  14  43.689   8.576  -1.170
  108    HZ2  LYS  14           HZ2      LYS  14  42.658   9.549  -2.107
  109    HZ3  LYS  14           HZ3      LYS  14  43.672  10.257  -0.942
  110    H    HIS  15           HN       HIS  15  46.322   6.696  -0.526
  111    HA   HIS  15           HA       HIS  15  45.928   4.395  -0.731
  112    HB2  HIS  15           HB2      HIS  15  48.785   4.688  -1.732
  113    HB3  HIS  15           HB1      HIS  15  47.666   3.366  -2.148
  114    HD1  HIS  15           HD1      HIS  15  45.116   4.546  -2.922
  115    HD2  HIS  15           HD2      HIS  15  48.698   6.607  -3.700
  116    HE1  HIS  15           HE1      HIS  15  44.648   6.196  -4.815
  117    H    ILE  16           HN       ILE  16  47.354   5.266   1.846
  118    HA   ILE  16           HA       ILE  16  47.459   2.894   3.098
  119    HB   ILE  16           HB       ILE  16  49.320   2.022   1.896
  120   HG12  ILE  16          HG12      ILE  16  51.135   1.865   3.545
  121   HG13  ILE  16          HG11      ILE  16  50.458   3.231   4.455
  122   HG21  ILE  16          HG21      ILE  16  50.548   4.778   2.290
  123   HG22  ILE  16          HG22      ILE  16  50.143   4.012   0.744
  124   HG23  ILE  16          HG23      ILE  16  51.483   3.387   1.730
  125   HD11  ILE  16           HD1      ILE  16  48.485   1.979   5.034
  126   HD12  ILE  16           HD2      ILE  16  49.860   0.889   5.320
  127   HD13  ILE  16           HD3      ILE  16  48.866   0.703   3.855
  128    H    GLY  17           HN       GLY  17  49.067   5.771   2.758
  129    HA2  GLY  17           HA1      GLY  17  49.185   6.270   5.646
  130    HA3  GLY  17           HA2      GLY  17  49.514   7.450   4.361
  131    H    HIS  18           HN       HIS  18  46.965   6.171   3.055
  132    HA   HIS  18           HA       HIS  18  45.062   8.099   4.368
  133    HB2  HIS  18           HB2      HIS  18  45.338   6.808   1.685
  134    HB3  HIS  18           HB1      HIS  18  43.666   6.908   2.271
  135    HD1  HIS  18           HD1      HIS  18  46.227   9.546   3.200
  136    HD2  HIS  18           HD2      HIS  18  42.912   9.086   0.662
  137    HE1  HIS  18           HE1      HIS  18  45.694  11.844   2.219
  138    H    ALA  19           HN       ALA  19  45.337   4.608   3.473
  139    HA   ALA  19           HA       ALA  19  44.273   3.547   5.822
  140    HB1  ALA  19           HB1      ALA  19  42.107   4.574   3.986
  141    HB2  ALA  19           HB2      ALA  19  42.162   4.557   5.766
  142    HB3  ALA  19           HB3      ALA  19  41.823   3.059   4.876
  143    H    ALA  20           HN       ALA  20  45.639   3.297   2.972
  144    HA   ALA  20           HA       ALA  20  46.229   1.516   1.611
  145    HB1  ALA  20           HB1      ALA  20  44.919  -0.348   3.614
  146    HB2  ALA  20           HB2      ALA  20  46.479   0.441   3.941
  147    HB3  ALA  20           HB3      ALA  20  46.311  -0.656   2.550
  148    H    VAL  21           HN       VAL  21  43.289   2.633   2.080
  149    HA   VAL  21           HA       VAL  21  42.115   0.991  -0.121
  150    HB   VAL  21           HB       VAL  21  40.620   1.624   2.467
  151   HG11  VAL  21          HG11      VAL  21  38.962  -0.043   1.349
  152   HG12  VAL  21          HG12      VAL  21  39.866   0.266  -0.152
  153   HG13  VAL  21          HG13      VAL  21  39.040   1.602   0.683
  154   HG21  VAL  21          HG21      VAL  21  42.251  -0.152   2.871
  155   HG22  VAL  21          HG22      VAL  21  41.764  -0.992   1.381
  156   HG23  VAL  21          HG23      VAL  21  40.639  -0.887   2.755
  157    H    ASN  22           HN       ASN  22  42.824   3.865   1.459
  158    HA   ASN  22           HA       ASN  22  42.646   5.993   0.346
  159    HB2  ASN  22           HB2      ASN  22  41.253   4.986  -1.557
  160    HB3  ASN  22           HB1      ASN  22  39.824   5.268  -0.527
  161   HD21  ASN  22          HD21      ASN  22  41.598   6.664  -3.005
  162   HD22  ASN  22          HD22      ASN  22  41.227   8.359  -2.677
  163    H    HIS  23           HN       HIS  23  40.051   4.314   2.050
  164    HA   HIS  23           HA       HIS  23  40.095   6.202   4.219
  165    HB2  HIS  23           HB2      HIS  23  37.654   6.993   3.830
  166    HB3  HIS  23           HB1      HIS  23  38.937   7.775   2.878
  167    HD1  HIS  23           HD1      HIS  23  38.459   4.384   1.655
  168    HD2  HIS  23           HD2      HIS  23  36.476   8.048   1.085
  169    HE1  HIS  23           HE1      HIS  23  37.098   4.186  -0.498
  170    H    TYR  24           HN       TYR  24  36.943   5.117   3.216
  171    HA   TYR  24           HA       TYR  24  35.541   3.518   4.140
  172    HB2  TYR  24           HB2      TYR  24  37.146   2.044   2.878
  173    HB3  TYR  24           HB1      TYR  24  38.074   1.849   4.384
  174    HD1  TYR  24           HD1      TYR  24  37.375   0.280   6.049
  175    HD2  TYR  24           HD2      TYR  24  34.672   1.382   2.869
  176    HE1  TYR  24           HE1      TYR  24  35.797  -1.507   6.771
  177    HE2  TYR  24           HE2      TYR  24  33.094  -0.404   3.591
  178    HH   TYR  24           HH       TYR  24  32.623  -1.897   5.374
  179    H    LEU  25           HN       LEU  25  37.547   5.275   5.874
  180    HA   LEU  25           HA       LEU  25  37.707   5.716   8.139
  181    HB2  LEU  25           HB2      LEU  25  35.174   4.961   7.911
  182    HB3  LEU  25           HB1      LEU  25  35.722   3.518   8.790
  183    HG   LEU  25           HG       LEU  25  35.978   6.419   9.706
  184   HD11  LEU  25          HD11      LEU  25  34.453   5.670  11.512
  185   HD12  LEU  25          HD12      LEU  25  34.387   4.048  10.782
  186   HD13  LEU  25          HD13      LEU  25  33.711   5.445   9.911
  187   HD21  LEU  25          HD21      LEU  25  37.934   5.322  10.528
  188   HD22  LEU  25          HD22      LEU  25  37.054   3.806  10.844
  189   HD23  LEU  25          HD23      LEU  25  36.775   5.232  11.873
  Start of MODEL   78
    1    H1   GLY   1           HT1      GLY   1  69.710  17.984   0.467
    2    H2   GLY   1           HT2      GLY   1  68.520  18.928  -0.295
    3    H3   GLY   1           HT3      GLY   1  68.987  17.437  -0.963
    4    HA2  GLY   1           HA1      GLY   1  68.211  16.373   1.120
    5    HA3  GLY   1           HA2      GLY   1  67.485  17.945   1.510
    6    H    TRP   2           HN       TRP   2  65.404  18.075   1.057
    7    HA   TRP   2           HA       TRP   2  63.354  17.587   0.075
    8    HB2  TRP   2           HB2      TRP   2  65.159  17.659  -2.374
    9    HB3  TRP   2           HB1      TRP   2  63.382  17.594  -2.456
   10    HD1  TRP   2           HD1      TRP   2  66.191  19.815  -0.987
   11    HE1  TRP   2           HE1      TRP   2  65.354  22.274  -0.868
   12    HE3  TRP   2           HE3      TRP   2  61.364  19.098  -2.535
   13    HZ2  TRP   2           HZ2      TRP   2  62.907  23.704  -1.384
   14    HZ3  TRP   2           HZ3      TRP   2  59.796  21.024  -2.714
   15    HH2  TRP   2           HH2      TRP   2  60.562  23.324  -2.141
   16    H    GLY   3           HN       GLY   3  64.938  15.833  -2.519
   17    HA2  GLY   3           HA1      GLY   3  64.874  13.598  -3.104
   18    HA3  GLY   3           HA2      GLY   3  64.847  13.221  -1.370
   19    H    SER   4           HN       SER   4  62.374  15.257  -2.766
   20    HA   SER   4           HA       SER   4  60.511  13.126  -3.387
   21    HB2  SER   4           HB2      SER   4  60.263  14.507  -0.691
   22    HB3  SER   4           HB1      SER   4  58.924  13.647  -1.482
   23    HG   SER   4           HG       SER   4  59.850  12.069  -0.354
   24    H    ILE   5           HN       ILE   5  60.056  14.288  -5.222
   25    HA   ILE   5           HA       ILE   5  59.420  17.130  -5.105
   26    HB   ILE   5           HB       ILE   5  58.548  16.634  -7.520
   27   HG12  ILE   5          HG12      ILE   5  60.051  14.024  -7.009
   28   HG13  ILE   5          HG11      ILE   5  58.280  14.136  -6.975
   29   HG21  ILE   5          HG21      ILE   5  60.835  16.566  -8.395
   30   HG22  ILE   5          HG22      ILE   5  61.444  15.935  -6.847
   31   HG23  ILE   5          HG23      ILE   5  60.801  17.591  -6.943
   32   HD11  ILE   5           HD1      ILE   5  60.160  14.523  -9.325
   33   HD12  ILE   5           HD2      ILE   5  58.518  15.209  -9.354
   34   HD13  ILE   5           HD3      ILE   5  58.747  13.455  -9.192
   35    H    PHE   6           HN       PHE   6  57.829  17.082  -3.404
   36    HA   PHE   6           HA       PHE   6  55.638  17.220  -2.682
   37    HB2  PHE   6           HB2      PHE   6  54.811  16.961  -5.592
   38    HB3  PHE   6           HB1      PHE   6  53.944  17.777  -4.269
   39    HD1  PHE   6           HD1      PHE   6  54.910  19.860  -3.233
   40    HD2  PHE   6           HD2      PHE   6  56.584  18.076  -6.790
   41    HE1  PHE   6           HE1      PHE   6  56.125  21.979  -3.725
   42    HE2  PHE   6           HE2      PHE   6  57.798  20.196  -7.282
   43    HZ   PHE   6           HZ       PHE   6  57.620  22.124  -5.714
   44    H    LYS   7           HN       LYS   7  56.959  14.493  -3.835
   45    HA   LYS   7           HA       LYS   7  54.596  12.822  -4.169
   46    HB2  LYS   7           HB2      LYS   7  57.542  12.252  -3.701
   47    HB3  LYS   7           HB1      LYS   7  56.338  10.948  -3.815
   48    HG2  LYS   7           HG2      LYS   7  56.415  13.072  -5.987
   49    HG3  LYS   7           HG1      LYS   7  57.640  11.785  -5.997
   50    HD2  LYS   7           HD2      LYS   7  55.818  10.075  -5.953
   51    HD3  LYS   7           HD1      LYS   7  54.612  11.382  -6.021
   52    HE2  LYS   7           HE2      LYS   7  55.468  12.130  -8.180
   53    HE3  LYS   7           HE1      LYS   7  56.797  10.949  -8.100
   54    HZ1  LYS   7           HZ1      LYS   7  54.214  10.566  -9.093
   55    HZ2  LYS   7           HZ2      LYS   7  54.350   9.617  -7.690
   56    HZ3  LYS   7           HZ3      LYS   7  55.462   9.424  -8.959
   57    H    HIS   8           HN       HIS   8  57.117  12.913  -1.600
   58    HA   HIS   8           HA       HIS   8  55.388  11.443   0.243
   59    HB2  HIS   8           HB2      HIS   8  57.882  11.277   0.253
   60    HB3  HIS   8           HB1      HIS   8  57.962  12.971   0.793
   61    HD1  HIS   8           HD1      HIS   8  56.960   9.496   1.922
   62    HD2  HIS   8           HD2      HIS   8  57.313  13.370   3.515
   63    HE1  HIS   8           HE1      HIS   8  56.658   9.310   4.452
   64    H    GLY   9           HN       GLY   9  53.639  13.202  -0.246
   65    HA2  GLY   9           HA1      GLY   9  53.305  14.699   2.176
   66    HA3  GLY   9           HA2      GLY   9  53.823  15.790   0.877
   67    H    ARG  10           HN       ARG  10  52.498  14.152  -1.208
   68    HA   ARG  10           HA       ARG  10  49.609  14.721  -0.541
   69    HB2  ARG  10           HB2      ARG  10  51.086  15.379  -3.123
   70    HB3  ARG  10           HB1      ARG  10  49.335  15.554  -2.859
   71    HG2  ARG  10           HG2      ARG  10  49.729  17.175  -1.062
   72    HG3  ARG  10           HG1      ARG  10  51.489  16.953  -1.215
   73    HD2  ARG  10           HD2      ARG  10  51.482  17.880  -3.454
   74    HD3  ARG  10           HD1      ARG  10  49.704  17.908  -3.491
   75    HE   ARG  10           HE       ARG  10  49.789  19.930  -2.276
   76   HH11  ARG  10          HH11      ARG  10  51.304  18.844   0.071
   77   HH12  ARG  10          HH12      ARG  10  52.753  19.792   0.036
   78   HH21  ARG  10          HH21      ARG  10  52.283  20.876  -3.223
   79   HH22  ARG  10          HH22      ARG  10  53.307  20.942  -1.829
   80    H    HIS  11           HN       HIS  11  51.782  12.390  -1.116
   81    HA   HIS  11           HA       HIS  11  49.720  10.560  -2.123
   82    HB2  HIS  11           HB2      HIS  11  52.258  11.019  -3.747
   83    HB3  HIS  11           HB1      HIS  11  51.054   9.740  -4.037
   84    HD1  HIS  11           HD1      HIS  11  48.518  10.637  -4.542
   85    HD2  HIS  11           HD2      HIS  11  51.658  13.391  -5.043
   86    HE1  HIS  11           HE1      HIS  11  47.613  12.578  -5.935
   87    H    ALA  12           HN       ALA  12  50.012   8.558  -1.743
   88    HA   ALA  12           HA       ALA  12  50.769   6.650  -0.740
   89    HB1  ALA  12           HB1      ALA  12  53.059   6.397  -0.312
   90    HB2  ALA  12           HB2      ALA  12  53.200   8.149  -0.174
   91    HB3  ALA  12           HB3      ALA  12  52.954   7.417  -1.763
   92    H    ALA  13           HN       ALA  13  51.572   9.824   0.565
   93    HA   ALA  13           HA       ALA  13  51.443   8.942   3.354
   94    HB1  ALA  13           HB1      ALA  13  50.742  11.588   1.946
   95    HB2  ALA  13           HB2      ALA  13  52.232  11.265   2.865
   96    HB3  ALA  13           HB3      ALA  13  50.665  11.340   3.706
   97    H    LYS  14           HN       LYS  14  50.270   8.523   0.428
   98    HA   LYS  14           HA       LYS  14  47.272   8.275   1.284
   99    HB2  LYS  14           HB2      LYS  14  48.155   9.765  -0.682
  100    HB3  LYS  14           HB1      LYS  14  48.587   8.194  -1.455
  101    HG2  LYS  14           HG2      LYS  14  46.367   7.753  -1.998
  102    HG3  LYS  14           HG1      LYS  14  45.740   8.380  -0.456
  103    HD2  LYS  14           HD2      LYS  14  45.906  10.674  -1.261
  104    HD3  LYS  14           HD1      LYS  14  46.724  10.136  -2.748
  105    HE2  LYS  14           HE2      LYS  14  44.740   8.966  -3.501
  106    HE3  LYS  14           HE1      LYS  14  43.928   9.232  -1.938
  107    HZ1  LYS  14           HZ1      LYS  14  43.748  10.847  -4.124
  108    HZ2  LYS  14           HZ2      LYS  14  44.870  11.664  -3.146
  109    HZ3  LYS  14           HZ3      LYS  14  43.331  11.279  -2.538
  110    H    HIS  15           HN       HIS  15  46.388   6.676  -0.619
  111    HA   HIS  15           HA       HIS  15  45.997   4.373  -0.824
  112    HB2  HIS  15           HB2      HIS  15  48.773   4.799  -1.989
  113    HB3  HIS  15           HB1      HIS  15  47.781   3.348  -2.270
  114    HD1  HIS  15           HD1      HIS  15  45.001   4.513  -2.684
  115    HD2  HIS  15           HD2      HIS  15  48.466   6.234  -4.338
  116    HE1  HIS  15           HE1      HIS  15  44.271   5.917  -4.691
  117    H    ILE  16           HN       ILE  16  47.551   5.240   1.689
  118    HA   ILE  16           HA       ILE  16  47.712   2.860   2.919
  119    HB   ILE  16           HB       ILE  16  49.518   1.984   1.646
  120   HG12  ILE  16          HG12      ILE  16  50.929   3.248   4.029
  121   HG13  ILE  16          HG11      ILE  16  49.757   1.926   4.215
  122   HG21  ILE  16          HG21      ILE  16  51.659   3.371   1.354
  123   HG22  ILE  16          HG22      ILE  16  50.752   4.749   1.979
  124   HG23  ILE  16          HG23      ILE  16  50.264   3.996   0.451
  125   HD11  ILE  16           HD1      ILE  16  52.500   1.876   2.923
  126   HD12  ILE  16           HD2      ILE  16  51.269   0.701   2.404
  127   HD13  ILE  16           HD3      ILE  16  51.791   0.752   4.101
  128    H    GLY  17           HN       GLY  17  49.252   5.767   2.523
  129    HA2  GLY  17           HA1      GLY  17  49.542   6.214   5.415
  130    HA3  GLY  17           HA2      GLY  17  49.804   7.413   4.132
  131    H    HIS  18           HN       HIS  18  47.191   6.133   2.946
  132    HA   HIS  18           HA       HIS  18  45.357   8.042   4.385
  133    HB2  HIS  18           HB2      HIS  18  45.486   6.788   1.670
  134    HB3  HIS  18           HB1      HIS  18  43.850   6.919   2.344
  135    HD1  HIS  18           HD1      HIS  18  46.480   9.489   3.223
  136    HD2  HIS  18           HD2      HIS  18  43.237   9.088   0.575
  137    HE1  HIS  18           HE1      HIS  18  45.970  11.812   2.285
  138    H    ALA  19           HN       ALA  19  45.629   4.560   3.457
  139    HA   ALA  19           HA       ALA  19  44.677   3.458   5.821
  140    HB1  ALA  19           HB1      ALA  19  42.174   2.984   4.992
  141    HB2  ALA  19           HB2      ALA  19  42.410   4.530   4.144
  142    HB3  ALA  19           HB3      ALA  19  42.565   4.451   5.915
  143    H    ALA  20           HN       ALA  20  45.911   3.243   2.924
  144    HA   ALA  20           HA       ALA  20  46.383   1.496   1.471
  145    HB1  ALA  20           HB1      ALA  20  45.282  -0.359   3.605
  146    HB2  ALA  20           HB2      ALA  20  46.887   0.400   3.721
  147    HB3  ALA  20           HB3      ALA  20  46.520  -0.706   2.375
  148    H    VAL  21           HN       VAL  21  43.497   2.584   2.155
  149    HA   VAL  21           HA       VAL  21  42.148   0.924   0.078
  150    HB   VAL  21           HB       VAL  21  40.926   1.528   2.814
  151   HG11  VAL  21          HG11      VAL  21  39.844   0.316   0.240
  152   HG12  VAL  21          HG12      VAL  21  39.147   1.615   1.239
  153   HG13  VAL  21          HG13      VAL  21  39.107  -0.064   1.814
  154   HG21  VAL  21          HG21      VAL  21  40.895  -0.996   3.005
  155   HG22  VAL  21          HG22      VAL  21  42.533  -0.306   2.978
  156   HG23  VAL  21          HG23      VAL  21  41.867  -1.072   1.516
  157    H    ASN  22           HN       ASN  22  42.984   3.797   1.586
  158    HA   ASN  22           HA       ASN  22  42.707   5.930   0.529
  159    HB2  ASN  22           HB2      ASN  22  41.212   4.892  -1.294
  160    HB3  ASN  22           HB1      ASN  22  39.843   5.208  -0.195
  161   HD21  ASN  22          HD21      ASN  22  40.854   6.494  -2.893
  162   HD22  ASN  22          HD22      ASN  22  40.802   8.221  -2.525
  163    H    HIS  23           HN       HIS  23  40.216   4.219   2.355
  164    HA   HIS  23           HA       HIS  23  40.354   6.111   4.528
  165    HB2  HIS  23           HB2      HIS  23  39.047   7.493   2.902
  166    HB3  HIS  23           HB1      HIS  23  37.809   6.216   2.858
  167    HD1  HIS  23           HD1      HIS  23  36.379   5.815   5.015
  168    HD2  HIS  23           HD2      HIS  23  39.030   9.073   5.247
  169    HE1  HIS  23           HE1      HIS  23  35.727   7.182   7.073
  170    H    TYR  24           HN       TYR  24  40.652   4.177   5.656
  171    HA   TYR  24           HA       TYR  24  38.139   2.913   6.498
  172    HB2  TYR  24           HB2      TYR  24  38.684   1.613   4.452
  173    HB3  TYR  24           HB1      TYR  24  40.284   1.232   5.133
  174    HD1  TYR  24           HD1      TYR  24  36.602   0.983   5.881
  175    HD2  TYR  24           HD2      TYR  24  40.539  -0.654   6.558
  176    HE1  TYR  24           HE1      TYR  24  35.596  -0.924   7.130
  177    HE2  TYR  24           HE2      TYR  24  39.532  -2.561   7.805
  178    HH   TYR  24           HH       TYR  24  36.857  -2.879   9.041
  179    H    LEU  25           HN       LEU  25  40.748   4.399   7.323
  180    HA   LEU  25           HA       LEU  25  42.382   2.787   8.920
  181    HB2  LEU  25           HB2      LEU  25  42.550   5.303   8.493
  182    HB3  LEU  25           HB1      LEU  25  41.332   5.510   9.769
  183    HG   LEU  25           HG       LEU  25  42.975   4.010  11.221
  184   HD11  LEU  25          HD11      LEU  25  44.560   3.380   9.477
  185   HD12  LEU  25          HD12      LEU  25  45.381   4.478  10.606
  186   HD13  LEU  25          HD13      LEU  25  44.817   5.084   9.032
  187   HD21  LEU  25          HD21      LEU  25  43.625   6.895  10.468
  188   HD22  LEU  25          HD22      LEU  25  44.200   6.061  11.931
  189   HD23  LEU  25          HD23      LEU  25  42.461   6.370  11.707
  Start of MODEL   79
    1    H1   GLY   1           HT1      GLY   1  69.525  17.230   0.811
    2    H2   GLY   1           HT2      GLY   1  68.019  18.004   0.660
    3    H3   GLY   1           HT3      GLY   1  69.425  18.744   0.055
    4    HA2  GLY   1           HA1      GLY   1  68.281  17.895  -1.769
    5    HA3  GLY   1           HA2      GLY   1  69.695  16.865  -1.473
    6    H    TRP   2           HN       TRP   2  66.436  16.885  -2.130
    7    HA   TRP   2           HA       TRP   2  66.236  13.995  -1.596
    8    HB2  TRP   2           HB2      TRP   2  64.392  15.967  -0.185
    9    HB3  TRP   2           HB1      TRP   2  64.145  14.206  -0.261
   10    HD1  TRP   2           HD1      TRP   2  66.172  16.885   1.470
   11    HE1  TRP   2           HE1      TRP   2  67.659  15.832   3.326
   12    HE3  TRP   2           HE3      TRP   2  65.479  11.939   0.349
   13    HZ2  TRP   2           HZ2      TRP   2  68.425  13.191   4.180
   14    HZ3  TRP   2           HZ3      TRP   2  66.598  10.170   1.697
   15    HH2  TRP   2           HH2      TRP   2  68.068  10.790   3.610
   16    H    GLY   3           HN       GLY   3  64.843  13.000  -2.969
   17    HA2  GLY   3           HA1      GLY   3  63.926  14.489  -5.248
   18    HA3  GLY   3           HA2      GLY   3  63.540  12.799  -4.871
   19    H    SER   4           HN       SER   4  62.615  14.139  -2.136
   20    HA   SER   4           HA       SER   4  60.213  15.582  -2.900
   21    HB2  SER   4           HB2      SER   4  58.613  13.801  -2.099
   22    HB3  SER   4           HB1      SER   4  59.407  13.432  -3.645
   23    HG   SER   4           HG       SER   4  59.679  11.627  -2.453
   24    H    ILE   5           HN       ILE   5  58.754  15.918  -0.995
   25    HA   ILE   5           HA       ILE   5  60.106  15.460   1.637
   26    HB   ILE   5           HB       ILE   5  59.076  18.219   0.844
   27   HG12  ILE   5          HG12      ILE   5  61.925  17.120   0.768
   28   HG13  ILE   5          HG11      ILE   5  60.971  17.680  -0.624
   29   HG21  ILE   5          HG21      ILE   5  60.140  18.937   2.867
   30   HG22  ILE   5          HG22      ILE   5  61.031  17.406   3.035
   31   HG23  ILE   5          HG23      ILE   5  59.271  17.447   3.296
   32   HD11  ILE   5           HD1      ILE   5  62.359  19.531  -0.095
   33   HD12  ILE   5           HD2      ILE   5  62.133  19.316   1.656
   34   HD13  ILE   5           HD3      ILE   5  60.799  19.944   0.655
   35    H    PHE   6           HN       PHE   6  57.330  17.130   0.063
   36    HA   PHE   6           HA       PHE   6  55.589  16.540   2.344
   37    HB2  PHE   6           HB2      PHE   6  54.972  17.598  -0.444
   38    HB3  PHE   6           HB1      PHE   6  53.828  17.549   0.919
   39    HD1  PHE   6           HD1      PHE   6  57.049  19.011  -0.286
   40    HD2  PHE   6           HD2      PHE   6  53.937  19.172   2.701
   41    HE1  PHE   6           HE1      PHE   6  57.963  21.173   0.551
   42    HE2  PHE   6           HE2      PHE   6  54.852  21.334   3.537
   43    HZ   PHE   6           HZ       PHE   6  56.873  22.327   2.470
   44    H    LYS   7           HN       LYS   7  56.717  14.165   1.453
   45    HA   LYS   7           HA       LYS   7  56.146  12.024   0.775
   46    HB2  LYS   7           HB2      LYS   7  53.455  13.190   1.561
   47    HB3  LYS   7           HB1      LYS   7  53.585  11.522   0.952
   48    HG2  LYS   7           HG2      LYS   7  53.689  11.646   3.449
   49    HG3  LYS   7           HG1      LYS   7  55.163  10.949   2.736
   50    HD2  LYS   7           HD2      LYS   7  56.409  12.961   3.071
   51    HD3  LYS   7           HD1      LYS   7  54.939  13.913   3.392
   52    HE2  LYS   7           HE2      LYS   7  55.842  11.594   5.149
   53    HE3  LYS   7           HE1      LYS   7  56.300  13.286   5.456
   54    HZ1  LYS   7           HZ1      LYS   7  53.850  13.785   5.388
   55    HZ2  LYS   7           HZ2      LYS   7  54.370  12.866   6.718
   56    HZ3  LYS   7           HZ3      LYS   7  53.571  12.112   5.423
   57    H    HIS   8           HN       HIS   8  56.956  12.831  -1.359
   58    HA   HIS   8           HA       HIS   8  56.734  13.059  -3.661
   59    HB2  HIS   8           HB2      HIS   8  54.436  11.111  -3.285
   60    HB3  HIS   8           HB1      HIS   8  55.460  11.314  -4.725
   61    HD1  HIS   8           HD1      HIS   8  57.574  11.692  -1.817
   62    HD2  HIS   8           HD2      HIS   8  56.033   8.428  -3.975
   63    HE1  HIS   8           HE1      HIS   8  58.963   9.640  -1.192
   64    H    GLY   9           HN       GLY   9  55.080  14.892  -1.954
   65    HA2  GLY   9           HA1      GLY   9  53.692  16.676  -2.491
   66    HA3  GLY   9           HA2      GLY   9  53.582  16.063  -4.151
   67    H    ARG  10           HN       ARG  10  52.507  15.160  -0.839
   68    HA   ARG  10           HA       ARG  10  50.458  14.390  -0.097
   69    HB2  ARG  10           HB2      ARG  10  49.230  15.691  -2.549
   70    HB3  ARG  10           HB1      ARG  10  48.503  15.447  -0.942
   71    HG2  ARG  10           HG2      ARG  10  50.830  17.299  -1.625
   72    HG3  ARG  10           HG1      ARG  10  49.182  17.787  -1.170
   73    HD2  ARG  10           HD2      ARG  10  49.598  16.440   1.020
   74    HD3  ARG  10           HD1      ARG  10  51.318  16.496   0.559
   75    HE   ARG  10           HE       ARG  10  49.942  18.635   1.784
   76   HH11  ARG  10          HH11      ARG  10  52.395  17.883  -0.453
   77   HH12  ARG  10          HH12      ARG  10  52.788  19.533  -0.810
   78   HH21  ARG  10          HH21      ARG  10  50.190  20.837   1.082
   79   HH22  ARG  10          HH22      ARG  10  51.539  21.204   0.059
   80    H    HIS  11           HN       HIS  11  51.870  12.462  -1.366
   81    HA   HIS  11           HA       HIS  11  49.712  10.743  -2.327
   82    HB2  HIS  11           HB2      HIS  11  50.298  11.854  -4.453
   83    HB3  HIS  11           HB1      HIS  11  52.012  11.455  -4.199
   84    HD1  HIS  11           HD1      HIS  11  52.730   8.938  -4.409
   85    HD2  HIS  11           HD2      HIS  11  48.689   9.677  -5.315
   86    HE1  HIS  11           HE1      HIS  11  51.830   6.871  -5.610
   87    H    ALA  12           HN       ALA  12  50.049   9.608  -0.663
   88    HA   ALA  12           HA       ALA  12  51.151   7.282  -0.374
   89    HB1  ALA  12           HB1      ALA  12  53.357   8.001  -1.081
   90    HB2  ALA  12           HB2      ALA  12  53.417   7.690   0.665
   91    HB3  ALA  12           HB3      ALA  12  53.195   9.344   0.058
   92    H    ALA  13           HN       ALA  13  51.329  10.565   0.742
   93    HA   ALA  13           HA       ALA  13  50.894   9.915   3.584
   94    HB1  ALA  13           HB1      ALA  13  49.722  12.203   3.515
   95    HB2  ALA  13           HB2      ALA  13  50.165  12.309   1.795
   96    HB3  ALA  13           HB3      ALA  13  51.435  12.272   3.040
   97    H    LYS  14           HN       LYS  14  50.227   9.168   0.539
   98    HA   LYS  14           HA       LYS  14  47.209   8.526   0.988
   99    HB2  LYS  14           HB2      LYS  14  48.153  10.006  -0.930
  100    HB3  LYS  14           HB1      LYS  14  48.942   8.490  -1.518
  101    HG2  LYS  14           HG2      LYS  14  46.915   7.670  -2.338
  102    HG3  LYS  14           HG1      LYS  14  45.965   8.289  -0.968
  103    HD2  LYS  14           HD2      LYS  14  45.981  10.544  -1.937
  104    HD3  LYS  14           HD1      LYS  14  47.033   9.993  -3.263
  105    HE2  LYS  14           HE2      LYS  14  45.304   8.487  -4.086
  106    HE3  LYS  14           HE1      LYS  14  44.267   8.850  -2.685
  107    HZ1  LYS  14           HZ1      LYS  14  44.343  11.225  -3.438
  108    HZ2  LYS  14           HZ2      LYS  14  43.512  10.171  -4.480
  109    HZ3  LYS  14           HZ3      LYS  14  45.081  10.694  -4.871
  110    H    HIS  15           HN       HIS  15  46.866   6.707  -0.906
  111    HA   HIS  15           HA       HIS  15  46.806   4.364  -0.972
  112    HB2  HIS  15           HB2      HIS  15  49.720   4.876  -1.668
  113    HB3  HIS  15           HB1      HIS  15  48.700   3.525  -2.221
  114    HD1  HIS  15           HD1      HIS  15  46.312   4.480  -3.435
  115    HD2  HIS  15           HD2      HIS  15  49.678   6.993  -3.436
  116    HE1  HIS  15           HE1      HIS  15  46.000   6.173  -5.323
  117    H    ILE  16           HN       ILE  16  47.779   5.563   1.660
  118    HA   ILE  16           HA       ILE  16  48.082   3.318   3.088
  119    HB   ILE  16           HB       ILE  16  50.171   2.645   2.156
  120   HG12  ILE  16          HG12      ILE  16  51.790   2.850   3.990
  121   HG13  ILE  16          HG11      ILE  16  50.842   4.166   4.714
  122   HG21  ILE  16          HG21      ILE  16  52.135   4.281   2.100
  123   HG22  ILE  16          HG22      ILE  16  50.977   5.561   2.470
  124   HG23  ILE  16          HG23      ILE  16  50.838   4.670   0.947
  125   HD11  ILE  16           HD1      ILE  16  49.678   1.405   4.161
  126   HD12  ILE  16           HD2      ILE  16  48.997   2.690   5.185
  127   HD13  ILE  16           HD3      ILE  16  50.463   1.826   5.700
  128    H    GLY  17           HN       GLY  17  49.345   6.359   2.710
  129    HA2  GLY  17           HA1      GLY  17  49.071   7.043   5.545
  130    HA3  GLY  17           HA2      GLY  17  49.390   8.176   4.217
  131    H    HIS  18           HN       HIS  18  47.151   6.483   2.772
  132    HA   HIS  18           HA       HIS  18  44.909   8.236   3.760
  133    HB2  HIS  18           HB2      HIS  18  45.617   6.828   1.218
  134    HB3  HIS  18           HB1      HIS  18  43.898   6.740   1.637
  135    HD1  HIS  18           HD1      HIS  18  43.325   8.328  -0.380
  136    HD2  HIS  18           HD2      HIS  18  45.815  10.053   2.537
  137    HE1  HIS  18           HE1      HIS  18  43.329  10.852  -0.777
  138    H    ALA  19           HN       ALA  19  45.780   4.789   3.229
  139    HA   ALA  19           HA       ALA  19  44.691   3.674   5.495
  140    HB1  ALA  19           HB1      ALA  19  42.471   4.384   5.335
  141    HB2  ALA  19           HB2      ALA  19  42.364   2.852   4.442
  142    HB3  ALA  19           HB3      ALA  19  42.498   4.391   3.557
  143    H    ALA  20           HN       ALA  20  46.237   3.530   2.770
  144    HA   ALA  20           HA       ALA  20  47.128   1.822   1.488
  145    HB1  ALA  20           HB1      ALA  20  45.919  -0.150   3.450
  146    HB2  ALA  20           HB2      ALA  20  47.365   0.814   3.838
  147    HB3  ALA  20           HB3      ALA  20  47.393  -0.322   2.468
  148    H    VAL  21           HN       VAL  21  44.002   2.524   1.769
  149    HA   VAL  21           HA       VAL  21  43.251   0.734  -0.501
  150    HB   VAL  21           HB       VAL  21  41.501   1.095   1.971
  151   HG11  VAL  21          HG11      VAL  21  40.227  -0.823   0.755
  152   HG12  VAL  21          HG12      VAL  21  41.170  -0.362  -0.682
  153   HG13  VAL  21          HG13      VAL  21  40.074   0.814   0.083
  154   HG21  VAL  21          HG21      VAL  21  43.366  -0.378   2.518
  155   HG22  VAL  21          HG22      VAL  21  43.155  -1.278   0.997
  156   HG23  VAL  21          HG23      VAL  21  41.919  -1.382   2.274
  157    H    ASN  22           HN       ASN  22  43.339   3.699   1.118
  158    HA   ASN  22           HA       ASN  22  42.868   5.712  -0.214
  159    HB2  ASN  22           HB2      ASN  22  41.518   4.569  -1.978
  160    HB3  ASN  22           HB1      ASN  22  40.158   4.463  -0.826
  161   HD21  ASN  22          HD21      ASN  22  42.333   6.820  -2.493
  162   HD22  ASN  22          HD22      ASN  22  41.177   8.155  -2.415
  163    H    HIS  23           HN       HIS  23  40.411   3.909   1.686
  164    HA   HIS  23           HA       HIS  23  40.544   5.852   3.820
  165    HB2  HIS  23           HB2      HIS  23  39.265   7.195   2.131
  166    HB3  HIS  23           HB1      HIS  23  38.001   5.943   2.154
  167    HD1  HIS  23           HD1      HIS  23  36.117   6.555   3.655
  168    HD2  HIS  23           HD2      HIS  23  39.815   7.863   5.169
  169    HE1  HIS  23           HE1      HIS  23  35.654   7.762   5.859
  170    H    TYR  24           HN       TYR  24  39.706   2.894   2.499
  171    HA   TYR  24           HA       TYR  24  37.464   2.003   3.915
  172    HB2  TYR  24           HB2      TYR  24  38.904   0.689   2.265
  173    HB3  TYR  24           HB1      TYR  24  40.004   0.357   3.624
  174    HD1  TYR  24           HD1      TYR  24  36.741  -0.401   2.109
  175    HD2  TYR  24           HD2      TYR  24  39.213  -0.931   5.608
  176    HE1  TYR  24           HE1      TYR  24  35.264  -2.257   2.872
  177    HE2  TYR  24           HE2      TYR  24  37.734  -2.787   6.371
  178    HH   TYR  24           HH       TYR  24  35.662  -3.667   6.108
  179    H    LEU  25           HN       LEU  25  40.485   3.069   5.177
  180    HA   LEU  25           HA       LEU  25  41.344   3.103   7.323
  181    HB2  LEU  25           HB2      LEU  25  39.267   4.343   7.757
  182    HB3  LEU  25           HB1      LEU  25  38.390   2.820   8.018
  183    HG   LEU  25           HG       LEU  25  39.811   2.317   9.983
  184   HD11  LEU  25          HD11      LEU  25  41.218   4.863   9.097
  185   HD12  LEU  25          HD12      LEU  25  41.925   3.300   9.574
  186   HD13  LEU  25          HD13      LEU  25  41.237   4.375  10.809
  187   HD21  LEU  25          HD21      LEU  25  37.709   3.712  10.156
  188   HD22  LEU  25          HD22      LEU  25  38.736   5.166  10.115
  189   HD23  LEU  25          HD23      LEU  25  38.884   4.008  11.459
  Start of MODEL   80
    1    H1   GLY   1           HT1      GLY   1  67.441  11.930   0.652
    2    H2   GLY   1           HT2      GLY   1  67.066  13.537   1.055
    3    H3   GLY   1           HT3      GLY   1  67.798  13.178  -0.437
    4    HA2  GLY   1           HA1      GLY   1  65.538  11.637  -0.318
    5    HA3  GLY   1           HA2      GLY   1  65.082  13.250   0.261
    6    H    TRP   2           HN       TRP   2  63.929  12.399  -2.012
    7    HA   TRP   2           HA       TRP   2  65.421  13.041  -4.401
    8    HB2  TRP   2           HB2      TRP   2  63.333  11.641  -4.319
    9    HB3  TRP   2           HB1      TRP   2  62.408  13.126  -3.979
   10    HD1  TRP   2           HD1      TRP   2  62.333  14.993  -5.905
   11    HE1  TRP   2           HE1      TRP   2  62.597  14.844  -8.487
   12    HE3  TRP   2           HE3      TRP   2  64.540  10.384  -6.225
   13    HZ2  TRP   2           HZ2      TRP   2  63.633  12.960 -10.403
   14    HZ3  TRP   2           HZ3      TRP   2  65.157   9.431  -8.440
   15    HH2  TRP   2           HH2      TRP   2  64.706  10.714 -10.528
   16    H    GLY   3           HN       GLY   3  63.911  14.942  -1.946
   17    HA2  GLY   3           HA1      GLY   3  63.889  17.253  -1.700
   18    HA3  GLY   3           HA2      GLY   3  64.785  17.399  -3.226
   19    H    SER   4           HN       SER   4  61.796  15.583  -3.041
   20    HA   SER   4           HA       SER   4  60.573  17.004  -5.176
   21    HB2  SER   4           HB2      SER   4  59.093  15.539  -2.965
   22    HB3  SER   4           HB1      SER   4  58.583  15.773  -4.651
   23    HG   SER   4           HG       SER   4  60.390  14.504  -5.270
   24    H    ILE   5           HN       ILE   5  57.910  17.383  -4.034
   25    HA   ILE   5           HA       ILE   5  58.274  19.706  -2.193
   26    HB   ILE   5           HB       ILE   5  56.644  20.039  -4.749
   27   HG12  ILE   5          HG12      ILE   5  59.575  20.741  -4.254
   28   HG13  ILE   5          HG11      ILE   5  58.944  19.598  -5.463
   29   HG21  ILE   5          HG21      ILE   5  57.980  22.128  -2.978
   30   HG22  ILE   5          HG22      ILE   5  56.340  21.515  -2.657
   31   HG23  ILE   5          HG23      ILE   5  56.687  22.366  -4.179
   32   HD11  ILE   5           HD1      ILE   5  58.689  22.624  -5.406
   33   HD12  ILE   5           HD2      ILE   5  57.585  21.620  -6.380
   34   HD13  ILE   5           HD3      ILE   5  59.336  21.586  -6.699
   35    H    PHE   6           HN       PHE   6  56.403  17.156  -3.643
   36    HA   PHE   6           HA       PHE   6  54.413  17.403  -1.452
   37    HB2  PHE   6           HB2      PHE   6  53.583  17.406  -4.383
   38    HB3  PHE   6           HB1      PHE   6  52.492  17.322  -2.979
   39    HD1  PHE   6           HD1      PHE   6  52.559  19.239  -1.266
   40    HD2  PHE   6           HD2      PHE   6  54.357  19.520  -5.181
   41    HE1  PHE   6           HE1      PHE   6  52.576  21.724  -1.082
   42    HE2  PHE   6           HE2      PHE   6  54.371  22.005  -4.996
   43    HZ   PHE   6           HZ       PHE   6  53.485  23.106  -2.943
   44    H    LYS   7           HN       LYS   7  56.140  15.664  -3.892
   45    HA   LYS   7           HA       LYS   7  54.658  13.272  -4.073
   46    HB2  LYS   7           HB2      LYS   7  56.796  13.907  -5.314
   47    HB3  LYS   7           HB1      LYS   7  57.688  13.397  -3.861
   48    HG2  LYS   7           HG2      LYS   7  56.442  11.165  -4.031
   49    HG3  LYS   7           HG1      LYS   7  55.890  11.699  -5.636
   50    HD2  LYS   7           HD2      LYS   7  58.811  11.507  -4.771
   51    HD3  LYS   7           HD1      LYS   7  57.958  10.286  -5.745
   52    HE2  LYS   7           HE2      LYS   7  57.406  12.258  -7.363
   53    HE3  LYS   7           HE1      LYS   7  58.691  13.136  -6.496
   54    HZ1  LYS   7           HZ1      LYS   7  59.043  10.449  -7.727
   55    HZ2  LYS   7           HZ2      LYS   7  60.251  11.441  -7.060
   56    HZ3  LYS   7           HZ3      LYS   7  59.461  11.905  -8.491
   57    H    HIS   8           HN       HIS   8  57.472  13.817  -1.895
   58    HA   HIS   8           HA       HIS   8  56.572  11.574  -0.181
   59    HB2  HIS   8           HB2      HIS   8  58.661  12.139   1.098
   60    HB3  HIS   8           HB1      HIS   8  58.947  11.765  -0.618
   61    HD1  HIS   8           HD1      HIS   8  57.443  15.092   0.291
   62    HD2  HIS   8           HD2      HIS   8  61.204  13.517  -0.735
   63    HE1  HIS   8           HE1      HIS   8  59.004  17.068  -0.143
   64    H    GLY   9           HN       GLY   9  54.644  13.582  -0.213
   65    HA2  GLY   9           HA1      GLY   9  54.335  14.077   2.583
   66    HA3  GLY   9           HA2      GLY   9  54.928  15.558   1.806
   67    H    ARG  10           HN       ARG  10  52.972  13.342  -0.046
   68    HA   ARG  10           HA       ARG  10  50.415  14.511   0.648
   69    HB2  ARG  10           HB2      ARG  10  51.717  16.366  -0.674
   70    HB3  ARG  10           HB1      ARG  10  51.397  15.355  -2.101
   71    HG2  ARG  10           HG2      ARG  10  48.968  15.449  -1.639
   72    HG3  ARG  10           HG1      ARG  10  49.274  16.417  -0.177
   73    HD2  ARG  10           HD2      ARG  10  50.363  18.161  -1.613
   74    HD3  ARG  10           HD1      ARG  10  49.916  17.212  -3.051
   75    HE   ARG  10           HE       ARG  10  47.723  18.046  -2.813
   76   HH11  ARG  10          HH11      ARG  10  46.509  17.213  -0.520
   77   HH12  ARG  10          HH12      ARG  10  46.557  18.528   0.606
   78   HH21  ARG  10          HH21      ARG  10  49.072  20.222  -1.077
   79   HH22  ARG  10          HH22      ARG  10  48.010  20.232   0.290
   80    H    HIS  11           HN       HIS  11  52.227  12.087  -0.354
   81    HA   HIS  11           HA       HIS  11  49.939  10.686  -1.570
   82    HB2  HIS  11           HB2      HIS  11  51.129  11.791  -3.524
   83    HB3  HIS  11           HB1      HIS  11  52.567  10.830  -3.101
   84    HD1  HIS  11           HD1      HIS  11  52.535   8.295  -3.574
   85    HD2  HIS  11           HD2      HIS  11  48.991  10.283  -4.651
   86    HE1  HIS  11           HE1      HIS  11  51.122   6.653  -4.929
   87    H    ALA  12           HN       ALA  12  49.953   8.629  -1.463
   88    HA   ALA  12           HA       ALA  12  50.420   6.519  -0.714
   89    HB1  ALA  12           HB1      ALA  12  52.731   7.126  -1.575
   90    HB2  ALA  12           HB2      ALA  12  52.639   5.905  -0.278
   91    HB3  ALA  12           HB3      ALA  12  53.003   7.592   0.095
   92    H    ALA  13           HN       ALA  13  51.590   9.359   1.017
   93    HA   ALA  13           HA       ALA  13  51.245   8.154   3.663
   94    HB1  ALA  13           HB1      ALA  13  50.979  11.026   2.590
   95    HB2  ALA  13           HB2      ALA  13  52.352  10.382   3.521
   96    HB3  ALA  13           HB3      ALA  13  50.764  10.580   4.299
   97    H    LYS  14           HN       LYS  14  50.127   8.272   0.688
   98    HA   LYS  14           HA       LYS  14  47.094   8.330   1.461
   99    HB2  LYS  14           HB2      LYS  14  48.227   9.923  -0.284
  100    HB3  LYS  14           HB1      LYS  14  48.482   8.419  -1.243
  101    HG2  LYS  14           HG2      LYS  14  46.247   8.335  -1.878
  102    HG3  LYS  14           HG1      LYS  14  45.650   8.865  -0.290
  103    HD2  LYS  14           HD2      LYS  14  46.064  11.181  -0.810
  104    HD3  LYS  14           HD1      LYS  14  46.987  10.754  -2.271
  105    HE2  LYS  14           HE2      LYS  14  44.501  11.517  -2.559
  106    HE3  LYS  14           HE1      LYS  14  45.047  10.074  -3.448
  107    HZ1  LYS  14           HZ1      LYS  14  43.711  10.001  -0.788
  108    HZ2  LYS  14           HZ2      LYS  14  44.104   8.674  -1.772
  109    HZ3  LYS  14           HZ3      LYS  14  42.908   9.775  -2.265
  110    H    HIS  15           HN       HIS  15  46.063   7.138  -0.629
  111    HA   HIS  15           HA       HIS  15  45.358   4.961  -1.124
  112    HB2  HIS  15           HB2      HIS  15  48.160   5.198  -2.267
  113    HB3  HIS  15           HB1      HIS  15  47.015   3.909  -2.714
  114    HD1  HIS  15           HD1      HIS  15  44.557   6.158  -2.343
  115    HD2  HIS  15           HD2      HIS  15  47.782   6.126  -5.037
  116    HE1  HIS  15           HE1      HIS  15  43.925   7.669  -4.304
  117    H    ILE  16           HN       ILE  16  46.879   5.228   1.499
  118    HA   ILE  16           HA       ILE  16  46.758   2.715   2.391
  119    HB   ILE  16           HB       ILE  16  48.450   1.801   0.955
  120   HG12  ILE  16          HG12      ILE  16  49.919   2.453   3.544
  121   HG13  ILE  16          HG11      ILE  16  48.652   1.218   3.413
  122   HG21  ILE  16          HG21      ILE  16  50.783   2.905   0.914
  123   HG22  ILE  16          HG22      ILE  16  50.031   4.292   1.706
  124   HG23  ILE  16          HG23      ILE  16  49.515   3.820   0.078
  125   HD11  ILE  16           HD1      ILE  16  50.215   0.357   1.379
  126   HD12  ILE  16           HD2      ILE  16  50.523  -0.125   3.060
  127   HD13  ILE  16           HD3      ILE  16  51.468   1.190   2.329
  128    H    GLY  17           HN       GLY  17  48.536   5.508   2.338
  129    HA2  GLY  17           HA1      GLY  17  48.877   5.491   5.285
  130    HA3  GLY  17           HA2      GLY  17  49.378   6.779   4.171
  131    H    HIS  18           HN       HIS  18  46.639   6.004   2.783
  132    HA   HIS  18           HA       HIS  18  45.048   8.013   4.375
  133    HB2  HIS  18           HB2      HIS  18  45.128   7.098   1.535
  134    HB3  HIS  18           HB1      HIS  18  43.489   7.333   2.164
  135    HD1  HIS  18           HD1      HIS  18  43.159   9.440   0.650
  136    HD2  HIS  18           HD2      HIS  18  46.306   9.783   3.419
  137    HE1  HIS  18           HE1      HIS  18  43.802  11.910   0.772
  138    H    ALA  19           HN       ALA  19  45.010   4.552   3.330
  139    HA   ALA  19           HA       ALA  19  43.002   4.110   5.505
  140    HB1  ALA  19           HB1      ALA  19  41.366   3.016   4.080
  141    HB2  ALA  19           HB2      ALA  19  42.348   3.366   2.639
  142    HB3  ALA  19           HB3      ALA  19  41.607   4.697   3.556
  143    H    ALA  20           HN       ALA  20  45.784   3.290   4.844
  144    HA   ALA  20           HA       ALA  20  47.049   1.368   5.087
  145    HB1  ALA  20           HB1      ALA  20  44.517  -0.077   5.892
  146    HB2  ALA  20           HB2      ALA  20  45.345   1.074   6.967
  147    HB3  ALA  20           HB3      ALA  20  46.189  -0.390   6.409
  148    H    VAL  21           HN       VAL  21  44.450   1.528   2.879
  149    HA   VAL  21           HA       VAL  21  45.728  -0.571   1.220
  150    HB   VAL  21           HB       VAL  21  42.778  -0.737   2.009
  151   HG11  VAL  21          HG11      VAL  21  44.486  -2.256  -0.008
  152   HG12  VAL  21          HG12      VAL  21  42.986  -1.348  -0.313
  153   HG13  VAL  21          HG13      VAL  21  42.931  -2.874   0.593
  154   HG21  VAL  21          HG21      VAL  21  43.539  -3.043   2.829
  155   HG22  VAL  21          HG22      VAL  21  44.132  -1.666   3.781
  156   HG23  VAL  21          HG23      VAL  21  45.211  -2.473   2.618
  157    H    ASN  22           HN       ASN  22  43.593   2.202   1.651
  158    HA   ASN  22           HA       ASN  22  44.053   3.021  -1.085
  159    HB2  ASN  22           HB2      ASN  22  42.449   1.270  -1.632
  160    HB3  ASN  22           HB1      ASN  22  41.296   1.906  -0.440
  161   HD21  ASN  22          HD21      ASN  22  43.291   3.272  -3.171
  162   HD22  ASN  22          HD22      ASN  22  41.956   4.210  -3.848
  163    H    HIS  23           HN       HIS  23  40.851   3.515   0.216
  164    HA   HIS  23           HA       HIS  23  41.611   6.020   1.613
  165    HB2  HIS  23           HB2      HIS  23  41.447   6.630  -0.815
  166    HB3  HIS  23           HB1      HIS  23  39.758   6.066  -0.800
  167    HD1  HIS  23           HD1      HIS  23  41.879   8.339   1.487
  168    HD2  HIS  23           HD2      HIS  23  38.152   8.274  -0.456
  169    HE1  HIS  23           HE1      HIS  23  40.648  10.484   2.129
  170    H    TYR  24           HN       TYR  24  39.981   3.243   1.608
  171    HA   TYR  24           HA       TYR  24  37.312   4.155   2.388
  172    HB2  TYR  24           HB2      TYR  24  38.634   1.456   2.869
  173    HB3  TYR  24           HB1      TYR  24  36.892   1.822   2.892
  174    HD1  TYR  24           HD1      TYR  24  35.898   2.908   0.718
  175    HD2  TYR  24           HD2      TYR  24  39.636   0.749   0.837
  176    HE1  TYR  24           HE1      TYR  24  35.768   2.542  -1.742
  177    HE2  TYR  24           HE2      TYR  24  39.502   0.383  -1.623
  178    HH   TYR  24           HH       TYR  24  36.799   0.542  -3.315
  179    H    LEU  25           HN       LEU  25  39.818   5.134   3.838
  180    HA   LEU  25           HA       LEU  25  40.465   5.548   6.027
  181    HB2  LEU  25           HB2      LEU  25  38.089   6.482   5.938
  182    HB3  LEU  25           HB1      LEU  25  37.560   4.970   6.707
  183    HG   LEU  25           HG       LEU  25  39.426   5.522   8.505
  184   HD11  LEU  25          HD11      LEU  25  38.937   8.248   7.215
  185   HD12  LEU  25          HD12      LEU  25  40.497   7.414   7.407
  186   HD13  LEU  25          HD13      LEU  25  39.634   8.025   8.834
  187   HD21  LEU  25          HD21      LEU  25  37.783   6.854   9.801
  188   HD22  LEU  25          HD22      LEU  25  36.992   5.503   8.955
  189   HD23  LEU  25          HD23      LEU  25  36.856   7.158   8.313
  Start of MODEL   81
    1    H1   GLY   1           HT1      GLY   1  66.739  19.625  -6.177
    2    H2   GLY   1           HT2      GLY   1  67.970  19.900  -7.315
    3    H3   GLY   1           HT3      GLY   1  68.085  20.563  -5.754
    4    HA2  GLY   1           HA1      GLY   1  69.108  18.197  -6.646
    5    HA3  GLY   1           HA2      GLY   1  69.054  18.801  -4.978
    6    H    TRP   2           HN       TRP   2  65.924  18.561  -6.160
    7    HA   TRP   2           HA       TRP   2  65.555  15.685  -5.634
    8    HB2  TRP   2           HB2      TRP   2  64.332  17.735  -3.742
    9    HB3  TRP   2           HB1      TRP   2  64.081  15.974  -3.706
   10    HD1  TRP   2           HD1      TRP   2  66.243  14.453  -3.099
   11    HE1  TRP   2           HE1      TRP   2  68.322  14.949  -1.618
   12    HE3  TRP   2           HE3      TRP   2  65.933  19.562  -2.955
   13    HZ2  TRP   2           HZ2      TRP   2  69.645  17.266  -0.534
   14    HZ3  TRP   2           HZ3      TRP   2  67.613  20.894  -1.692
   15    HH2  TRP   2           HH2      TRP   2  69.468  19.753  -0.482
   16    H    GLY   3           HN       GLY   3  63.780  18.816  -5.562
   17    HA2  GLY   3           HA1      GLY   3  62.120  19.552  -7.036
   18    HA3  GLY   3           HA2      GLY   3  62.241  18.029  -7.939
   19    H    SER   4           HN       SER   4  62.019  17.166  -4.762
   20    HA   SER   4           HA       SER   4  59.216  16.353  -5.078
   21    HB2  SER   4           HB2      SER   4  61.158  16.091  -2.747
   22    HB3  SER   4           HB1      SER   4  59.548  15.340  -2.829
   23    HG   SER   4           HG       SER   4  61.140  13.897  -3.551
   24    H    ILE   5           HN       ILE   5  58.366  18.574  -5.295
   25    HA   ILE   5           HA       ILE   5  58.473  20.348  -2.989
   26    HB   ILE   5           HB       ILE   5  56.376  20.411  -5.199
   27   HG12  ILE   5          HG12      ILE   5  59.250  21.446  -5.235
   28   HG13  ILE   5          HG11      ILE   5  58.574  20.165  -6.268
   29   HG21  ILE   5          HG21      ILE   5  56.265  22.751  -4.702
   30   HG22  ILE   5          HG22      ILE   5  57.764  22.698  -3.742
   31   HG23  ILE   5          HG23      ILE   5  56.280  21.936  -3.122
   32   HD11  ILE   5           HD1      ILE   5  56.845  21.958  -7.027
   33   HD12  ILE   5           HD2      ILE   5  58.510  22.103  -7.639
   34   HD13  ILE   5           HD3      ILE   5  57.962  23.139  -6.300
   35    H    PHE   6           HN       PHE   6  56.390  17.728  -4.075
   36    HA   PHE   6           HA       PHE   6  55.012  17.758  -1.461
   37    HB2  PHE   6           HB2      PHE   6  53.532  18.266  -4.073
   38    HB3  PHE   6           HB1      PHE   6  52.738  17.731  -2.573
   39    HD1  PHE   6           HD1      PHE   6  53.790  20.594  -4.443
   40    HD2  PHE   6           HD2      PHE   6  53.314  19.136  -0.407
   41    HE1  PHE   6           HE1      PHE   6  53.732  22.937  -3.602
   42    HE2  PHE   6           HE2      PHE   6  53.258  21.481   0.432
   43    HZ   PHE   6           HZ       PHE   6  53.539  23.378  -1.158
   44    H    LYS   7           HN       LYS   7  56.544  16.185  -3.861
   45    HA   LYS   7           HA       LYS   7  54.919  13.903  -4.400
   46    HB2  LYS   7           HB2      LYS   7  57.947  13.997  -4.110
   47    HB3  LYS   7           HB1      LYS   7  57.008  12.781  -4.998
   48    HG2  LYS   7           HG2      LYS   7  56.927  15.758  -5.662
   49    HG3  LYS   7           HG1      LYS   7  58.065  14.626  -6.424
   50    HD2  LYS   7           HD2      LYS   7  55.973  13.213  -7.040
   51    HD3  LYS   7           HD1      LYS   7  55.026  14.656  -6.608
   52    HE2  LYS   7           HE2      LYS   7  56.477  15.978  -8.216
   53    HE3  LYS   7           HE1      LYS   7  57.171  14.430  -8.755
   54    HZ1  LYS   7           HZ1      LYS   7  54.511  13.956  -8.833
   55    HZ2  LYS   7           HZ2      LYS   7  55.457  14.412 -10.168
   56    HZ3  LYS   7           HZ3      LYS   7  54.581  15.584  -9.304
   57    H    HIS   8           HN       HIS   8  57.765  13.940  -2.216
   58    HA   HIS   8           HA       HIS   8  56.668  11.655  -0.725
   59    HB2  HIS   8           HB2      HIS   8  59.112  11.957  -1.201
   60    HB3  HIS   8           HB1      HIS   8  59.106  13.374  -0.123
   61    HD1  HIS   8           HD1      HIS   8  58.469   9.603  -0.088
   62    HD2  HIS   8           HD2      HIS   8  59.293  12.742   2.584
   63    HE1  HIS   8           HE1      HIS   8  58.819   8.566   2.220
   64    H    GLY   9           HN       GLY   9  54.882  13.809  -0.612
   65    HA2  GLY   9           HA1      GLY   9  54.622  14.070   2.261
   66    HA3  GLY   9           HA2      GLY   9  55.134  15.597   1.519
   67    H    ARG  10           HN       ARG  10  53.135  13.321  -0.251
   68    HA   ARG  10           HA       ARG  10  50.606  14.494   0.559
   69    HB2  ARG  10           HB2      ARG  10  51.760  16.312  -0.892
   70    HB3  ARG  10           HB1      ARG  10  51.479  15.216  -2.263
   71    HG2  ARG  10           HG2      ARG  10  49.074  15.271  -1.899
   72    HG3  ARG  10           HG1      ARG  10  49.273  16.168  -0.375
   73    HD2  ARG  10           HD2      ARG  10  50.336  18.037  -1.687
   74    HD3  ARG  10           HD1      ARG  10  49.939  17.153  -3.181
   75    HE   ARG  10           HE       ARG  10  47.581  17.469  -1.544
   76   HH11  ARG  10          HH11      ARG  10  47.494  20.075  -1.252
   77   HH12  ARG  10          HH12      ARG  10  47.334  20.834  -2.801
   78   HH21  ARG  10          HH21      ARG  10  48.355  18.035  -4.576
   79   HH22  ARG  10          HH22      ARG  10  47.821  19.680  -4.682
   80    H    HIS  11           HN       HIS  11  52.446  12.076  -0.598
   81    HA   HIS  11           HA       HIS  11  50.054  10.620  -1.606
   82    HB2  HIS  11           HB2      HIS  11  52.666  10.732  -3.168
   83    HB3  HIS  11           HB1      HIS  11  51.230   9.761  -3.576
   84    HD1  HIS  11           HD1      HIS  11  48.972  11.164  -4.106
   85    HD2  HIS  11           HD2      HIS  11  52.542  13.386  -4.036
   86    HE1  HIS  11           HE1      HIS  11  48.518  13.374  -5.306
   87    H    ALA  12           HN       ALA  12  50.035   8.566  -1.429
   88    HA   ALA  12           HA       ALA  12  50.457   6.483  -0.590
   89    HB1  ALA  12           HB1      ALA  12  53.068   7.531   0.158
   90    HB2  ALA  12           HB2      ALA  12  52.761   6.997  -1.499
   91    HB3  ALA  12           HB3      ALA  12  52.672   5.849  -0.139
   92    H    ALA  13           HN       ALA  13  51.684   9.366   1.026
   93    HA   ALA  13           HA       ALA  13  51.335   8.264   3.715
   94    HB1  ALA  13           HB1      ALA  13  51.159  11.088   2.512
   95    HB2  ALA  13           HB2      ALA  13  52.461  10.457   3.549
   96    HB3  ALA  13           HB3      ALA  13  50.841  10.741   4.228
   97    H    LYS  14           HN       LYS  14  50.207   8.289   0.741
   98    HA   LYS  14           HA       LYS  14  47.182   8.422   1.517
   99    HB2  LYS  14           HB2      LYS  14  48.336   9.931  -0.286
  100    HB3  LYS  14           HB1      LYS  14  48.549   8.393  -1.196
  101    HG2  LYS  14           HG2      LYS  14  46.302   8.342  -1.809
  102    HG3  LYS  14           HG1      LYS  14  45.731   8.911  -0.225
  103    HD2  LYS  14           HD2      LYS  14  45.161  10.598  -1.849
  104    HD3  LYS  14           HD1      LYS  14  46.513  11.244  -0.896
  105    HE2  LYS  14           HE2      LYS  14  47.128  11.715  -3.137
  106    HE3  LYS  14           HE1      LYS  14  48.033  10.229  -2.770
  107    HZ1  LYS  14           HZ1      LYS  14  46.337   8.936  -3.848
  108    HZ2  LYS  14           HZ2      LYS  14  46.854  10.151  -4.917
  109    HZ3  LYS  14           HZ3      LYS  14  45.371  10.306  -4.102
  110    H    HIS  15           HN       HIS  15  46.121   7.163  -0.536
  111    HA   HIS  15           HA       HIS  15  45.382   4.980  -0.955
  112    HB2  HIS  15           HB2      HIS  15  46.885   5.694  -2.830
  113    HB3  HIS  15           HB1      HIS  15  48.222   4.836  -2.027
  114    HD1  HIS  15           HD1      HIS  15  44.602   4.040  -3.093
  115    HD2  HIS  15           HD2      HIS  15  48.405   2.251  -2.952
  116    HE1  HIS  15           HE1      HIS  15  44.372   1.685  -4.054
  117    H    ILE  16           HN       ILE  16  46.946   5.351   1.637
  118    HA   ILE  16           HA       ILE  16  46.743   2.876   2.636
  119    HB   ILE  16           HB       ILE  16  48.435   1.875   1.283
  120   HG12  ILE  16          HG12      ILE  16  50.228   1.273   2.851
  121   HG13  ILE  16          HG11      ILE  16  49.775   2.615   3.922
  122   HG21  ILE  16          HG21      ILE  16  49.530   3.835   0.324
  123   HG22  ILE  16          HG22      ILE  16  50.774   2.919   1.201
  124   HG23  ILE  16          HG23      ILE  16  50.065   4.362   1.931
  125   HD11  ILE  16           HD1      ILE  16  47.812   0.434   3.102
  126   HD12  ILE  16           HD2      ILE  16  47.648   1.609   4.427
  127   HD13  ILE  16           HD3      ILE  16  48.845   0.301   4.542
  128    H    GLY  17           HN       GLY  17  48.751   5.511   2.541
  129    HA2  GLY  17           HA1      GLY  17  49.003   5.664   5.460
  130    HA3  GLY  17           HA2      GLY  17  49.475   6.918   4.297
  131    H    HIS  18           HN       HIS  18  46.729   6.174   2.967
  132    HA   HIS  18           HA       HIS  18  45.168   8.188   4.588
  133    HB2  HIS  18           HB2      HIS  18  45.162   7.228   1.747
  134    HB3  HIS  18           HB1      HIS  18  43.560   7.583   2.424
  135    HD1  HIS  18           HD1      HIS  18  46.546   9.537   3.641
  136    HD2  HIS  18           HD2      HIS  18  43.343  10.020   0.961
  137    HE1  HIS  18           HE1      HIS  18  46.501  11.995   2.944
  138    H    ALA  19           HN       ALA  19  44.924   4.832   3.272
  139    HA   ALA  19           HA       ALA  19  43.733   3.647   5.484
  140    HB1  ALA  19           HB1      ALA  19  41.798   4.940   5.658
  141    HB2  ALA  19           HB2      ALA  19  41.214   3.674   4.557
  142    HB3  ALA  19           HB3      ALA  19  41.727   5.251   3.907
  143    H    ALA  20           HN       ALA  20  45.016   3.545   2.606
  144    HA   ALA  20           HA       ALA  20  45.292   1.890   1.008
  145    HB1  ALA  20           HB1      ALA  20  45.393   0.497   3.169
  146    HB2  ALA  20           HB2      ALA  20  45.022  -0.372   1.660
  147    HB3  ALA  20           HB3      ALA  20  43.718   0.022   2.805
  148    H    VAL  21           HN       VAL  21  42.530   3.350   1.728
  149    HA   VAL  21           HA       VAL  21  41.118   2.217  -0.650
  150    HB   VAL  21           HB       VAL  21  39.757   2.693   2.044
  151   HG11  VAL  21          HG11      VAL  21  38.169   3.157   0.333
  152   HG12  VAL  21          HG12      VAL  21  37.857   1.461   0.755
  153   HG13  VAL  21          HG13      VAL  21  38.780   1.856  -0.715
  154   HG21  VAL  21          HG21      VAL  21  40.464   0.114   0.570
  155   HG22  VAL  21          HG22      VAL  21  39.408   0.201   2.000
  156   HG23  VAL  21          HG23      VAL  21  41.119   0.658   2.132
  157    H    ASN  22           HN       ASN  22  42.257   4.707   1.276
  158    HA   ASN  22           HA       ASN  22  42.390   6.968   0.458
  159    HB2  ASN  22           HB2      ASN  22  40.827   6.461  -1.506
  160    HB3  ASN  22           HB1      ASN  22  39.474   6.796  -0.392
  161   HD21  ASN  22          HD21      ASN  22  41.200   8.277  -2.777
  162   HD22  ASN  22          HD22      ASN  22  41.174   9.938  -2.175
  163    H    HIS  23           HN       HIS  23  39.600   5.476   2.025
  164    HA   HIS  23           HA       HIS  23  39.986   7.068   4.405
  165    HB2  HIS  23           HB2      HIS  23  38.877   8.727   2.800
  166    HB3  HIS  23           HB1      HIS  23  37.434   7.688   2.869
  167    HD1  HIS  23           HD1      HIS  23  36.916  10.399   3.932
  168    HD2  HIS  23           HD2      HIS  23  38.704   7.461   6.350
  169    HE1  HIS  23           HE1      HIS  23  36.492  11.053   6.365
  170    H    TYR  24           HN       TYR  24  36.775   6.880   4.462
  171    HA   TYR  24           HA       TYR  24  35.344   5.397   5.546
  172    HB2  TYR  24           HB2      TYR  24  36.680   3.312   3.783
  173    HB3  TYR  24           HB1      TYR  24  35.020   3.292   4.429
  174    HD1  TYR  24           HD1      TYR  24  33.268   4.688   3.460
  175    HD2  TYR  24           HD2      TYR  24  37.315   4.870   1.971
  176    HE1  TYR  24           HE1      TYR  24  32.477   5.953   1.464
  177    HE2  TYR  24           HE2      TYR  24  36.525   6.135  -0.024
  178    HH   TYR  24           HH       TYR  24  33.302   7.479  -0.124
  179    H    LEU  25           HN       LEU  25  38.052   5.795   6.716
  180    HA   LEU  25           HA       LEU  25  37.862   3.681   8.710
  181    HB2  LEU  25           HB2      LEU  25  39.200   2.748   6.613
  182    HB3  LEU  25           HB1      LEU  25  40.532   3.724   7.268
  183    HG   LEU  25           HG       LEU  25  38.999   1.509   8.708
  184   HD11  LEU  25          HD11      LEU  25  41.949   1.742   7.975
  185   HD12  LEU  25          HD12      LEU  25  40.749   0.864   6.996
  186   HD13  LEU  25          HD13      LEU  25  41.116   0.323   8.651
  187   HD21  LEU  25          HD21      LEU  25  39.487   3.135  10.393
  188   HD22  LEU  25          HD22      LEU  25  41.074   3.517   9.679
  189   HD23  LEU  25          HD23      LEU  25  40.815   1.958  10.497
  Start of MODEL   82
    1    H1   GLY   1           HT1      GLY   1  64.473   7.540  -8.596
    2    H2   GLY   1           HT2      GLY   1  65.267   8.371  -9.847
    3    H3   GLY   1           HT3      GLY   1  64.260   9.212  -8.767
    4    HA2  GLY   1           HA1      GLY   1  66.261   7.763  -7.403
    5    HA3  GLY   1           HA2      GLY   1  66.950   8.881  -8.596
    6    H    TRP   2           HN       TRP   2  63.895   9.938  -7.656
    7    HA   TRP   2           HA       TRP   2  64.865  12.313  -6.437
    8    HB2  TRP   2           HB2      TRP   2  62.158  10.966  -6.081
    9    HB3  TRP   2           HB1      TRP   2  62.534  12.669  -5.725
   10    HD1  TRP   2           HD1      TRP   2  61.882  10.261  -8.583
   11    HE1  TRP   2           HE1      TRP   2  61.686  11.567 -10.823
   12    HE3  TRP   2           HE3      TRP   2  63.393  14.877  -6.963
   13    HZ2  TRP   2           HZ2      TRP   2  62.133  14.255 -11.753
   14    HZ3  TRP   2           HZ3      TRP   2  63.501  16.798  -8.544
   15    HH2  TRP   2           HH2      TRP   2  62.874  16.491 -10.935
   16    H    GLY   3           HN       GLY   3  63.627   9.283  -4.984
   17    HA2  GLY   3           HA1      GLY   3  63.953   8.409  -2.869
   18    HA3  GLY   3           HA2      GLY   3  65.347   9.494  -2.707
   19    H    SER   4           HN       SER   4  62.211  10.844  -3.413
   20    HA   SER   4           HA       SER   4  62.282  12.494  -1.053
   21    HB2  SER   4           HB2      SER   4  60.011  11.840  -2.968
   22    HB3  SER   4           HB1      SER   4  59.957  13.111  -1.727
   23    HG   SER   4           HG       SER   4  62.206  13.154  -3.318
   24    H    ILE   5           HN       ILE   5  61.949  11.864   0.970
   25    HA   ILE   5           HA       ILE   5  60.715   9.339   1.626
   26    HB   ILE   5           HB       ILE   5  61.032  11.704   3.522
   27   HG12  ILE   5          HG12      ILE   5  63.116   9.631   2.684
   28   HG13  ILE   5          HG11      ILE   5  63.148  11.357   2.258
   29   HG21  ILE   5          HG21      ILE   5  61.147  10.025   5.229
   30   HG22  ILE   5          HG22      ILE   5  61.353   8.718   4.038
   31   HG23  ILE   5          HG23      ILE   5  59.786   9.549   4.189
   32   HD11  ILE   5           HD1      ILE   5  64.579  11.207   4.145
   33   HD12  ILE   5           HD2      ILE   5  63.495  10.076   4.988
   34   HD13  ILE   5           HD3      ILE   5  63.041  11.791   4.825
   35    H    PHE   6           HN       PHE   6  59.625  12.743   1.971
   36    HA   PHE   6           HA       PHE   6  56.912  11.865   2.731
   37    HB2  PHE   6           HB2      PHE   6  57.888  14.657   2.019
   38    HB3  PHE   6           HB1      PHE   6  56.432  14.219   2.943
   39    HD1  PHE   6           HD1      PHE   6  56.628  13.239   5.227
   40    HD2  PHE   6           HD2      PHE   6  60.086  14.631   3.050
   41    HE1  PHE   6           HE1      PHE   6  57.959  13.234   7.334
   42    HE2  PHE   6           HE2      PHE   6  61.415  14.625   5.157
   43    HZ   PHE   6           HZ       PHE   6  60.332  13.994   7.310
   44    H    LYS   7           HN       LYS   7  58.204  11.252   0.020
   45    HA   LYS   7           HA       LYS   7  57.535  11.190  -2.200
   46    HB2  LYS   7           HB2      LYS   7  54.905  11.513  -0.728
   47    HB3  LYS   7           HB1      LYS   7  54.944  11.431  -2.505
   48    HG2  LYS   7           HG2      LYS   7  54.585   9.199  -1.424
   49    HG3  LYS   7           HG1      LYS   7  56.048   9.254  -2.431
   50    HD2  LYS   7           HD2      LYS   7  57.483   9.420  -0.521
   51    HD3  LYS   7           HD1      LYS   7  56.120   9.780   0.567
   52    HE2  LYS   7           HE2      LYS   7  55.221   7.520   0.242
   53    HE3  LYS   7           HE1      LYS   7  56.502   7.153  -0.939
   54    HZ1  LYS   7           HZ1      LYS   7  58.020   6.875   0.676
   55    HZ2  LYS   7           HZ2      LYS   7  56.671   6.611   1.675
   56    HZ3  LYS   7           HZ3      LYS   7  57.419   8.136   1.637
   57    H    HIS   8           HN       HIS   8  57.846  13.922  -0.566
   58    HA   HIS   8           HA       HIS   8  57.692  16.191  -1.078
   59    HB2  HIS   8           HB2      HIS   8  59.388  15.334  -2.713
   60    HB3  HIS   8           HB1      HIS   8  58.086  15.153  -3.910
   61    HD1  HIS   8           HD1      HIS   8  59.532  17.892  -1.624
   62    HD2  HIS   8           HD2      HIS   8  57.759  17.442  -5.409
   63    HE1  HIS   8           HE1      HIS   8  59.482  20.199  -2.721
   64    H    GLY   9           HN       GLY   9  55.180  14.425  -1.359
   65    HA2  GLY   9           HA1      GLY   9  53.482  16.588  -2.383
   66    HA3  GLY   9           HA2      GLY   9  53.475  15.125  -3.388
   67    H    ARG  10           HN       ARG  10  54.098  13.983  -0.375
   68    HA   ARG  10           HA       ARG  10  52.795  12.892   1.192
   69    HB2  ARG  10           HB2      ARG  10  50.598  14.905   0.604
   70    HB3  ARG  10           HB1      ARG  10  50.925  14.043   2.121
   71    HG2  ARG  10           HG2      ARG  10  52.698  16.169   0.838
   72    HG3  ARG  10           HG1      ARG  10  51.701  16.368   2.295
   73    HD2  ARG  10           HD2      ARG  10  54.178  14.647   1.930
   74    HD3  ARG  10           HD1      ARG  10  53.898  15.946   3.110
   75    HE   ARG  10           HE       ARG  10  51.944  13.964   3.610
   76   HH11  ARG  10          HH11      ARG  10  54.226  12.130   2.921
   77   HH12  ARG  10          HH12      ARG  10  54.997  11.928   4.458
   78   HH21  ARG  10          HH21      ARG  10  53.425  14.664   5.901
   79   HH22  ARG  10          HH22      ARG  10  54.544  13.364   6.146
   80    H    HIS  11           HN       HIS  11  52.666  12.224  -1.712
   81    HA   HIS  11           HA       HIS  11  49.888  11.120  -1.853
   82    HB2  HIS  11           HB2      HIS  11  50.868  12.352  -3.855
   83    HB3  HIS  11           HB1      HIS  11  52.051  11.029  -3.991
   84    HD1  HIS  11           HD1      HIS  11  48.436  11.900  -4.556
   85    HD2  HIS  11           HD2      HIS  11  50.904   8.499  -4.761
   86    HE1  HIS  11           HE1      HIS  11  47.130  10.086  -5.794
   87    H    ALA  12           HN       ALA  12  50.444   9.952  -0.059
   88    HA   ALA  12           HA       ALA  12  50.590   7.208  -0.549
   89    HB1  ALA  12           HB1      ALA  12  52.984   8.656   0.341
   90    HB2  ALA  12           HB2      ALA  12  52.923   7.583  -1.079
   91    HB3  ALA  12           HB3      ALA  12  52.861   6.909   0.562
   92    H    ALA  13           HN       ALA  13  51.428  10.073   1.237
   93    HA   ALA  13           HA       ALA  13  50.704   8.992   3.882
   94    HB1  ALA  13           HB1      ALA  13  50.390  11.808   2.690
   95    HB2  ALA  13           HB2      ALA  13  51.813  11.277   3.617
   96    HB3  ALA  13           HB3      ALA  13  50.221  11.381   4.408
   97    H    LYS  14           HN       LYS  14  50.037   9.054   0.733
   98    HA   LYS  14           HA       LYS  14  46.939   8.999   1.040
   99    HB2  LYS  14           HB2      LYS  14  48.278  10.622  -0.475
  100    HB3  LYS  14           HB1      LYS  14  48.780   9.129  -1.375
  101    HG2  LYS  14           HG2      LYS  14  46.691   8.964  -2.406
  102    HG3  LYS  14           HG1      LYS  14  45.795   9.465  -0.951
  103    HD2  LYS  14           HD2      LYS  14  46.299  11.812  -1.393
  104    HD3  LYS  14           HD1      LYS  14  47.364  11.368  -2.749
  105    HE2  LYS  14           HE2      LYS  14  45.075  12.101  -3.489
  106    HE3  LYS  14           HE1      LYS  14  45.478  10.442  -3.993
  107    HZ1  LYS  14           HZ1      LYS  14  44.000   9.546  -2.538
  108    HZ2  LYS  14           HZ2      LYS  14  43.212  11.027  -2.801
  109    HZ3  LYS  14           HZ3      LYS  14  44.152  10.798  -1.405
  110    H    HIS  15           HN       HIS  15  46.334   7.765  -1.239
  111    HA   HIS  15           HA       HIS  15  45.802   5.568  -1.860
  112    HB2  HIS  15           HB2      HIS  15  47.628   6.449  -3.360
  113    HB3  HIS  15           HB1      HIS  15  48.801   5.575  -2.347
  114    HD1  HIS  15           HD1      HIS  15  45.831   4.992  -4.670
  115    HD2  HIS  15           HD2      HIS  15  48.954   2.827  -2.866
  116    HE1  HIS  15           HE1      HIS  15  45.793   2.636  -5.657
  117    H    ILE  16           HN       ILE  16  46.741   5.902   1.009
  118    HA   ILE  16           HA       ILE  16  46.492   3.418   1.889
  119    HB   ILE  16           HB       ILE  16  48.471   2.470   0.854
  120   HG12  ILE  16          HG12      ILE  16  49.580   3.180   3.594
  121   HG13  ILE  16          HG11      ILE  16  48.113   2.185   3.476
  122   HG21  ILE  16          HG21      ILE  16  49.838   5.011   1.856
  123   HG22  ILE  16          HG22      ILE  16  49.647   4.519   0.166
  124   HG23  ILE  16          HG23      ILE  16  50.737   3.624   1.240
  125   HD11  ILE  16           HD1      ILE  16  49.377   0.612   1.948
  126   HD12  ILE  16           HD2      ILE  16  50.024   0.698   3.602
  127   HD13  ILE  16           HD3      ILE  16  50.850   1.552   2.282
  128    H    GLY  17           HN       GLY  17  48.338   6.152   2.186
  129    HA2  GLY  17           HA1      GLY  17  48.144   6.194   5.112
  130    HA3  GLY  17           HA2      GLY  17  48.730   7.507   4.076
  131    H    HIS  18           HN       HIS  18  46.242   6.699   2.303
  132    HA   HIS  18           HA       HIS  18  44.381   8.616   3.719
  133    HB2  HIS  18           HB2      HIS  18  44.716   8.907   1.275
  134    HB3  HIS  18           HB1      HIS  18  44.120   7.256   0.996
  135    HD1  HIS  18           HD1      HIS  18  42.289   8.680   3.781
  136    HD2  HIS  18           HD2      HIS  18  42.052   9.036  -0.403
  137    HE1  HIS  18           HE1      HIS  18  39.966   9.586   3.224
  138    H    ALA  19           HN       ALA  19  44.773   5.250   2.744
  139    HA   ALA  19           HA       ALA  19  42.787   4.425   4.750
  140    HB1  ALA  19           HB1      ALA  19  42.173   4.165   1.778
  141    HB2  ALA  19           HB2      ALA  19  41.187   4.913   3.064
  142    HB3  ALA  19           HB3      ALA  19  41.405   3.150   3.029
  143    H    ALA  20           HN       ALA  20  43.834   3.000   1.663
  144    HA   ALA  20           HA       ALA  20  45.893   1.351   2.867
  145    HB1  ALA  20           HB1      ALA  20  44.779  -0.823   2.545
  146    HB2  ALA  20           HB2      ALA  20  43.273   0.009   2.090
  147    HB3  ALA  20           HB3      ALA  20  43.909   0.162   3.745
  148    H    VAL  21           HN       VAL  21  43.754   2.393   0.386
  149    HA   VAL  21           HA       VAL  21  45.802   1.840  -1.681
  150    HB   VAL  21           HB       VAL  21  42.920   0.879  -2.031
  151   HG11  VAL  21          HG11      VAL  21  43.827   1.533  -4.150
  152   HG12  VAL  21          HG12      VAL  21  44.020  -0.229  -4.084
  153   HG13  VAL  21          HG13      VAL  21  45.416   0.829  -3.777
  154   HG21  VAL  21          HG21      VAL  21  45.500  -0.648  -1.461
  155   HG22  VAL  21          HG22      VAL  21  44.023  -1.421  -2.083
  156   HG23  VAL  21          HG23      VAL  21  44.008  -0.640  -0.490
  157    H    ASN  22           HN       ASN  22  43.256   3.596  -0.242
  158    HA   ASN  22           HA       ASN  22  43.543   6.041  -1.405
  159    HB2  ASN  22           HB2      ASN  22  43.279   5.382  -3.682
  160    HB3  ASN  22           HB1      ASN  22  41.945   4.270  -3.282
  161   HD21  ASN  22          HD21      ASN  22  40.026   5.090  -4.124
  162   HD22  ASN  22          HD22      ASN  22  39.576   6.798  -4.104
  163    H    HIS  23           HN       HIS  23  41.146   3.530  -0.763
  164    HA   HIS  23           HA       HIS  23  39.812   5.187   1.229
  165    HB2  HIS  23           HB2      HIS  23  37.653   5.391   0.142
  166    HB3  HIS  23           HB1      HIS  23  38.892   6.145  -0.887
  167    HD1  HIS  23           HD1      HIS  23  36.011   4.607  -1.625
  168    HD2  HIS  23           HD2      HIS  23  39.951   3.343  -2.386
  169    HE1  HIS  23           HE1      HIS  23  35.918   2.954  -3.571
  170    H    TYR  24           HN       TYR  24  39.303   3.799   2.786
  171    HA   TYR  24           HA       TYR  24  39.158   0.942   2.260
  172    HB2  TYR  24           HB2      TYR  24  38.587   0.766   4.649
  173    HB3  TYR  24           HB1      TYR  24  39.970   1.864   4.415
  174    HD1  TYR  24           HD1      TYR  24  36.288   1.713   5.036
  175    HD2  TYR  24           HD2      TYR  24  39.811   4.207   4.964
  176    HE1  TYR  24           HE1      TYR  24  35.019   3.537   6.161
  177    HE2  TYR  24           HE2      TYR  24  38.540   6.032   6.089
  178    HH   TYR  24           HH       TYR  24  35.747   5.539   7.731
  179    H    LEU  25           HN       LEU  25  37.070   3.374   1.534
  180    HA   LEU  25           HA       LEU  25  34.552   2.322   2.459
  181    HB2  LEU  25           HB2      LEU  25  35.033   4.672   1.577
  182    HB3  LEU  25           HB1      LEU  25  35.040   3.964  -0.051
  183    HG   LEU  25           HG       LEU  25  32.682   2.967   0.646
  184   HD11  LEU  25          HD11      LEU  25  31.455   4.569   2.173
  185   HD12  LEU  25          HD12      LEU  25  33.024   5.282   2.611
  186   HD13  LEU  25          HD13      LEU  25  32.677   3.582   3.005
  187   HD21  LEU  25          HD21      LEU  25  33.092   5.941   0.094
  188   HD22  LEU  25          HD22      LEU  25  31.573   5.048  -0.153
  189   HD23  LEU  25          HD23      LEU  25  33.009   4.649  -1.127
  Start of MODEL   83
    1    H1   GLY   1           HT1      GLY   1  67.823  12.624  -6.384
    2    H2   GLY   1           HT2      GLY   1  67.405  11.712  -5.013
    3    H3   GLY   1           HT3      GLY   1  67.113  13.386  -5.048
    4    HA2  GLY   1           HA1      GLY   1  65.925  11.947  -7.210
    5    HA3  GLY   1           HA2      GLY   1  65.327  11.485  -5.604
    6    H    TRP   2           HN       TRP   2  66.200  14.438  -7.453
    7    HA   TRP   2           HA       TRP   2  65.158  16.505  -7.543
    8    HB2  TRP   2           HB2      TRP   2  62.704  14.765  -7.085
    9    HB3  TRP   2           HB1      TRP   2  62.658  16.475  -7.579
   10    HD1  TRP   2           HD1      TRP   2  62.884  13.056  -8.962
   11    HE1  TRP   2           HE1      TRP   2  63.445  13.092 -11.501
   12    HE3  TRP   2           HE3      TRP   2  64.259  17.966  -9.415
   13    HZ2  TRP   2           HZ2      TRP   2  64.368  15.014 -13.438
   14    HZ3  TRP   2           HZ3      TRP   2  64.977  18.880 -11.617
   15    HH2  TRP   2           HH2      TRP   2  65.032  17.410 -13.628
   16    H    GLY   3           HN       GLY   3  63.810  18.130  -6.342
   17    HA2  GLY   3           HA1      GLY   3  64.506  17.944  -3.486
   18    HA3  GLY   3           HA2      GLY   3  63.836  19.347  -4.340
   19    H    SER   4           HN       SER   4  61.892  16.921  -5.315
   20    HA   SER   4           HA       SER   4  59.690  16.409  -4.779
   21    HB2  SER   4           HB2      SER   4  59.327  15.442  -2.635
   22    HB3  SER   4           HB1      SER   4  61.038  15.137  -3.004
   23    HG   SER   4           HG       SER   4  61.074  15.992  -1.002
   24    H    ILE   5           HN       ILE   5  58.560  18.222  -5.355
   25    HA   ILE   5           HA       ILE   5  58.488  20.572  -3.604
   26    HB   ILE   5           HB       ILE   5  56.579  19.963  -5.898
   27   HG12  ILE   5          HG12      ILE   5  59.412  21.099  -5.995
   28   HG13  ILE   5          HG11      ILE   5  58.866  19.560  -6.702
   29   HG21  ILE   5          HG21      ILE   5  57.774  22.618  -5.004
   30   HG22  ILE   5          HG22      ILE   5  56.282  21.965  -4.287
   31   HG23  ILE   5          HG23      ILE   5  56.343  22.337  -6.026
   32   HD11  ILE   5           HD1      ILE   5  57.157  20.992  -8.034
   33   HD12  ILE   5           HD2      ILE   5  58.865  21.084  -8.528
   34   HD13  ILE   5           HD3      ILE   5  58.151  22.388  -7.550
   35    H    PHE   6           HN       PHE   6  56.467  17.731  -4.240
   36    HA   PHE   6           HA       PHE   6  54.958  18.266  -1.757
   37    HB2  PHE   6           HB2      PHE   6  53.622  18.287  -4.492
   38    HB3  PHE   6           HB1      PHE   6  52.741  18.035  -2.968
   39    HD1  PHE   6           HD1      PHE   6  53.265  19.814  -1.057
   40    HD2  PHE   6           HD2      PHE   6  53.870  20.508  -5.276
   41    HE1  PHE   6           HE1      PHE   6  53.181  22.274  -0.666
   42    HE2  PHE   6           HE2      PHE   6  53.784  22.966  -4.882
   43    HZ   PHE   6           HZ       PHE   6  53.489  23.848  -2.572
   44    H    LYS   7           HN       LYS   7  56.343  16.276  -4.091
   45    HA   LYS   7           HA       LYS   7  54.763  13.964  -4.134
   46    HB2  LYS   7           HB2      LYS   7  57.005  14.434  -5.308
   47    HB3  LYS   7           HB1      LYS   7  57.782  13.909  -3.801
   48    HG2  LYS   7           HG2      LYS   7  57.706  11.887  -4.997
   49    HG3  LYS   7           HG1      LYS   7  56.212  11.780  -4.044
   50    HD2  LYS   7           HD2      LYS   7  54.875  12.503  -5.952
   51    HD3  LYS   7           HD1      LYS   7  56.337  12.864  -6.899
   52    HE2  LYS   7           HE2      LYS   7  55.215  10.636  -7.429
   53    HE3  LYS   7           HE1      LYS   7  56.943  10.542  -7.018
   54    HZ1  LYS   7           HZ1      LYS   7  56.381   9.900  -4.791
   55    HZ2  LYS   7           HZ2      LYS   7  55.563   8.871  -5.867
   56    HZ3  LYS   7           HZ3      LYS   7  54.725  10.121  -5.079
   57    H    HIS   8           HN       HIS   8  57.639  14.201  -2.001
   58    HA   HIS   8           HA       HIS   8  56.393  12.285  -0.132
   59    HB2  HIS   8           HB2      HIS   8  59.049  13.773  -0.047
   60    HB3  HIS   8           HB1      HIS   8  58.548  12.489   1.080
   61    HD1  HIS   8           HD1      HIS   8  58.163  10.058   0.054
   62    HD2  HIS   8           HD2      HIS   8  59.967  12.844  -2.532
   63    HE1  HIS   8           HE1      HIS   8  59.173   8.747  -1.893
   64    H    GLY   9           HN       GLY   9  54.562  13.901   0.205
   65    HA2  GLY   9           HA1      GLY   9  54.759  14.978   2.815
   66    HA3  GLY   9           HA2      GLY   9  55.027  16.312   1.676
   67    H    ARG  10           HN       ARG  10  53.225  14.495  -0.184
   68    HA   ARG  10           HA       ARG  10  50.575  14.981   1.072
   69    HB2  ARG  10           HB2      ARG  10  51.521  16.369  -1.470
   70    HB3  ARG  10           HB1      ARG  10  49.811  16.229  -0.996
   71    HG2  ARG  10           HG2      ARG  10  50.424  17.333   1.209
   72    HG3  ARG  10           HG1      ARG  10  52.041  17.640   0.530
   73    HD2  ARG  10           HD2      ARG  10  50.679  19.622   0.175
   74    HD3  ARG  10           HD1      ARG  10  50.933  18.830  -1.398
   75    HE   ARG  10           HE       ARG  10  48.512  17.825  -0.264
   76   HH11  ARG  10          HH11      ARG  10  46.584  19.134  -0.293
   77   HH12  ARG  10          HH12      ARG  10  46.536  20.460  -1.407
   78   HH21  ARG  10          HH21      ARG  10  49.893  20.219  -2.246
   79   HH22  ARG  10          HH22      ARG  10  48.410  21.074  -2.513
   80    H    HIS  11           HN       HIS  11  52.349  12.756   0.075
   81    HA   HIS  11           HA       HIS  11  50.202  11.320  -1.332
   82    HB2  HIS  11           HB2      HIS  11  51.481  12.442  -3.199
   83    HB3  HIS  11           HB1      HIS  11  52.936  11.574  -2.652
   84    HD1  HIS  11           HD1      HIS  11  49.513  11.023  -4.207
   85    HD2  HIS  11           HD2      HIS  11  52.991   8.831  -3.315
   86    HE1  HIS  11           HE1      HIS  11  49.284   8.741  -5.332
   87    H    ALA  12           HN       ALA  12  50.279   9.263  -1.267
   88    HA   ALA  12           HA       ALA  12  50.733   7.165  -0.502
   89    HB1  ALA  12           HB1      ALA  12  53.198   8.285   0.565
   90    HB2  ALA  12           HB2      ALA  12  53.087   7.828  -1.138
   91    HB3  ALA  12           HB3      ALA  12  52.915   6.607   0.146
   92    H    ALA  13           HN       ALA  13  51.611  10.022   1.354
   93    HA   ALA  13           HA       ALA  13  51.053   8.772   3.945
   94    HB1  ALA  13           HB1      ALA  13  52.002  10.989   4.153
   95    HB2  ALA  13           HB2      ALA  13  50.258  11.253   4.386
   96    HB3  ALA  13           HB3      ALA  13  51.012  11.617   2.816
   97    H    LYS  14           HN       LYS  14  50.246   8.854   0.878
   98    HA   LYS  14           HA       LYS  14  47.153   8.779   1.335
   99    HB2  LYS  14           HB2      LYS  14  48.376  10.481  -0.234
  100    HB3  LYS  14           HB1      LYS  14  48.807   9.022  -1.205
  101    HG2  LYS  14           HG2      LYS  14  46.662   8.881  -2.094
  102    HG3  LYS  14           HG1      LYS  14  45.870   9.252  -0.546
  103    HD2  LYS  14           HD2      LYS  14  46.378  11.660  -0.872
  104    HD3  LYS  14           HD1      LYS  14  47.159  11.280  -2.426
  105    HE2  LYS  14           HE2      LYS  14  44.274  10.550  -1.784
  106    HE3  LYS  14           HE1      LYS  14  44.741  12.059  -2.605
  107    HZ1  LYS  14           HZ1      LYS  14  44.940   9.277  -3.553
  108    HZ2  LYS  14           HZ2      LYS  14  46.050  10.427  -4.130
  109    HZ3  LYS  14           HZ3      LYS  14  44.383  10.656  -4.367
  110    H    HIS  15           HN       HIS  15  46.432   7.571  -0.951
  111    HA   HIS  15           HA       HIS  15  45.937   5.358  -1.566
  112    HB2  HIS  15           HB2      HIS  15  47.607   6.329  -3.180
  113    HB3  HIS  15           HB1      HIS  15  48.889   5.496  -2.267
  114    HD1  HIS  15           HD1      HIS  15  45.693   4.753  -4.245
  115    HD2  HIS  15           HD2      HIS  15  49.159   2.790  -2.890
  116    HE1  HIS  15           HE1      HIS  15  45.707   2.421  -5.292
  117    H    ILE  16           HN       ILE  16  46.997   5.654   1.236
  118    HA   ILE  16           HA       ILE  16  46.935   3.147   2.066
  119    HB   ILE  16           HB       ILE  16  48.892   2.315   0.919
  120   HG12  ILE  16          HG12      ILE  16  50.064   3.049   3.628
  121   HG13  ILE  16          HG11      ILE  16  48.685   1.935   3.520
  122   HG21  ILE  16          HG21      ILE  16  50.207   4.891   1.893
  123   HG22  ILE  16          HG22      ILE  16  49.942   4.424   0.205
  124   HG23  ILE  16          HG23      ILE  16  51.124   3.555   1.199
  125   HD11  ILE  16           HD1      ILE  16  50.636   0.553   3.535
  126   HD12  ILE  16           HD2      ILE  16  51.473   1.573   2.348
  127   HD13  ILE  16           HD3      ILE  16  50.090   0.572   1.844
  128    H    GLY  17           HN       GLY  17  48.700   5.937   2.330
  129    HA2  GLY  17           HA1      GLY  17  48.633   5.943   5.260
  130    HA3  GLY  17           HA2      GLY  17  49.103   7.297   4.216
  131    H    HIS  18           HN       HIS  18  46.602   6.411   2.539
  132    HA   HIS  18           HA       HIS  18  44.718   8.250   3.982
  133    HB2  HIS  18           HB2      HIS  18  44.949   8.276   1.455
  134    HB3  HIS  18           HB1      HIS  18  44.251   6.643   1.428
  135    HD1  HIS  18           HD1      HIS  18  43.262  10.033   1.013
  136    HD2  HIS  18           HD2      HIS  18  41.588   6.719   2.973
  137    HE1  HIS  18           HE1      HIS  18  40.800  10.562   1.437
  138    H    ALA  19           HN       ALA  19  45.149   4.862   3.045
  139    HA   ALA  19           HA       ALA  19  43.455   3.999   5.297
  140    HB1  ALA  19           HB1      ALA  19  41.630   4.364   3.833
  141    HB2  ALA  19           HB2      ALA  19  41.957   2.620   3.725
  142    HB3  ALA  19           HB3      ALA  19  42.504   3.712   2.423
  143    H    ALA  20           HN       ALA  20  44.284   2.636   2.113
  144    HA   ALA  20           HA       ALA  20  46.513   1.076   3.075
  145    HB1  ALA  20           HB1      ALA  20  45.399  -1.166   2.789
  146    HB2  ALA  20           HB2      ALA  20  43.832  -0.324   2.770
  147    HB3  ALA  20           HB3      ALA  20  44.858  -0.262   4.222
  148    H    VAL  21           HN       VAL  21  44.093   2.069   0.867
  149    HA   VAL  21           HA       VAL  21  45.870   1.465  -1.430
  150    HB   VAL  21           HB       VAL  21  42.931   0.642  -1.522
  151   HG11  VAL  21          HG11      VAL  21  43.917   1.151  -3.693
  152   HG12  VAL  21          HG12      VAL  21  43.757  -0.613  -3.544
  153   HG13  VAL  21          HG13      VAL  21  45.346   0.157  -3.325
  154   HG21  VAL  21          HG21      VAL  21  45.409  -1.055  -0.986
  155   HG22  VAL  21          HG22      VAL  21  43.829  -1.721  -1.454
  156   HG23  VAL  21          HG23      VAL  21  44.001  -0.844   0.082
  157    H    ASN  22           HN       ASN  22  43.460   3.268   0.244
  158    HA   ASN  22           HA       ASN  22  43.712   5.708  -0.972
  159    HB2  ASN  22           HB2      ASN  22  43.206   5.037  -3.198
  160    HB3  ASN  22           HB1      ASN  22  41.905   3.947  -2.658
  161   HD21  ASN  22          HD21      ASN  22  39.890   4.774  -3.205
  162   HD22  ASN  22          HD22      ASN  22  39.479   6.493  -3.207
  163    H    HIS  23           HN       HIS  23  41.291   3.284  -0.068
  164    HA   HIS  23           HA       HIS  23  40.259   4.992   2.052
  165    HB2  HIS  23           HB2      HIS  23  39.172   6.001   0.030
  166    HB3  HIS  23           HB1      HIS  23  38.406   4.426  -0.289
  167    HD1  HIS  23           HD1      HIS  23  36.213   4.007   0.833
  168    HD2  HIS  23           HD2      HIS  23  38.393   7.079   2.701
  169    HE1  HIS  23           HE1      HIS  23  34.746   4.959   2.695
  170    H    TYR  24           HN       TYR  24  41.187   2.153   1.080
  171    HA   TYR  24           HA       TYR  24  38.889   0.471   1.788
  172    HB2  TYR  24           HB2      TYR  24  40.645  -0.248   0.178
  173    HB3  TYR  24           HB1      TYR  24  41.837  -0.237   1.498
  174    HD1  TYR  24           HD1      TYR  24  42.156  -2.221   2.758
  175    HD2  TYR  24           HD2      TYR  24  38.443  -1.636   0.631
  176    HE1  TYR  24           HE1      TYR  24  41.425  -4.512   3.403
  177    HE2  TYR  24           HE2      TYR  24  37.714  -3.927   1.278
  178    HH   TYR  24           HH       TYR  24  38.811  -6.088   1.941
  179    H    LEU  25           HN       LEU  25  39.341   2.353   3.809
  180    HA   LEU  25           HA       LEU  25  41.003   1.688   5.931
  181    HB2  LEU  25           HB2      LEU  25  38.938   2.448   7.401
  182    HB3  LEU  25           HB1      LEU  25  39.706   3.604   6.291
  183    HG   LEU  25           HG       LEU  25  37.986   3.229   4.610
  184   HD11  LEU  25          HD11      LEU  25  37.488   0.893   4.809
  185   HD12  LEU  25          HD12      LEU  25  35.992   1.735   5.272
  186   HD13  LEU  25          HD13      LEU  25  37.054   1.057   6.528
  187   HD21  LEU  25          HD21      LEU  25  37.554   4.806   6.536
  188   HD22  LEU  25          HD22      LEU  25  36.656   3.494   7.339
  189   HD23  LEU  25          HD23      LEU  25  36.076   4.155   5.790
  Start of MODEL   84
    1    H1   GLY   1           HT1      GLY   1  65.808   7.085  -6.119
    2    H2   GLY   1           HT2      GLY   1  65.449   5.896  -4.959
    3    H3   GLY   1           HT3      GLY   1  66.899   6.776  -4.859
    4    HA2  GLY   1           HA1      GLY   1  64.154   7.655  -4.339
    5    HA3  GLY   1           HA2      GLY   1  65.566   7.715  -3.267
    6    H    TRP   2           HN       TRP   2  64.024   9.951  -3.602
    7    HA   TRP   2           HA       TRP   2  66.014  11.805  -4.728
    8    HB2  TRP   2           HB2      TRP   2  63.228  11.582  -5.938
    9    HB3  TRP   2           HB1      TRP   2  64.350  12.934  -6.219
   10    HD1  TRP   2           HD1      TRP   2  63.389   9.705  -7.634
   11    HE1  TRP   2           HE1      TRP   2  65.160   8.807  -9.313
   12    HE3  TRP   2           HE3      TRP   2  67.268  12.835  -6.466
   13    HZ2  TRP   2           HZ2      TRP   2  67.888   9.393 -10.027
   14    HZ3  TRP   2           HZ3      TRP   2  69.445  12.648  -7.658
   15    HH2  TRP   2           HH2      TRP   2  69.758  10.932  -9.437
   16    H    GLY   3           HN       GLY   3  65.255  14.119  -4.449
   17    HA2  GLY   3           HA1      GLY   3  64.261  14.389  -1.726
   18    HA3  GLY   3           HA2      GLY   3  64.721  15.700  -2.829
   19    H    SER   4           HN       SER   4  62.725  14.026  -4.707
   20    HA   SER   4           HA       SER   4  60.559  14.453  -5.429
   21    HB2  SER   4           HB2      SER   4  58.819  14.067  -3.818
   22    HB3  SER   4           HB1      SER   4  60.189  13.031  -3.359
   23    HG   SER   4           HG       SER   4  59.066  14.490  -1.715
   24    H    ILE   5           HN       ILE   5  58.433  15.883  -4.336
   25    HA   ILE   5           HA       ILE   5  59.301  18.552  -3.544
   26    HB   ILE   5           HB       ILE   5  59.900  18.609  -5.965
   27   HG12  ILE   5          HG12      ILE   5  57.407  20.272  -5.375
   28   HG13  ILE   5          HG11      ILE   5  59.009  20.627  -4.693
   29   HG21  ILE   5          HG21      ILE   5  58.225  18.337  -7.677
   30   HG22  ILE   5          HG22      ILE   5  56.918  18.242  -6.472
   31   HG23  ILE   5          HG23      ILE   5  58.104  16.923  -6.607
   32   HD11  ILE   5           HD1      ILE   5  59.861  20.633  -7.140
   33   HD12  ILE   5           HD2      ILE   5  58.848  22.003  -6.632
   34   HD13  ILE   5           HD3      ILE   5  58.144  20.693  -7.607
   35    H    PHE   6           HN       PHE   6  56.974  16.143  -4.363
   36    HA   PHE   6           HA       PHE   6  54.984  17.437  -2.662
   37    HB2  PHE   6           HB2      PHE   6  53.317  17.971  -4.220
   38    HB3  PHE   6           HB1      PHE   6  54.792  18.501  -5.054
   39    HD1  PHE   6           HD1      PHE   6  55.964  16.033  -6.120
   40    HD2  PHE   6           HD2      PHE   6  51.804  17.170  -5.851
   41    HE1  PHE   6           HE1      PHE   6  55.428  14.527  -8.023
   42    HE2  PHE   6           HE2      PHE   6  51.275  15.661  -7.757
   43    HZ   PHE   6           HZ       PHE   6  53.075  14.294  -8.802
   44    H    LYS   7           HN       LYS   7  56.140  14.854  -4.694
   45    HA   LYS   7           HA       LYS   7  54.016  12.984  -4.342
   46    HB2  LYS   7           HB2      LYS   7  55.912  12.715  -5.936
   47    HB3  LYS   7           HB1      LYS   7  57.003  12.435  -4.557
   48    HG2  LYS   7           HG2      LYS   7  55.897  10.403  -3.953
   49    HG3  LYS   7           HG1      LYS   7  54.498  10.759  -4.996
   50    HD2  LYS   7           HD2      LYS   7  55.934   9.072  -6.066
   51    HD3  LYS   7           HD1      LYS   7  55.972  10.585  -7.001
   52    HE2  LYS   7           HE2      LYS   7  58.138  11.162  -6.188
   53    HE3  LYS   7           HE1      LYS   7  58.053   9.967  -4.870
   54    HZ1  LYS   7           HZ1      LYS   7  59.005   9.626  -7.499
   55    HZ2  LYS   7           HZ2      LYS   7  57.663   8.609  -7.277
   56    HZ3  LYS   7           HZ3      LYS   7  58.992   8.507  -6.223
   57    H    HIS   8           HN       HIS   8  57.143  13.166  -2.571
   58    HA   HIS   8           HA       HIS   8  56.119  11.401  -0.462
   59    HB2  HIS   8           HB2      HIS   8  58.503  11.406  -1.170
   60    HB3  HIS   8           HB1      HIS   8  58.660  13.076  -0.574
   61    HD1  HIS   8           HD1      HIS   8  56.354  11.316   1.598
   62    HD2  HIS   8           HD2      HIS   8  60.540  11.598   1.291
   63    HE1  HIS   8           HE1      HIS   8  57.338  10.503   3.812
   64    H    GLY   9           HN       GLY   9  54.349  13.477  -0.643
   65    HA2  GLY   9           HA1      GLY   9  54.480  14.546   2.052
   66    HA3  GLY   9           HA2      GLY   9  54.788  15.797   0.831
   67    H    ARG  10           HN       ARG  10  52.993  14.123  -1.043
   68    HA   ARG  10           HA       ARG  10  50.327  14.728   0.193
   69    HB2  ARG  10           HB2      ARG  10  51.177  15.663  -2.580
   70    HB3  ARG  10           HB1      ARG  10  49.597  15.921  -1.801
   71    HG2  ARG  10           HG2      ARG  10  50.738  17.201   0.020
   72    HG3  ARG  10           HG1      ARG  10  52.281  17.009  -0.848
   73    HD2  ARG  10           HD2      ARG  10  51.318  19.190  -1.401
   74    HD3  ARG  10           HD1      ARG  10  51.254  18.142  -2.838
   75    HE   ARG  10           HE       ARG  10  48.796  17.784  -1.518
   76   HH11  ARG  10          HH11      ARG  10  47.534  19.836  -0.987
   77   HH12  ARG  10          HH12      ARG  10  47.505  20.989  -2.279
   78   HH21  ARG  10          HH21      ARG  10  50.099  19.491  -4.028
   79   HH22  ARG  10          HH22      ARG  10  48.957  20.794  -4.000
   80    H    HIS  11           HN       HIS  11  52.143  12.385  -0.748
   81    HA   HIS  11           HA       HIS  11  49.900  10.828  -1.829
   82    HB2  HIS  11           HB2      HIS  11  52.426  11.275  -3.474
   83    HB3  HIS  11           HB1      HIS  11  51.229   9.996  -3.792
   84    HD1  HIS  11           HD1      HIS  11  51.622  13.787  -3.751
   85    HD2  HIS  11           HD2      HIS  11  48.834  10.894  -4.993
   86    HE1  HIS  11           HE1      HIS  11  49.866  14.982  -5.173
   87    H    ALA  12           HN       ALA  12  50.016   8.787  -1.620
   88    HA   ALA  12           HA       ALA  12  50.599   6.748  -0.778
   89    HB1  ALA  12           HB1      ALA  12  52.851   6.256  -0.371
   90    HB2  ALA  12           HB2      ALA  12  53.154   7.970  -0.101
   91    HB3  ALA  12           HB3      ALA  12  52.851   7.389  -1.740
   92    H    ALA  13           HN       ALA  13  51.645   9.738   0.753
   93    HA   ALA  13           HA       ALA  13  51.428   8.672   3.473
   94    HB1  ALA  13           HB1      ALA  13  52.340  10.901   3.452
   95    HB2  ALA  13           HB2      ALA  13  50.617  11.184   3.800
   96    HB3  ALA  13           HB3      ALA  13  51.243  11.423   2.150
   97    H    LYS  14           HN       LYS  14  50.253   8.529   0.528
   98    HA   LYS  14           HA       LYS  14  47.242   8.457   1.365
   99    HB2  LYS  14           HB2      LYS  14  48.238  10.044  -0.466
  100    HB3  LYS  14           HB1      LYS  14  48.561   8.521  -1.376
  101    HG2  LYS  14           HG2      LYS  14  46.324   8.316  -1.981
  102    HG3  LYS  14           HG1      LYS  14  45.727   8.762  -0.368
  103    HD2  LYS  14           HD2      LYS  14  44.962  10.449  -1.907
  104    HD3  LYS  14           HD1      LYS  14  46.262  11.186  -0.945
  105    HE2  LYS  14           HE2      LYS  14  46.798  11.816  -3.164
  106    HE3  LYS  14           HE1      LYS  14  47.834  10.397  -2.894
  107    HZ1  LYS  14           HZ1      LYS  14  45.828   9.108  -3.831
  108    HZ2  LYS  14           HZ2      LYS  14  46.834   9.949  -4.912
  109    HZ3  LYS  14           HZ3      LYS  14  45.335  10.607  -4.455
  110    H    HIS  15           HN       HIS  15  46.263   7.074  -0.718
  111    HA   HIS  15           HA       HIS  15  45.736   4.814  -1.100
  112    HB2  HIS  15           HB2      HIS  15  48.572   4.977  -2.176
  113    HB3  HIS  15           HB1      HIS  15  47.280   3.883  -2.726
  114    HD1  HIS  15           HD1      HIS  15  48.882   6.718  -3.936
  115    HD2  HIS  15           HD2      HIS  15  44.819   5.938  -3.179
  116    HE1  HIS  15           HE1      HIS  15  47.516   8.316  -5.388
  117    H    ILE  16           HN       ILE  16  47.135   5.333   1.519
  118    HA   ILE  16           HA       ILE  16  47.226   2.891   2.532
  119    HB   ILE  16           HB       ILE  16  49.034   1.996   1.205
  120   HG12  ILE  16          HG12      ILE  16  50.543   2.934   3.672
  121   HG13  ILE  16          HG11      ILE  16  49.171   1.819   3.838
  122   HG21  ILE  16          HG21      ILE  16  49.945   4.056   0.208
  123   HG22  ILE  16          HG22      ILE  16  51.260   3.270   1.098
  124   HG23  ILE  16          HG23      ILE  16  50.421   4.646   1.810
  125   HD11  ILE  16           HD1      ILE  16  50.339   0.315   2.116
  126   HD12  ILE  16           HD2      ILE  16  51.136   0.451   3.697
  127   HD13  ILE  16           HD3      ILE  16  51.767   1.359   2.308
  128    H    GLY  17           HN       GLY  17  48.971   5.702   2.362
  129    HA2  GLY  17           HA1      GLY  17  49.276   5.930   5.264
  130    HA3  GLY  17           HA2      GLY  17  49.585   7.205   4.072
  131    H    HIS  18           HN       HIS  18  46.903   6.179   2.800
  132    HA   HIS  18           HA       HIS  18  45.192   8.107   4.330
  133    HB2  HIS  18           HB2      HIS  18  45.096   7.894   1.788
  134    HB3  HIS  18           HB1      HIS  18  44.390   6.282   2.018
  135    HD1  HIS  18           HD1      HIS  18  43.365   9.613   1.372
  136    HD2  HIS  18           HD2      HIS  18  41.986   6.600   3.952
  137    HE1  HIS  18           HE1      HIS  18  40.991  10.240   2.076
  138    H    ALA  19           HN       ALA  19  45.539   4.657   3.595
  139    HA   ALA  19           HA       ALA  19  44.220   3.957   6.137
  140    HB1  ALA  19           HB1      ALA  19  42.187   4.221   4.949
  141    HB2  ALA  19           HB2      ALA  19  42.509   2.473   4.917
  142    HB3  ALA  19           HB3      ALA  19  42.838   3.467   3.470
  143    H    ALA  20           HN       ALA  20  44.602   2.410   2.949
  144    HA   ALA  20           HA       ALA  20  46.931   0.879   3.720
  145    HB1  ALA  20           HB1      ALA  20  45.950  -1.313   3.895
  146    HB2  ALA  20           HB2      ALA  20  44.330  -0.680   3.520
  147    HB3  ALA  20           HB3      ALA  20  45.114  -0.264   5.063
  148    H    VAL  21           HN       VAL  21  44.297   1.814   1.742
  149    HA   VAL  21           HA       VAL  21  45.823   1.119  -0.703
  150    HB   VAL  21           HB       VAL  21  42.933   0.192  -0.337
  151   HG11  VAL  21          HG11      VAL  21  44.956   0.007  -2.609
  152   HG12  VAL  21          HG12      VAL  21  43.357   0.788  -2.633
  153   HG13  VAL  21          HG13      VAL  21  43.478  -0.982  -2.545
  154   HG21  VAL  21          HG21      VAL  21  43.994  -2.118  -0.570
  155   HG22  VAL  21          HG22      VAL  21  44.349  -1.286   0.957
  156   HG23  VAL  21          HG23      VAL  21  45.573  -1.336  -0.334
  157    H    ASN  22           HN       ASN  22  43.497   2.927   1.117
  158    HA   ASN  22           HA       ASN  22  43.606   5.306  -0.292
  159    HB2  ASN  22           HB2      ASN  22  42.794   4.442  -2.359
  160    HB3  ASN  22           HB1      ASN  22  41.590   3.414  -1.547
  161   HD21  ASN  22          HD21      ASN  22  42.410   6.825  -2.381
  162   HD22  ASN  22          HD22      ASN  22  40.750   7.413  -2.250
  163    H    HIS  23           HN       HIS  23  41.364   2.959   1.149
  164    HA   HIS  23           HA       HIS  23  40.661   4.768   3.289
  165    HB2  HIS  23           HB2      HIS  23  39.368   5.811   1.417
  166    HB3  HIS  23           HB1      HIS  23  38.495   4.274   1.218
  167    HD1  HIS  23           HD1      HIS  23  36.481   3.909   2.668
  168    HD2  HIS  23           HD2      HIS  23  39.032   6.878   4.209
  169    HE1  HIS  23           HE1      HIS  23  35.301   4.961   4.676
  170    H    TYR  24           HN       TYR  24  41.562   2.010   2.843
  171    HA   TYR  24           HA       TYR  24  39.563   0.062   3.076
  172    HB2  TYR  24           HB2      TYR  24  42.018  -0.379   2.956
  173    HB3  TYR  24           HB1      TYR  24  42.165   0.137   4.652
  174    HD1  TYR  24           HD1      TYR  24  40.355  -2.287   2.420
  175    HD2  TYR  24           HD2      TYR  24  41.734  -1.407   6.415
  176    HE1  TYR  24           HE1      TYR  24  39.673  -4.567   3.160
  177    HE2  TYR  24           HE2      TYR  24  41.053  -3.687   7.153
  178    HH   TYR  24           HH       TYR  24  40.652  -6.083   5.734
  179    H    LEU  25           HN       LEU  25  40.224   2.663   5.191
  180    HA   LEU  25           HA       LEU  25  39.426   3.206   7.296
  181    HB2  LEU  25           HB2      LEU  25  37.288   2.817   5.935
  182    HB3  LEU  25           HB1      LEU  25  37.205   1.219   6.707
  183    HG   LEU  25           HG       LEU  25  37.451   2.570   8.970
  184   HD11  LEU  25          HD11      LEU  25  36.518   4.729   7.019
  185   HD12  LEU  25          HD12      LEU  25  37.931   4.785   8.097
  186   HD13  LEU  25          HD13      LEU  25  36.293   4.829   8.778
  187   HD21  LEU  25          HD21      LEU  25  34.901   2.685   7.293
  188   HD22  LEU  25          HD22      LEU  25  34.982   2.865   9.063
  189   HD23  LEU  25          HD23      LEU  25  35.428   1.318   8.302
  Start of MODEL   85
    1    H1   GLY   1           HT1      GLY   1  68.437  21.359  -2.285
    2    H2   GLY   1           HT2      GLY   1  67.331  20.517  -3.263
    3    H3   GLY   1           HT3      GLY   1  68.117  19.721  -1.984
    4    HA2  GLY   1           HA1      GLY   1  66.894  21.920  -0.888
    5    HA3  GLY   1           HA2      GLY   1  65.722  21.169  -1.989
    6    H    TRP   2           HN       TRP   2  65.648  18.688  -1.831
    7    HA   TRP   2           HA       TRP   2  66.277  17.607   0.840
    8    HB2  TRP   2           HB2      TRP   2  63.399  18.083  -0.038
    9    HB3  TRP   2           HB1      TRP   2  63.878  17.022   1.308
   10    HD1  TRP   2           HD1      TRP   2  64.971  18.170   3.457
   11    HE1  TRP   2           HE1      TRP   2  64.853  20.589   4.404
   12    HE3  TRP   2           HE3      TRP   2  63.236  20.585  -0.710
   13    HZ2  TRP   2           HZ2      TRP   2  64.100  23.200   3.452
   14    HZ3  TRP   2           HZ3      TRP   2  62.824  23.040  -0.667
   15    HH2  TRP   2           HH2      TRP   2  63.254  24.349   1.408
   16    H    GLY   3           HN       GLY   3  63.524  16.648  -1.168
   17    HA2  GLY   3           HA1      GLY   3  64.803  14.867  -2.928
   18    HA3  GLY   3           HA2      GLY   3  64.536  13.966  -1.423
   19    H    SER   4           HN       SER   4  62.213  16.391  -1.776
   20    HA   SER   4           HA       SER   4  60.401  14.971  -3.565
   21    HB2  SER   4           HB2      SER   4  59.899  14.817  -0.568
   22    HB3  SER   4           HB1      SER   4  58.719  14.386  -1.825
   23    HG   SER   4           HG       SER   4  60.640  13.016  -2.589
   24    H    ILE   5           HN       ILE   5  59.286  16.537  -4.501
   25    HA   ILE   5           HA       ILE   5  59.119  19.183  -3.272
   26    HB   ILE   5           HB       ILE   5  59.328  18.723  -5.774
   27   HG12  ILE   5          HG12      ILE   5  57.039  20.447  -4.732
   28   HG13  ILE   5          HG11      ILE   5  58.730  20.939  -4.953
   29   HG21  ILE   5          HG21      ILE   5  56.327  18.238  -5.646
   30   HG22  ILE   5          HG22      ILE   5  57.502  16.901  -5.681
   31   HG23  ILE   5          HG23      ILE   5  57.418  18.049  -7.039
   32   HD11  ILE   5           HD1      ILE   5  56.662  20.291  -7.083
   33   HD12  ILE   5           HD2      ILE   5  58.406  20.304  -7.445
   34   HD13  ILE   5           HD3      ILE   5  57.603  21.786  -6.872
   35    H    PHE   6           HN       PHE   6  56.887  16.475  -3.905
   36    HA   PHE   6           HA       PHE   6  55.167  17.327  -1.706
   37    HB2  PHE   6           HB2      PHE   6  54.253  17.683  -4.584
   38    HB3  PHE   6           HB1      PHE   6  53.090  17.404  -3.269
   39    HD1  PHE   6           HD1      PHE   6  53.557  18.921  -1.074
   40    HD2  PHE   6           HD2      PHE   6  54.741  19.937  -5.103
   41    HE1  PHE   6           HE1      PHE   6  53.653  21.326  -0.443
   42    HE2  PHE   6           HE2      PHE   6  54.837  22.341  -4.466
   43    HZ   PHE   6           HZ       PHE   6  54.281  23.038  -2.141
   44    H    LYS   7           HN       LYS   7  56.677  15.055  -3.407
   45    HA   LYS   7           HA       LYS   7  54.748  13.034  -3.939
   46    HB2  LYS   7           HB2      LYS   7  57.539  12.535  -2.842
   47    HB3  LYS   7           HB1      LYS   7  56.572  11.476  -3.893
   48    HG2  LYS   7           HG2      LYS   7  57.683  14.219  -4.648
   49    HG3  LYS   7           HG1      LYS   7  58.308  12.647  -5.199
   50    HD2  LYS   7           HD2      LYS   7  55.891  12.227  -6.092
   51    HD3  LYS   7           HD1      LYS   7  55.660  13.979  -5.879
   52    HE2  LYS   7           HE2      LYS   7  57.709  12.579  -7.643
   53    HE3  LYS   7           HE1      LYS   7  56.379  13.646  -8.155
   54    HZ1  LYS   7           HZ1      LYS   7  57.453  15.507  -7.341
   55    HZ2  LYS   7           HZ2      LYS   7  58.750  14.601  -7.959
   56    HZ3  LYS   7           HZ3      LYS   7  58.448  14.628  -6.287
   57    H    HIS   8           HN       HIS   8  56.989  12.914  -1.142
   58    HA   HIS   8           HA       HIS   8  55.040  11.306   0.357
   59    HB2  HIS   8           HB2      HIS   8  57.548  10.990   0.456
   60    HB3  HIS   8           HB1      HIS   8  57.648  12.538   1.331
   61    HD1  HIS   8           HD1      HIS   8  57.936  12.061   3.761
   62    HD2  HIS   8           HD2      HIS   8  55.132   9.492   1.969
   63    HE1  HIS   8           HE1      HIS   8  57.000  10.555   5.600
   64    H    GLY   9           HN       GLY   9  53.902  13.763  -0.320
   65    HA2  GLY   9           HA1      GLY   9  53.208  14.731   2.349
   66    HA3  GLY   9           HA2      GLY   9  54.126  15.914   1.396
   67    H    ARG  10           HN       ARG  10  52.239  13.763  -0.485
   68    HA   ARG  10           HA       ARG  10  49.737  15.215  -0.342
   69    HB2  ARG  10           HB2      ARG  10  51.270  16.877  -1.515
   70    HB3  ARG  10           HB1      ARG  10  51.396  15.702  -2.845
   71    HG2  ARG  10           HG2      ARG  10  49.049  15.845  -3.328
   72    HG3  ARG  10           HG1      ARG  10  48.711  16.710  -1.812
   73    HD2  ARG  10           HD2      ARG  10  50.526  17.825  -3.988
   74    HD3  ARG  10           HD1      ARG  10  48.781  18.166  -3.907
   75    HE   ARG  10           HE       ARG  10  49.885  18.754  -1.355
   76   HH11  ARG  10          HH11      ARG  10  48.555  20.978  -1.848
   77   HH12  ARG  10          HH12      ARG  10  49.586  22.097  -2.676
   78   HH21  ARG  10          HH21      ARG  10  51.883  19.683  -3.632
   79   HH22  ARG  10          HH22      ARG  10  51.469  21.364  -3.686
   80    H    HIS  11           HN       HIS  11  51.690  12.679  -1.153
   81    HA   HIS  11           HA       HIS  11  49.447  11.127  -2.142
   82    HB2  HIS  11           HB2      HIS  11  50.141  12.304  -4.253
   83    HB3  HIS  11           HB1      HIS  11  51.755  11.571  -4.076
   84    HD1  HIS  11           HD1      HIS  11  51.988   9.561  -5.520
   85    HD2  HIS  11           HD2      HIS  11  48.126   9.879  -3.889
   86    HE1  HIS  11           HE1      HIS  11  50.639   7.561  -6.359
   87    H    ALA  12           HN       ALA  12  49.641   9.096  -2.021
   88    HA   ALA  12           HA       ALA  12  50.383   7.039  -1.375
   89    HB1  ALA  12           HB1      ALA  12  52.411   7.778  -2.700
   90    HB2  ALA  12           HB2      ALA  12  52.684   6.581  -1.409
   91    HB3  ALA  12           HB3      ALA  12  52.999   8.295  -1.129
   92    H    ALA  13           HN       ALA  13  51.697   9.961   0.099
   93    HA   ALA  13           HA       ALA  13  51.978   8.747   2.749
   94    HB1  ALA  13           HB1      ALA  13  51.503  11.570   1.661
   95    HB2  ALA  13           HB2      ALA  13  52.885  10.991   2.622
   96    HB3  ALA  13           HB3      ALA  13  51.295  11.211   3.391
   97    H    LYS  14           HN       LYS  14  50.273   8.792   0.058
   98    HA   LYS  14           HA       LYS  14  47.465   8.656   1.426
   99    HB2  LYS  14           HB2      LYS  14  48.120  10.309  -0.494
  100    HB3  LYS  14           HB1      LYS  14  48.269   8.818  -1.499
  101    HG2  LYS  14           HG2      LYS  14  45.956   8.597  -1.667
  102    HG3  LYS  14           HG1      LYS  14  45.665   9.085   0.019
  103    HD2  LYS  14           HD2      LYS  14  45.937  11.447  -0.584
  104    HD3  LYS  14           HD1      LYS  14  46.358  10.999  -2.255
  105    HE2  LYS  14           HE2      LYS  14  44.115   9.909  -2.488
  106    HE3  LYS  14           HE1      LYS  14  43.698  10.482  -0.856
  107    HZ1  LYS  14           HZ1      LYS  14  43.779  11.925  -3.344
  108    HZ2  LYS  14           HZ2      LYS  14  44.627  12.713  -2.101
  109    HZ3  LYS  14           HZ3      LYS  14  42.990  12.311  -1.893
  110    H    HIS  15           HN       HIS  15  46.110   7.378  -0.445
  111    HA   HIS  15           HA       HIS  15  45.471   5.157  -0.825
  112    HB2  HIS  15           HB2      HIS  15  46.530   6.050  -2.910
  113    HB3  HIS  15           HB1      HIS  15  48.061   5.294  -2.408
  114    HD1  HIS  15           HD1      HIS  15  48.420   2.958  -3.201
  115    HD2  HIS  15           HD2      HIS  15  44.348   3.997  -3.137
  116    HE1  HIS  15           HE1      HIS  15  47.111   0.964  -4.115
  117    H    ILE  16           HN       ILE  16  47.459   5.574   1.447
  118    HA   ILE  16           HA       ILE  16  47.641   3.067   2.358
  119    HB   ILE  16           HB       ILE  16  49.108   2.235   0.671
  120   HG12  ILE  16          HG12      ILE  16  51.219   1.751   1.834
  121   HG13  ILE  16          HG11      ILE  16  50.883   3.025   3.023
  122   HG21  ILE  16          HG21      ILE  16  49.846   4.305  -0.407
  123   HG22  ILE  16          HG22      ILE  16  51.299   3.461   0.170
  124   HG23  ILE  16          HG23      ILE  16  50.653   4.825   1.084
  125   HD11  ILE  16           HD1      ILE  16  48.970   1.833   3.882
  126   HD12  ILE  16           HD2      ILE  16  50.280   0.639   3.739
  127   HD13  ILE  16           HD3      ILE  16  48.989   0.694   2.517
  128    H    GLY  17           HN       GLY  17  49.421   5.838   1.992
  129    HA2  GLY  17           HA1      GLY  17  50.224   5.929   4.807
  130    HA3  GLY  17           HA2      GLY  17  50.365   7.252   3.634
  131    H    HIS  18           HN       HIS  18  47.460   6.341   2.841
  132    HA   HIS  18           HA       HIS  18  46.129   8.164   4.852
  133    HB2  HIS  18           HB2      HIS  18  45.606   7.342   2.009
  134    HB3  HIS  18           HB1      HIS  18  44.163   7.574   3.017
  135    HD1  HIS  18           HD1      HIS  18  47.285   9.627   3.625
  136    HD2  HIS  18           HD2      HIS  18  43.481  10.075   1.895
  137    HE1  HIS  18           HE1      HIS  18  46.965  12.110   3.122
  138    H    ALA  19           HN       ALA  19  45.834   4.868   3.388
  139    HA   ALA  19           HA       ALA  19  45.157   3.506   5.724
  140    HB1  ALA  19           HB1      ALA  19  42.788   5.003   4.599
  141    HB2  ALA  19           HB2      ALA  19  43.205   4.659   6.296
  142    HB3  ALA  19           HB3      ALA  19  42.521   3.378   5.275
  143    H    ALA  20           HN       ALA  20  45.876   3.620   2.633
  144    HA   ALA  20           HA       ALA  20  45.902   2.062   0.910
  145    HB1  ALA  20           HB1      ALA  20  44.977   0.013   2.948
  146    HB2  ALA  20           HB2      ALA  20  46.648   0.621   2.894
  147    HB3  ALA  20           HB3      ALA  20  45.970  -0.244   1.493
  148    H    VAL  21           HN       VAL  21  43.323   3.295   2.239
  149    HA   VAL  21           HA       VAL  21  41.452   2.090   0.261
  150    HB   VAL  21           HB       VAL  21  40.818   2.337   3.238
  151   HG11  VAL  21          HG11      VAL  21  39.159   1.663   0.776
  152   HG12  VAL  21          HG12      VAL  21  38.795   2.810   2.089
  153   HG13  VAL  21          HG13      VAL  21  38.685   1.064   2.383
  154   HG21  VAL  21          HG21      VAL  21  40.532  -0.189   3.037
  155   HG22  VAL  21          HG22      VAL  21  42.205   0.380   2.860
  156   HG23  VAL  21          HG23      VAL  21  41.266  -0.074   1.419
  157    H    ASN  22           HN       ASN  22  42.857   4.596   1.959
  158    HA   ASN  22           HA       ASN  22  42.636   6.895   1.355
  159    HB2  ASN  22           HB2      ASN  22  39.651   6.498   0.966
  160    HB3  ASN  22           HB1      ASN  22  40.638   7.905   0.529
  161   HD21  ASN  22          HD21      ASN  22  42.920   6.404  -0.562
  162   HD22  ASN  22          HD22      ASN  22  42.361   5.688  -2.077
  163    H    HIS  23           HN       HIS  23  40.268   5.102   3.257
  164    HA   HIS  23           HA       HIS  23  40.905   6.661   5.622
  165    HB2  HIS  23           HB2      HIS  23  39.452   8.315   4.556
  166    HB3  HIS  23           HB1      HIS  23  38.183   7.090   4.321
  167    HD1  HIS  23           HD1      HIS  23  40.158   8.754   7.169
  168    HD2  HIS  23           HD2      HIS  23  36.436   6.930   6.460
  169    HE1  HIS  23           HE1      HIS  23  38.789   8.958   9.316
  170    H    TYR  24           HN       TYR  24  37.597   5.771   5.437
  171    HA   TYR  24           HA       TYR  24  36.400   4.006   6.311
  172    HB2  TYR  24           HB2      TYR  24  37.898   2.708   4.653
  173    HB3  TYR  24           HB1      TYR  24  38.872   2.252   6.069
  174    HD1  TYR  24           HD1      TYR  24  37.924   0.835   7.858
  175    HD2  TYR  24           HD2      TYR  24  35.630   1.852   4.348
  176    HE1  TYR  24           HE1      TYR  24  36.287  -0.960   8.409
  177    HE2  TYR  24           HE2      TYR  24  33.993   0.057   4.897
  178    HH   TYR  24           HH       TYR  24  34.353  -2.351   6.567
  179    H    LEU  25           HN       LEU  25  39.176   5.269   7.737
  180    HA   LEU  25           HA       LEU  25  38.201   4.744  10.388
  181    HB2  LEU  25           HB2      LEU  25  40.332   3.414  11.098
  182    HB3  LEU  25           HB1      LEU  25  39.007   2.531  10.310
  183    HG   LEU  25           HG       LEU  25  40.184   2.697   8.130
  184   HD11  LEU  25          HD11      LEU  25  41.480   4.679   8.221
  185   HD12  LEU  25          HD12      LEU  25  42.703   3.398   8.347
  186   HD13  LEU  25          HD13      LEU  25  42.175   4.270   9.807
  187   HD21  LEU  25          HD21      LEU  25  42.020   1.639  10.321
  188   HD22  LEU  25          HD22      LEU  25  41.918   1.074   8.636
  189   HD23  LEU  25          HD23      LEU  25  40.560   0.795   9.754
  Start of MODEL   86
    1    H1   GLY   1           HT1      GLY   1  69.566  20.786  -1.377
    2    H2   GLY   1           HT2      GLY   1  68.352  19.959  -0.524
    3    H3   GLY   1           HT3      GLY   1  67.994  21.417  -1.319
    4    HA2  GLY   1           HA1      GLY   1  67.688  20.469  -3.248
    5    HA3  GLY   1           HA2      GLY   1  69.131  19.458  -3.037
    6    H    TRP   2           HN       TRP   2  65.899  19.841  -1.506
    7    HA   TRP   2           HA       TRP   2  65.751  17.037  -0.801
    8    HB2  TRP   2           HB2      TRP   2  63.631  19.210  -1.013
    9    HB3  TRP   2           HB1      TRP   2  63.325  17.577  -0.375
   10    HD1  TRP   2           HD1      TRP   2  65.704  20.568   0.290
   11    HE1  TRP   2           HE1      TRP   2  66.240  20.671   2.832
   12    HE3  TRP   2           HE3      TRP   2  63.191  16.378   1.812
   13    HZ2  TRP   2           HZ2      TRP   2  65.641  19.123   5.185
   14    HZ3  TRP   2           HZ3      TRP   2  63.186  15.709   4.210
   15    HH2  TRP   2           HH2      TRP   2  64.407  17.076   5.897
   16    H    GLY   3           HN       GLY   3  65.234  15.334  -2.000
   17    HA2  GLY   3           HA1      GLY   3  64.611  15.658  -4.806
   18    HA3  GLY   3           HA2      GLY   3  64.646  14.134  -3.896
   19    H    SER   4           HN       SER   4  62.725  15.431  -1.900
   20    HA   SER   4           HA       SER   4  60.249  14.725  -3.434
   21    HB2  SER   4           HB2      SER   4  60.691  15.114  -0.447
   22    HB3  SER   4           HB1      SER   4  59.214  14.504  -1.226
   23    HG   SER   4           HG       SER   4  61.693  13.282  -0.821
   24    H    ILE   5           HN       ILE   5  59.859  16.619  -4.594
   25    HA   ILE   5           HA       ILE   5  59.901  19.233  -3.368
   26    HB   ILE   5           HB       ILE   5  58.210  18.418  -5.768
   27   HG12  ILE   5          HG12      ILE   5  61.184  19.095  -5.630
   28   HG13  ILE   5          HG11      ILE   5  60.483  17.522  -6.077
   29   HG21  ILE   5          HG21      ILE   5  58.046  20.752  -4.686
   30   HG22  ILE   5          HG22      ILE   5  58.435  20.713  -6.419
   31   HG23  ILE   5          HG23      ILE   5  59.722  21.005  -5.224
   32   HD11  ILE   5           HD1      ILE   5  60.964  18.550  -8.162
   33   HD12  ILE   5           HD2      ILE   5  60.390  20.141  -7.612
   34   HD13  ILE   5           HD3      ILE   5  59.223  18.838  -7.941
   35    H    PHE   6           HN       PHE   6  57.409  16.748  -3.846
   36    HA   PHE   6           HA       PHE   6  55.833  17.835  -1.655
   37    HB2  PHE   6           HB2      PHE   6  53.801  18.340  -2.979
   38    HB3  PHE   6           HB1      PHE   6  55.144  19.432  -3.393
   39    HD1  PHE   6           HD1      PHE   6  53.292  16.367  -4.479
   40    HD2  PHE   6           HD2      PHE   6  56.080  19.463  -5.607
   41    HE1  PHE   6           HE1      PHE   6  53.139  15.640  -6.857
   42    HE2  PHE   6           HE2      PHE   6  55.927  18.734  -7.985
   43    HZ   PHE   6           HZ       PHE   6  54.412  16.858  -8.616
   44    H    LYS   7           HN       LYS   7  56.951  15.418  -3.563
   45    HA   LYS   7           HA       LYS   7  54.790  13.637  -3.938
   46    HB2  LYS   7           HB2      LYS   7  57.203  13.362  -4.704
   47    HB3  LYS   7           HB1      LYS   7  57.584  12.825  -3.049
   48    HG2  LYS   7           HG2      LYS   7  55.821  11.049  -3.268
   49    HG3  LYS   7           HG1      LYS   7  55.584  11.543  -4.963
   50    HD2  LYS   7           HD2      LYS   7  58.078  11.140  -5.317
   51    HD3  LYS   7           HD1      LYS   7  58.107  10.399  -3.698
   52    HE2  LYS   7           HE2      LYS   7  56.381   8.769  -4.407
   53    HE3  LYS   7           HE1      LYS   7  56.343   9.511  -6.025
   54    HZ1  LYS   7           HZ1      LYS   7  58.214   7.646  -4.923
   55    HZ2  LYS   7           HZ2      LYS   7  58.995   9.020  -5.546
   56    HZ3  LYS   7           HZ3      LYS   7  57.967   8.101  -6.538
   57    H    HIS   8           HN       HIS   8  57.132  13.588  -1.206
   58    HA   HIS   8           HA       HIS   8  55.350  11.888   0.376
   59    HB2  HIS   8           HB2      HIS   8  57.905  13.385   1.084
   60    HB3  HIS   8           HB1      HIS   8  57.072  12.232   2.154
   61    HD1  HIS   8           HD1      HIS   8  59.940  12.181   0.254
   62    HD2  HIS   8           HD2      HIS   8  56.475   9.812   0.026
   63    HE1  HIS   8           HE1      HIS   8  60.589   9.992  -0.892
   64    H    GLY   9           HN       GLY   9  53.572  13.619  -0.035
   65    HA2  GLY   9           HA1      GLY   9  53.036  14.863   2.486
   66    HA3  GLY   9           HA2      GLY   9  53.598  16.095   1.338
   67    H    ARG  10           HN       ARG  10  52.360  14.105  -0.773
   68    HA   ARG  10           HA       ARG  10  49.471  14.767  -0.324
   69    HB2  ARG  10           HB2      ARG  10  51.016  15.444  -2.864
   70    HB3  ARG  10           HB1      ARG  10  49.271  15.670  -2.598
   71    HG2  ARG  10           HG2      ARG  10  49.781  17.216  -0.705
   72    HG3  ARG  10           HG1      ARG  10  51.517  17.034  -1.051
   73    HD2  ARG  10           HD2      ARG  10  51.142  17.904  -3.350
   74    HD3  ARG  10           HD1      ARG  10  49.415  18.119  -2.977
   75    HE   ARG  10           HE       ARG  10  51.564  19.892  -2.154
   76   HH11  ARG  10          HH11      ARG  10  48.348  19.909  -2.463
   77   HH12  ARG  10          HH12      ARG  10  47.965  20.617  -0.929
   78   HH21  ARG  10          HH21      ARG  10  51.161  20.216   0.353
   79   HH22  ARG  10          HH22      ARG  10  49.558  20.792   0.665
   80    H    HIS  11           HN       HIS  11  51.695  12.475  -0.778
   81    HA   HIS  11           HA       HIS  11  49.731  10.633  -1.950
   82    HB2  HIS  11           HB2      HIS  11  52.359  11.192  -3.385
   83    HB3  HIS  11           HB1      HIS  11  51.264   9.836  -3.747
   84    HD1  HIS  11           HD1      HIS  11  48.585  10.791  -4.084
   85    HD2  HIS  11           HD2      HIS  11  51.784  13.373  -4.966
   86    HE1  HIS  11           HE1      HIS  11  47.693  12.597  -5.654
   87    H    ALA  12           HN       ALA  12  50.034   8.624  -1.607
   88    HA   ALA  12           HA       ALA  12  50.731   6.705  -0.587
   89    HB1  ALA  12           HB1      ALA  12  52.981   7.530  -1.412
   90    HB2  ALA  12           HB2      ALA  12  52.982   6.468   0.018
   91    HB3  ALA  12           HB3      ALA  12  53.088   8.221   0.197
   92    H    ALA  13           HN       ALA  13  51.391   9.852   0.858
   93    HA   ALA  13           HA       ALA  13  51.066   8.900   3.607
   94    HB1  ALA  13           HB1      ALA  13  51.857  11.283   3.000
   95    HB2  ALA  13           HB2      ALA  13  50.433  11.238   4.068
   96    HB3  ALA  13           HB3      ALA  13  50.234  11.569   2.330
   97    H    LYS  14           HN       LYS  14  50.118   8.545   0.590
   98    HA   LYS  14           HA       LYS  14  47.063   8.239   1.206
   99    HB2  LYS  14           HB2      LYS  14  48.073   9.800  -0.636
  100    HB3  LYS  14           HB1      LYS  14  48.601   8.262  -1.417
  101    HG2  LYS  14           HG2      LYS  14  46.443   7.801  -2.160
  102    HG3  LYS  14           HG1      LYS  14  45.676   8.360  -0.656
  103    HD2  LYS  14           HD2      LYS  14  45.823  10.675  -1.366
  104    HD3  LYS  14           HD1      LYS  14  46.818  10.232  -2.775
  105    HE2  LYS  14           HE2      LYS  14  44.282  10.629  -3.177
  106    HE3  LYS  14           HE1      LYS  14  45.004   9.154  -3.865
  107    HZ1  LYS  14           HZ1      LYS  14  42.982   8.580  -2.755
  108    HZ2  LYS  14           HZ2      LYS  14  43.453   9.381  -1.334
  109    HZ3  LYS  14           HZ3      LYS  14  44.268   7.976  -1.829
  110    H    HIS  15           HN       HIS  15  46.366   6.682  -0.828
  111    HA   HIS  15           HA       HIS  15  46.047   4.381  -1.140
  112    HB2  HIS  15           HB2      HIS  15  48.936   4.738  -2.004
  113    HB3  HIS  15           HB1      HIS  15  47.807   3.484  -2.573
  114    HD1  HIS  15           HD1      HIS  15  45.254   5.128  -3.021
  115    HD2  HIS  15           HD2      HIS  15  49.078   6.375  -4.251
  116    HE1  HIS  15           HE1      HIS  15  44.932   6.840  -4.890
  117    H    ILE  16           HN       ILE  16  47.261   5.155   1.543
  118    HA   ILE  16           HA       ILE  16  47.422   2.768   2.696
  119    HB   ILE  16           HB       ILE  16  49.363   1.940   1.541
  120   HG12  ILE  16          HG12      ILE  16  50.535   3.156   4.073
  121   HG13  ILE  16          HG11      ILE  16  49.370   1.816   4.121
  122   HG21  ILE  16          HG21      ILE  16  50.531   4.714   2.063
  123   HG22  ILE  16          HG22      ILE  16  50.183   4.008   0.477
  124   HG23  ILE  16          HG23      ILE  16  51.496   3.360   1.474
  125   HD11  ILE  16           HD1      ILE  16  51.051   0.659   2.415
  126   HD12  ILE  16           HD2      ILE  16  51.423   0.669   4.152
  127   HD13  ILE  16           HD3      ILE  16  52.216   1.834   3.073
  128    H    GLY  17           HN       GLY  17  49.015   5.666   2.494
  129    HA2  GLY  17           HA1      GLY  17  49.071   6.065   5.401
  130    HA3  GLY  17           HA2      GLY  17  49.461   7.274   4.162
  131    H    HIS  18           HN       HIS  18  46.894   6.039   2.783
  132    HA   HIS  18           HA       HIS  18  45.024   8.013   4.083
  133    HB2  HIS  18           HB2      HIS  18  45.290   6.701   1.415
  134    HB3  HIS  18           HB1      HIS  18  43.618   6.756   2.004
  135    HD1  HIS  18           HD1      HIS  18  43.009   8.524   0.163
  136    HD2  HIS  18           HD2      HIS  18  45.990   9.790   2.842
  137    HE1  HIS  18           HE1      HIS  18  43.240  11.055  -0.094
  138    H    ALA  19           HN       ALA  19  45.690   4.584   3.667
  139    HA   ALA  19           HA       ALA  19  44.032   3.922   5.954
  140    HB1  ALA  19           HB1      ALA  19  42.444   2.410   4.628
  141    HB2  ALA  19           HB2      ALA  19  42.923   3.343   3.185
  142    HB3  ALA  19           HB3      ALA  19  42.131   4.157   4.561
  143    H    ALA  20           HN       ALA  20  44.765   2.315   2.858
  144    HA   ALA  20           HA       ALA  20  46.992   0.802   3.890
  145    HB1  ALA  20           HB1      ALA  20  45.039  -0.288   5.100
  146    HB2  ALA  20           HB2      ALA  20  46.013  -1.377   4.083
  147    HB3  ALA  20           HB3      ALA  20  44.436  -0.793   3.503
  148    H    VAL  21           HN       VAL  21  44.516   1.625   1.654
  149    HA   VAL  21           HA       VAL  21  46.267   0.899  -0.620
  150    HB   VAL  21           HB       VAL  21  43.423  -0.199  -0.398
  151   HG11  VAL  21          HG11      VAL  21  44.133  -1.319  -2.602
  152   HG12  VAL  21          HG12      VAL  21  45.503  -0.186  -2.623
  153   HG13  VAL  21          HG13      VAL  21  43.835   0.430  -2.679
  154   HG21  VAL  21          HG21      VAL  21  46.175  -1.510  -0.311
  155   HG22  VAL  21          HG22      VAL  21  44.682  -2.422  -0.633
  156   HG23  VAL  21          HG23      VAL  21  44.891  -1.589   0.919
  157    H    ASN  22           HN       ASN  22  43.710   2.664   0.913
  158    HA   ASN  22           HA       ASN  22  43.852   4.976  -0.620
  159    HB2  ASN  22           HB2      ASN  22  43.203   3.952  -2.676
  160    HB3  ASN  22           HB1      ASN  22  41.968   2.951  -1.877
  161   HD21  ASN  22          HD21      ASN  22  40.065   3.686  -2.911
  162   HD22  ASN  22          HD22      ASN  22  39.556   5.377  -2.907
  163    H    HIS  23           HN       HIS  23  41.592   2.642   0.822
  164    HA   HIS  23           HA       HIS  23  40.697   4.579   2.784
  165    HB2  HIS  23           HB2      HIS  23  39.474   5.392   0.755
  166    HB3  HIS  23           HB1      HIS  23  38.679   3.803   0.649
  167    HD1  HIS  23           HD1      HIS  23  36.496   3.647   1.836
  168    HD2  HIS  23           HD2      HIS  23  39.019   6.534   3.565
  169    HE1  HIS  23           HE1      HIS  23  35.189   4.767   3.725
  170    H    TYR  24           HN       TYR  24  41.690   1.759   2.394
  171    HA   TYR  24           HA       TYR  24  39.732  -0.193   2.789
  172    HB2  TYR  24           HB2      TYR  24  42.243  -0.522   2.627
  173    HB3  TYR  24           HB1      TYR  24  42.340  -0.065   4.345
  174    HD1  TYR  24           HD1      TYR  24  41.081  -2.597   1.934
  175    HD2  TYR  24           HD2      TYR  24  41.500  -1.540   6.099
  176    HE1  TYR  24           HE1      TYR  24  40.466  -4.921   2.586
  177    HE2  TYR  24           HE2      TYR  24  40.886  -3.865   6.750
  178    HH   TYR  24           HH       TYR  24  39.338  -5.921   4.999
  179    H    LEU  25           HN       LEU  25  40.442   2.493   4.794
  180    HA   LEU  25           HA       LEU  25  39.852   1.476   7.370
  181    HB2  LEU  25           HB2      LEU  25  40.725   3.714   7.098
  182    HB3  LEU  25           HB1      LEU  25  39.332   4.197   6.109
  183    HG   LEU  25           HG       LEU  25  37.834   4.058   8.014
  184   HD11  LEU  25          HD11      LEU  25  38.563   2.139   9.223
  185   HD12  LEU  25          HD12      LEU  25  38.903   3.498  10.318
  186   HD13  LEU  25          HD13      LEU  25  40.224   2.760   9.380
  187   HD21  LEU  25          HD21      LEU  25  40.438   5.365   8.916
  188   HD22  LEU  25          HD22      LEU  25  38.793   5.784   9.454
  189   HD23  LEU  25          HD23      LEU  25  39.286   6.095   7.772
  Start of MODEL   87
    1    H1   GLY   1           HT1      GLY   1  65.533  24.091  -4.731
    2    H2   GLY   1           HT2      GLY   1  64.481  24.216  -6.059
    3    H3   GLY   1           HT3      GLY   1  66.143  24.512  -6.255
    4    HA2  GLY   1           HA1      GLY   1  65.260  22.323  -7.051
    5    HA3  GLY   1           HA2      GLY   1  66.719  22.327  -6.042
    6    H    TRP   2           HN       TRP   2  63.145  22.188  -5.783
    7    HA   TRP   2           HA       TRP   2  63.261  20.878  -3.179
    8    HB2  TRP   2           HB2      TRP   2  60.935  20.995  -5.135
    9    HB3  TRP   2           HB1      TRP   2  60.860  20.719  -3.378
   10    HD1  TRP   2           HD1      TRP   2  60.938  23.429  -5.951
   11    HE1  TRP   2           HE1      TRP   2  60.978  25.773  -4.826
   12    HE3  TRP   2           HE3      TRP   2  61.878  21.992  -1.128
   13    HZ2  TRP   2           HZ2      TRP   2  61.369  26.845  -2.182
   14    HZ3  TRP   2           HZ3      TRP   2  62.081  23.693   0.680
   15    HH2  TRP   2           HH2      TRP   2  61.827  26.115   0.157
   16    H    GLY   3           HN       GLY   3  62.288  19.798  -6.470
   17    HA2  GLY   3           HA1      GLY   3  62.473  17.702  -7.446
   18    HA3  GLY   3           HA2      GLY   3  63.579  17.236  -6.137
   19    H    SER   4           HN       SER   4  60.300  18.446  -5.625
   20    HA   SER   4           HA       SER   4  59.112  15.796  -5.385
   21    HB2  SER   4           HB2      SER   4  59.919  17.299  -2.869
   22    HB3  SER   4           HB1      SER   4  58.677  16.026  -2.891
   23    HG   SER   4           HG       SER   4  61.363  15.804  -2.884
   24    H    ILE   5           HN       ILE   5  57.430  16.568  -6.602
   25    HA   ILE   5           HA       ILE   5  56.104  19.089  -5.932
   26    HB   ILE   5           HB       ILE   5  54.987  16.853  -7.678
   27   HG12  ILE   5          HG12      ILE   5  57.001  19.042  -8.372
   28   HG13  ILE   5          HG11      ILE   5  57.295  17.288  -8.396
   29   HG21  ILE   5          HG21      ILE   5  53.748  18.612  -8.732
   30   HG22  ILE   5          HG22      ILE   5  54.730  19.876  -7.954
   31   HG23  ILE   5          HG23      ILE   5  53.593  18.909  -6.985
   32   HD11  ILE   5           HD1      ILE   5  56.861  17.833 -10.666
   33   HD12  ILE   5           HD2      ILE   5  55.536  18.939 -10.241
   34   HD13  ILE   5           HD3      ILE   5  55.312  17.179 -10.083
   35    H    PHE   6           HN       PHE   6  55.706  15.674  -5.166
   36    HA   PHE   6           HA       PHE   6  53.761  16.373  -3.069
   37    HB2  PHE   6           HB2      PHE   6  52.093  14.650  -3.939
   38    HB3  PHE   6           HB1      PHE   6  52.167  16.179  -4.845
   39    HD1  PHE   6           HD1      PHE   6  52.757  16.200  -7.163
   40    HD2  PHE   6           HD2      PHE   6  53.428  12.645  -4.807
   41    HE1  PHE   6           HE1      PHE   6  53.316  14.931  -9.233
   42    HE2  PHE   6           HE2      PHE   6  53.986  11.379  -6.878
   43    HZ   PHE   6           HZ       PHE   6  53.842  12.501  -9.099
   44    H    LYS   7           HN       LYS   7  56.449  14.926  -3.884
   45    HA   LYS   7           HA       LYS   7  55.991  12.203  -2.886
   46    HB2  LYS   7           HB2      LYS   7  58.630  13.677  -3.223
   47    HB3  LYS   7           HB1      LYS   7  58.368  11.918  -3.159
   48    HG2  LYS   7           HG2      LYS   7  57.023  12.042  -5.240
   49    HG3  LYS   7           HG1      LYS   7  57.303  13.799  -5.311
   50    HD2  LYS   7           HD2      LYS   7  59.746  13.406  -5.448
   51    HD3  LYS   7           HD1      LYS   7  59.466  11.649  -5.383
   52    HE2  LYS   7           HE2      LYS   7  58.280  13.477  -7.512
   53    HE3  LYS   7           HE1      LYS   7  59.789  12.558  -7.723
   54    HZ1  LYS   7           HZ1      LYS   7  58.496  10.888  -8.377
   55    HZ2  LYS   7           HZ2      LYS   7  57.075  11.657  -7.853
   56    HZ3  LYS   7           HZ3      LYS   7  57.993  10.729  -6.766
   57    H    HIS   8           HN       HIS   8  56.867  15.338  -1.588
   58    HA   HIS   8           HA       HIS   8  57.921  14.266   0.932
   59    HB2  HIS   8           HB2      HIS   8  57.094  17.052   0.030
   60    HB3  HIS   8           HB1      HIS   8  57.759  16.694   1.640
   61    HD1  HIS   8           HD1      HIS   8  59.651  18.458   0.506
   62    HD2  HIS   8           HD2      HIS   8  59.545  14.499  -0.904
   63    HE1  HIS   8           HE1      HIS   8  61.908  17.980  -0.590
   64    H    GLY   9           HN       GLY   9  56.067  12.827   1.355
   65    HA2  GLY   9           HA1      GLY   9  54.087  12.339   2.447
   66    HA3  GLY   9           HA2      GLY   9  54.443  13.778   3.422
   67    H    ARG  10           HN       ARG  10  52.821  12.566   0.513
   68    HA   ARG  10           HA       ARG  10  50.590  14.348   0.921
   69    HB2  ARG  10           HB2      ARG  10  52.420  15.882  -0.081
   70    HB3  ARG  10           HB1      ARG  10  52.190  14.969  -1.588
   71    HG2  ARG  10           HG2      ARG  10  49.812  15.577  -1.636
   72    HG3  ARG  10           HG1      ARG  10  49.964  16.402  -0.067
   73    HD2  ARG  10           HD2      ARG  10  51.497  18.040  -1.016
   74    HD3  ARG  10           HD1      ARG  10  51.540  17.161  -2.563
   75    HE   ARG  10           HE       ARG  10  48.824  17.804  -1.995
   76   HH11  ARG  10          HH11      ARG  10  47.888  19.576  -3.038
   77   HH12  ARG  10          HH12      ARG  10  48.903  20.826  -3.674
   78   HH21  ARG  10          HH21      ARG  10  51.854  19.303  -2.676
   79   HH22  ARG  10          HH22      ARG  10  51.149  20.672  -3.469
   80    H    HIS  11           HN       HIS  11  52.151  11.717  -0.318
   81    HA   HIS  11           HA       HIS  11  49.687  10.708  -1.541
   82    HB2  HIS  11           HB2      HIS  11  50.709  11.935  -3.461
   83    HB3  HIS  11           HB1      HIS  11  52.193  10.974  -3.255
   84    HD1  HIS  11           HD1      HIS  11  48.540  10.681  -4.270
   85    HD2  HIS  11           HD2      HIS  11  52.057   8.381  -4.322
   86    HE1  HIS  11           HE1      HIS  11  48.046   8.564  -5.613
   87    H    ALA  12           HN       ALA  12  49.494   8.668  -1.598
   88    HA   ALA  12           HA       ALA  12  49.834   6.445  -1.147
   89    HB1  ALA  12           HB1      ALA  12  52.067   6.944  -2.249
   90    HB2  ALA  12           HB2      ALA  12  52.016   5.596  -1.085
   91    HB3  ALA  12           HB3      ALA  12  52.594   7.190  -0.593
   92    H    ALA  13           HN       ALA  13  51.494   8.958   0.681
   93    HA   ALA  13           HA       ALA  13  51.365   7.505   3.218
   94    HB1  ALA  13           HB1      ALA  13  52.651   9.702   2.971
   95    HB2  ALA  13           HB2      ALA  13  51.367   9.791   4.202
   96    HB3  ALA  13           HB3      ALA  13  51.110  10.507   2.592
   97    H    LYS  14           HN       LYS  14  49.903   8.065   0.442
   98    HA   LYS  14           HA       LYS  14  47.011   8.306   1.612
   99    HB2  LYS  14           HB2      LYS  14  48.074   9.962  -0.118
  100    HB3  LYS  14           HB1      LYS  14  48.042   8.550  -1.237
  101    HG2  LYS  14           HG2      LYS  14  45.743   8.725  -1.543
  102    HG3  LYS  14           HG1      LYS  14  45.424   9.169   0.149
  103    HD2  LYS  14           HD2      LYS  14  46.011  11.470  -0.255
  104    HD3  LYS  14           HD1      LYS  14  46.688  11.083  -1.855
  105    HE2  LYS  14           HE2      LYS  14  44.442  12.088  -2.086
  106    HE3  LYS  14           HE1      LYS  14  44.430  10.396  -2.637
  107    HZ1  LYS  14           HZ1      LYS  14  43.273  11.575  -0.201
  108    HZ2  LYS  14           HZ2      LYS  14  43.793   9.958  -0.161
  109    HZ3  LYS  14           HZ3      LYS  14  42.606  10.445  -1.276
  110    H    HIS  15           HN       HIS  15  45.607   7.433  -0.413
  111    HA   HIS  15           HA       HIS  15  44.621   5.398  -1.029
  112    HB2  HIS  15           HB2      HIS  15  45.964   6.261  -2.964
  113    HB3  HIS  15           HB1      HIS  15  47.295   5.191  -2.461
  114    HD1  HIS  15           HD1      HIS  15  47.296   2.966  -3.572
  115    HD2  HIS  15           HD2      HIS  15  43.437   4.625  -3.384
  116    HE1  HIS  15           HE1      HIS  15  45.703   1.322  -4.708
  117    H    ILE  16           HN       ILE  16  46.569   5.265   1.354
  118    HA   ILE  16           HA       ILE  16  46.223   2.688   2.023
  119    HB   ILE  16           HB       ILE  16  47.629   1.758   0.351
  120   HG12  ILE  16          HG12      ILE  16  49.495   2.068   2.739
  121   HG13  ILE  16          HG11      ILE  16  48.068   1.010   2.765
  122   HG21  ILE  16          HG21      ILE  16  49.549   4.012   1.075
  123   HG22  ILE  16          HG22      ILE  16  48.752   3.771  -0.491
  124   HG23  ILE  16          HG23      ILE  16  50.017   2.653   0.051
  125   HD11  ILE  16           HD1      ILE  16  49.734  -0.504   2.109
  126   HD12  ILE  16           HD2      ILE  16  50.637   0.716   1.187
  127   HD13  ILE  16           HD3      ILE  16  49.140   0.025   0.521
  128    H    GLY  17           HN       GLY  17  48.412   5.175   2.030
  129    HA2  GLY  17           HA1      GLY  17  49.041   4.856   4.885
  130    HA3  GLY  17           HA2      GLY  17  49.486   6.232   3.856
  131    H    HIS  18           HN       HIS  18  46.572   5.896   2.778
  132    HA   HIS  18           HA       HIS  18  45.370   7.781   4.789
  133    HB2  HIS  18           HB2      HIS  18  44.984   7.149   1.894
  134    HB3  HIS  18           HB1      HIS  18  43.468   7.425   2.772
  135    HD1  HIS  18           HD1      HIS  18  43.126   9.684   1.471
  136    HD2  HIS  18           HD2      HIS  18  46.613   9.552   3.819
  137    HE1  HIS  18           HE1      HIS  18  43.974  12.082   1.713
  138    H    ALA  19           HN       ALA  19  44.642   4.643   3.141
  139    HA   ALA  19           HA       ALA  19  43.690   3.286   5.404
  140    HB1  ALA  19           HB1      ALA  19  41.128   3.474   4.914
  141    HB2  ALA  19           HB2      ALA  19  41.548   5.009   4.121
  142    HB3  ALA  19           HB3      ALA  19  41.897   4.770   5.851
  143    H    ALA  20           HN       ALA  20  44.530   3.485   2.312
  144    HA   ALA  20           HA       ALA  20  44.447   2.013   0.517
  145    HB1  ALA  20           HB1      ALA  20  44.926   0.377   2.450
  146    HB2  ALA  20           HB2      ALA  20  44.228  -0.310   0.964
  147    HB3  ALA  20           HB3      ALA  20  43.195  -0.028   2.386
  148    H    VAL  21           HN       VAL  21  42.043   3.507   1.855
  149    HA   VAL  21           HA       VAL  21  40.037   2.637  -0.181
  150    HB   VAL  21           HB       VAL  21  39.451   3.021   2.794
  151   HG11  VAL  21          HG11      VAL  21  37.108   2.213   1.951
  152   HG12  VAL  21          HG12      VAL  21  37.679   2.707   0.341
  153   HG13  VAL  21          HG13      VAL  21  37.565   3.904   1.653
  154   HG21  VAL  21          HG21      VAL  21  39.287   0.576   0.971
  155   HG22  VAL  21          HG22      VAL  21  38.715   0.631   2.655
  156   HG23  VAL  21          HG23      VAL  21  40.445   0.824   2.299
  157    H    ASN  22           HN       ASN  22  41.844   4.893   1.500
  158    HA   ASN  22           HA       ASN  22  42.060   7.178   0.876
  159    HB2  ASN  22           HB2      ASN  22  39.080   7.315   0.318
  160    HB3  ASN  22           HB1      ASN  22  40.340   8.488  -0.118
  161   HD21  ASN  22          HD21      ASN  22  38.382   6.526  -1.714
  162   HD22  ASN  22          HD22      ASN  22  39.474   5.855  -2.930
  163    H    HIS  23           HN       HIS  23  39.319   5.899   2.667
  164    HA   HIS  23           HA       HIS  23  38.696   6.328   4.872
  165    HB2  HIS  23           HB2      HIS  23  41.225   7.112   5.112
  166    HB3  HIS  23           HB1      HIS  23  40.526   8.743   5.096
  167    HD1  HIS  23           HD1      HIS  23  40.112   9.595   7.387
  168    HD2  HIS  23           HD2      HIS  23  39.455   5.449   7.120
  169    HE1  HIS  23           HE1      HIS  23  39.412   8.783   9.708
  170    H    TYR  24           HN       TYR  24  38.200   7.975   2.189
  171    HA   TYR  24           HA       TYR  24  36.995  10.440   3.203
  172    HB2  TYR  24           HB2      TYR  24  37.933  10.214   0.907
  173    HB3  TYR  24           HB1      TYR  24  36.653   9.040   0.521
  174    HD1  TYR  24           HD1      TYR  24  34.604   9.837  -0.362
  175    HD2  TYR  24           HD2      TYR  24  37.121  12.520   1.898
  176    HE1  TYR  24           HE1      TYR  24  33.068  11.725  -0.891
  177    HE2  TYR  24           HE2      TYR  24  35.582  14.405   1.370
  178    HH   TYR  24           HH       TYR  24  34.078  14.908  -0.621
  179    H    LEU  25           HN       LEU  25  36.105   7.817   4.353
  180    HA   LEU  25           HA       LEU  25  33.467   7.245   3.345
  181    HB2  LEU  25           HB2      LEU  25  35.079   5.891   4.954
  182    HB3  LEU  25           HB1      LEU  25  34.251   6.792   6.241
  183    HG   LEU  25           HG       LEU  25  32.911   5.048   4.119
  184   HD11  LEU  25          HD11      LEU  25  34.129   3.767   5.848
  185   HD12  LEU  25          HD12      LEU  25  32.370   3.593   6.058
  186   HD13  LEU  25          HD13      LEU  25  33.292   4.680   7.125
  187   HD21  LEU  25          HD21      LEU  25  30.897   5.436   5.725
  188   HD22  LEU  25          HD22      LEU  25  31.346   6.768   4.638
  189   HD23  LEU  25          HD23      LEU  25  31.831   6.817   6.351
  Start of MODEL   88
    1    H1   GLY   1           HT1      GLY   1  65.816  10.460   1.654
    2    H2   GLY   1           HT2      GLY   1  66.066  11.443   3.018
    3    H3   GLY   1           HT3      GLY   1  65.746  12.148   1.505
    4    HA2  GLY   1           HA1      GLY   1  63.574  11.053   1.504
    5    HA3  GLY   1           HA2      GLY   1  63.922  10.543   3.167
    6    H    TRP   2           HN       TRP   2  64.714  13.616   1.526
    7    HA   TRP   2           HA       TRP   2  63.783  15.162   3.787
    8    HB2  TRP   2           HB2      TRP   2  64.269  16.122   0.943
    9    HB3  TRP   2           HB1      TRP   2  64.307  17.093   2.434
   10    HD1  TRP   2           HD1      TRP   2  66.309  16.530   4.189
   11    HE1  TRP   2           HE1      TRP   2  68.729  15.666   3.794
   12    HE3  TRP   2           HE3      TRP   2  65.738  14.664  -0.544
   13    HZ2  TRP   2           HZ2      TRP   2  70.189  14.346   1.693
   14    HZ3  TRP   2           HZ3      TRP   2  67.657  13.606  -1.725
   15    HH2  TRP   2           HH2      TRP   2  69.880  13.446  -0.612
   16    H    GLY   3           HN       GLY   3  62.360  17.256   2.872
   17    HA2  GLY   3           HA1      GLY   3  59.691  16.190   2.792
   18    HA3  GLY   3           HA2      GLY   3  60.152  17.891   2.581
   19    H    SER   4           HN       SER   4  62.009  16.973   0.327
   20    HA   SER   4           HA       SER   4  61.855  16.961  -1.987
   21    HB2  SER   4           HB2      SER   4  59.480  15.147  -1.402
   22    HB3  SER   4           HB1      SER   4  60.293  15.314  -2.974
   23    HG   SER   4           HG       SER   4  62.089  14.880  -1.004
   24    H    ILE   5           HN       ILE   5  59.851  16.925  -3.819
   25    HA   ILE   5           HA       ILE   5  58.738  19.617  -3.490
   26    HB   ILE   5           HB       ILE   5  57.708  19.115  -5.774
   27   HG12  ILE   5          HG12      ILE   5  59.438  16.605  -5.561
   28   HG13  ILE   5          HG11      ILE   5  57.672  16.600  -5.371
   29   HG21  ILE   5          HG21      ILE   5  60.709  18.602  -5.574
   30   HG22  ILE   5          HG22      ILE   5  59.966  20.209  -5.396
   31   HG23  ILE   5          HG23      ILE   5  59.830  19.334  -6.936
   32   HD11  ILE   5           HD1      ILE   5  57.997  16.048  -7.652
   33   HD12  ILE   5           HD2      ILE   5  59.309  17.231  -7.848
   34   HD13  ILE   5           HD3      ILE   5  57.624  17.786  -7.698
   35    H    PHE   6           HN       PHE   6  57.668  18.400  -1.425
   36    HA   PHE   6           HA       PHE   6  55.649  17.891  -0.412
   37    HB2  PHE   6           HB2      PHE   6  54.290  18.771  -2.982
   38    HB3  PHE   6           HB1      PHE   6  53.654  18.827  -1.322
   39    HD1  PHE   6           HD1      PHE   6  54.618  20.427   0.346
   40    HD2  PHE   6           HD2      PHE   6  55.767  20.499  -3.814
   41    HE1  PHE   6           HE1      PHE   6  55.570  22.711   0.648
   42    HE2  PHE   6           HE2      PHE   6  56.721  22.781  -3.512
   43    HZ   PHE   6           HZ       PHE   6  56.657  23.870  -1.271
   44    H    LYS   7           HN       LYS   7  57.039  16.040  -2.497
   45    HA   LYS   7           HA       LYS   7  54.909  14.396  -3.572
   46    HB2  LYS   7           HB2      LYS   7  57.235  14.442  -4.474
   47    HB3  LYS   7           HB1      LYS   7  57.801  13.653  -2.983
   48    HG2  LYS   7           HG2      LYS   7  56.447  11.690  -3.424
   49    HG3  LYS   7           HG1      LYS   7  55.650  12.491  -4.801
   50    HD2  LYS   7           HD2      LYS   7  57.734  12.557  -6.050
   51    HD3  LYS   7           HD1      LYS   7  58.646  11.955  -4.646
   52    HE2  LYS   7           HE2      LYS   7  58.042  10.215  -6.443
   53    HE3  LYS   7           HE1      LYS   7  57.609   9.802  -4.767
   54    HZ1  LYS   7           HZ1      LYS   7  55.751  11.070  -6.715
   55    HZ2  LYS   7           HZ2      LYS   7  55.368  10.493  -5.165
   56    HZ3  LYS   7           HZ3      LYS   7  55.806   9.405  -6.394
   57    H    HIS   8           HN       HIS   8  57.308  13.695  -0.985
   58    HA   HIS   8           HA       HIS   8  55.620  11.536   0.064
   59    HB2  HIS   8           HB2      HIS   8  58.151  12.834   1.154
   60    HB3  HIS   8           HB1      HIS   8  57.393  11.353   1.787
   61    HD1  HIS   8           HD1      HIS   8  57.126   9.327  -0.041
   62    HD2  HIS   8           HD2      HIS   8  59.855  12.383  -0.993
   63    HE1  HIS   8           HE1      HIS   8  58.677   8.424  -1.859
   64    H    GLY   9           HN       GLY   9  53.977  13.646   0.086
   65    HA2  GLY   9           HA1      GLY   9  53.441  13.971   2.936
   66    HA3  GLY   9           HA2      GLY   9  53.958  15.479   2.156
   67    H    ARG  10           HN       ARG  10  52.678  14.270  -0.410
   68    HA   ARG  10           HA       ARG  10  49.815  14.920   0.304
   69    HB2  ARG  10           HB2      ARG  10  51.440  15.763  -2.129
   70    HB3  ARG  10           HB1      ARG  10  49.674  15.941  -1.989
   71    HG2  ARG  10           HG2      ARG  10  50.025  17.285   0.106
   72    HG3  ARG  10           HG1      ARG  10  51.780  17.199  -0.178
   73    HD2  ARG  10           HD2      ARG  10  50.882  19.313  -1.069
   74    HD3  ARG  10           HD1      ARG  10  51.460  18.279  -2.399
   75    HE   ARG  10           HE       ARG  10  48.619  17.903  -1.830
   76   HH11  ARG  10          HH11      ARG  10  50.779  18.497  -4.245
   77   HH12  ARG  10          HH12      ARG  10  49.805  19.630  -5.121
   78   HH21  ARG  10          HH21      ARG  10  47.436  19.938  -2.608
   79   HH22  ARG  10          HH22      ARG  10  47.913  20.447  -4.193
   80    H    HIS  11           HN       HIS  11  51.887  12.550  -0.590
   81    HA   HIS  11           HA       HIS  11  49.694  10.955  -1.736
   82    HB2  HIS  11           HB2      HIS  11  52.277  11.294  -3.309
   83    HB3  HIS  11           HB1      HIS  11  50.873  10.297  -3.756
   84    HD1  HIS  11           HD1      HIS  11  51.844  13.961  -3.188
   85    HD2  HIS  11           HD2      HIS  11  48.945  11.675  -5.201
   86    HE1  HIS  11           HE1      HIS  11  50.413  15.576  -4.555
   87    H    ALA  12           HN       ALA  12  49.850   8.917  -1.544
   88    HA   ALA  12           HA       ALA  12  50.486   6.874  -0.737
   89    HB1  ALA  12           HB1      ALA  12  52.751   6.435  -0.336
   90    HB2  ALA  12           HB2      ALA  12  53.000   8.153  -0.025
   91    HB3  ALA  12           HB3      ALA  12  52.722   7.601  -1.679
   92    H    ALA  13           HN       ALA  13  51.471   9.857   0.862
   93    HA   ALA  13           HA       ALA  13  51.269   8.722   3.555
   94    HB1  ALA  13           HB1      ALA  13  52.151  10.973   3.551
   95    HB2  ALA  13           HB2      ALA  13  50.435  11.198   3.969
   96    HB3  ALA  13           HB3      ALA  13  50.994  11.503   2.307
   97    H    LYS  14           HN       LYS  14  50.093   8.646   0.603
   98    HA   LYS  14           HA       LYS  14  47.079   8.502   1.434
   99    HB2  LYS  14           HB2      LYS  14  48.054  10.113  -0.394
  100    HB3  LYS  14           HB1      LYS  14  48.397   8.597  -1.305
  101    HG2  LYS  14           HG2      LYS  14  46.162   8.333  -1.889
  102    HG3  LYS  14           HG1      LYS  14  45.563   8.828  -0.293
  103    HD2  LYS  14           HD2      LYS  14  44.794  10.461  -1.888
  104    HD3  LYS  14           HD1      LYS  14  46.091  11.236  -0.953
  105    HE2  LYS  14           HE2      LYS  14  47.679  10.419  -2.847
  106    HE3  LYS  14           HE1      LYS  14  46.192  10.136  -3.784
  107    HZ1  LYS  14           HZ1      LYS  14  46.558  12.286  -4.338
  108    HZ2  LYS  14           HZ2      LYS  14  47.402  12.649  -2.909
  109    HZ3  LYS  14           HZ3      LYS  14  45.705  12.575  -2.900
  110    H    HIS  15           HN       HIS  15  46.116   7.130  -0.612
  111    HA   HIS  15           HA       HIS  15  45.597   4.876  -1.008
  112    HB2  HIS  15           HB2      HIS  15  47.028   5.769  -2.889
  113    HB3  HIS  15           HB1      HIS  15  48.424   4.984  -2.114
  114    HD1  HIS  15           HD1      HIS  15  44.993   4.138  -3.593
  115    HD2  HIS  15           HD2      HIS  15  48.670   2.290  -2.737
  116    HE1  HIS  15           HE1      HIS  15  44.877   1.752  -4.501
  117    H    ILE  16           HN       ILE  16  47.146   5.408   1.569
  118    HA   ILE  16           HA       ILE  16  47.219   2.928   2.561
  119    HB   ILE  16           HB       ILE  16  49.004   2.073   1.235
  120   HG12  ILE  16          HG12      ILE  16  50.638   3.046   3.605
  121   HG13  ILE  16          HG11      ILE  16  49.252   1.979   3.897
  122   HG21  ILE  16          HG21      ILE  16  49.832   4.141   0.198
  123   HG22  ILE  16          HG22      ILE  16  51.197   3.387   1.043
  124   HG23  ILE  16          HG23      ILE  16  50.354   4.750   1.780
  125   HD11  ILE  16           HD1      ILE  16  51.671   1.380   2.134
  126   HD12  ILE  16           HD2      ILE  16  50.229   0.343   2.237
  127   HD13  ILE  16           HD3      ILE  16  51.242   0.605   3.675
  128    H    GLY  17           HN       GLY  17  48.935   5.760   2.445
  129    HA2  GLY  17           HA1      GLY  17  49.197   5.937   5.366
  130    HA3  GLY  17           HA2      GLY  17  49.532   7.233   4.199
  131    H    HIS  18           HN       HIS  18  46.885   6.211   2.872
  132    HA   HIS  18           HA       HIS  18  45.125   8.075   4.440
  133    HB2  HIS  18           HB2      HIS  18  45.255   7.044   1.642
  134    HB3  HIS  18           HB1      HIS  18  43.606   7.140   2.289
  135    HD1  HIS  18           HD1      HIS  18  43.074   9.126   0.657
  136    HD2  HIS  18           HD2      HIS  18  46.186   9.914   3.371
  137    HE1  HIS  18           HE1      HIS  18  43.472  11.650   0.648
  138    H    ALA  19           HN       ALA  19  45.241   4.627   3.318
  139    HA   ALA  19           HA       ALA  19  43.777   3.799   5.701
  140    HB1  ALA  19           HB1      ALA  19  42.205   3.526   3.130
  141    HB2  ALA  19           HB2      ALA  19  41.984   4.911   4.229
  142    HB3  ALA  19           HB3      ALA  19  41.654   3.259   4.802
  143    H    ALA  20           HN       ALA  20  46.180   2.923   4.459
  144    HA   ALA  20           HA       ALA  20  47.178   0.887   3.977
  145    HB1  ALA  20           HB1      ALA  20  44.538  -0.574   4.072
  146    HB2  ALA  20           HB2      ALA  20  45.235   0.090   5.567
  147    HB3  ALA  20           HB3      ALA  20  46.146  -1.104   4.615
  148    H    VAL  21           HN       VAL  21  44.370   2.025   2.215
  149    HA   VAL  21           HA       VAL  21  45.606   0.973  -0.288
  150    HB   VAL  21           HB       VAL  21  42.653   0.503   0.313
  151   HG11  VAL  21          HG11      VAL  21  43.193   0.804  -2.062
  152   HG12  VAL  21          HG12      VAL  21  42.843  -0.912  -1.746
  153   HG13  VAL  21          HG13      VAL  21  44.526  -0.368  -1.933
  154   HG21  VAL  21          HG21      VAL  21  45.043  -1.391   0.413
  155   HG22  VAL  21          HG22      VAL  21  43.350  -1.936   0.350
  156   HG23  VAL  21          HG23      VAL  21  43.928  -0.991   1.744
  157    H    ASN  22           HN       ASN  22  43.320   3.011   1.434
  158    HA   ASN  22           HA       ASN  22  43.651   5.418   0.281
  159    HB2  ASN  22           HB2      ASN  22  43.405   4.867  -2.009
  160    HB3  ASN  22           HB1      ASN  22  42.090   3.710  -1.690
  161   HD21  ASN  22          HD21      ASN  22  42.884   7.244  -1.657
  162   HD22  ASN  22          HD22      ASN  22  41.225   7.765  -1.966
  163    H    HIS  23           HN       HIS  23  41.060   3.005   0.704
  164    HA   HIS  23           HA       HIS  23  39.909   4.492   2.907
  165    HB2  HIS  23           HB2      HIS  23  39.096   5.862   0.961
  166    HB3  HIS  23           HB1      HIS  23  38.262   4.413   0.349
  167    HD1  HIS  23           HD1      HIS  23  38.547   5.774   3.936
  168    HD2  HIS  23           HD2      HIS  23  35.622   4.904   1.044
  169    HE1  HIS  23           HE1      HIS  23  36.266   6.090   5.043
  170    H    TYR  24           HN       TYR  24  37.643   3.497   3.447
  171    HA   TYR  24           HA       TYR  24  36.541   1.563   4.100
  172    HB2  TYR  24           HB2      TYR  24  36.053   1.545   1.630
  173    HB3  TYR  24           HB1      TYR  24  37.452   0.467   1.410
  174    HD1  TYR  24           HD1      TYR  24  37.269  -1.878   1.855
  175    HD2  TYR  24           HD2      TYR  24  34.169   0.811   3.194
  176    HE1  TYR  24           HE1      TYR  24  35.847  -3.827   2.480
  177    HE2  TYR  24           HE2      TYR  24  32.747  -1.138   3.817
  178    HH   TYR  24           HH       TYR  24  32.578  -3.355   3.863
  179    H    LEU  25           HN       LEU  25  39.717   1.832   4.108
  180    HA   LEU  25           HA       LEU  25  41.444   0.571   4.992
  181    HB2  LEU  25           HB2      LEU  25  39.439   0.147   6.670
  182    HB3  LEU  25           HB1      LEU  25  39.459  -1.494   5.994
  183    HG   LEU  25           HG       LEU  25  41.843  -0.055   7.252
  184   HD11  LEU  25          HD11      LEU  25  40.108  -0.716   8.890
  185   HD12  LEU  25          HD12      LEU  25  41.563  -1.727   9.061
  186   HD13  LEU  25          HD13      LEU  25  40.121  -2.373   8.241
  187   HD21  LEU  25          HD21      LEU  25  42.766  -2.493   7.149
  188   HD22  LEU  25          HD22      LEU  25  42.744  -1.557   5.639
  189   HD23  LEU  25          HD23      LEU  25  41.488  -2.783   5.944
  Start of MODEL   89
    1    H1   GLY   1           HT1      GLY   1  65.168  12.401  -2.000
    2    H2   GLY   1           HT2      GLY   1  65.106  12.428  -0.301
    3    H3   GLY   1           HT3      GLY   1  65.959  11.198  -1.106
    4    HA2  GLY   1           HA1      GLY   1  67.044  13.394  -0.084
    5    HA3  GLY   1           HA2      GLY   1  67.754  12.400  -1.370
    6    H    TRP   2           HN       TRP   2  65.429  13.201  -3.164
    7    HA   TRP   2           HA       TRP   2  66.783  15.435  -4.409
    8    HB2  TRP   2           HB2      TRP   2  65.478  13.741  -5.672
    9    HB3  TRP   2           HB1      TRP   2  63.986  14.337  -4.904
   10    HD1  TRP   2           HD1      TRP   2  62.863  16.398  -5.940
   11    HE1  TRP   2           HE1      TRP   2  63.407  18.039  -7.882
   12    HE3  TRP   2           HE3      TRP   2  67.659  14.910  -6.935
   13    HZ2  TRP   2           HZ2      TRP   2  65.636  18.604  -9.615
   14    HZ3  TRP   2           HZ3      TRP   2  68.976  16.014  -8.737
   15    HH2  TRP   2           HH2      TRP   2  67.969  17.857 -10.076
   16    H    GLY   3           HN       GLY   3  63.340  15.303  -3.418
   17    HA2  GLY   3           HA1      GLY   3  63.326  17.381  -1.553
   18    HA3  GLY   3           HA2      GLY   3  63.230  18.182  -3.134
   19    H    SER   4           HN       SER   4  61.897  15.205  -3.581
   20    HA   SER   4           HA       SER   4  59.704  14.529  -3.913
   21    HB2  SER   4           HB2      SER   4  59.344  16.049  -1.303
   22    HB3  SER   4           HB1      SER   4  58.120  14.982  -2.025
   23    HG   SER   4           HG       SER   4  59.964  13.398  -2.045
   24    H    ILE   5           HN       ILE   5  58.853  15.402  -5.701
   25    HA   ILE   5           HA       ILE   5  58.287  18.239  -5.933
   26    HB   ILE   5           HB       ILE   5  57.121  16.019  -7.663
   27   HG12  ILE   5          HG12      ILE   5  59.865  17.351  -7.805
   28   HG13  ILE   5          HG11      ILE   5  59.545  15.643  -7.428
   29   HG21  ILE   5          HG21      ILE   5  56.994  17.714  -9.354
   30   HG22  ILE   5          HG22      ILE   5  58.028  18.826  -8.425
   31   HG23  ILE   5          HG23      ILE   5  56.373  18.478  -7.874
   32   HD11  ILE   5           HD1      ILE   5  59.163  17.103 -10.063
   33   HD12  ILE   5           HD2      ILE   5  58.321  15.570  -9.729
   34   HD13  ILE   5           HD3      ILE   5  60.100  15.628  -9.737
   35    H    PHE   6           HN       PHE   6  56.406  15.341  -5.116
   36    HA   PHE   6           HA       PHE   6  54.359  16.987  -3.854
   37    HB2  PHE   6           HB2      PHE   6  52.472  16.323  -5.254
   38    HB3  PHE   6           HB1      PHE   6  53.675  17.183  -6.244
   39    HD1  PHE   6           HD1      PHE   6  54.788  16.086  -8.072
   40    HD2  PHE   6           HD2      PHE   6  52.394  13.792  -5.308
   41    HE1  PHE   6           HE1      PHE   6  54.954  14.104  -9.574
   42    HE2  PHE   6           HE2      PHE   6  52.561  11.811  -6.809
   43    HZ   PHE   6           HZ       PHE   6  53.774  11.992  -8.978
   44    H    LYS   7           HN       LYS   7  56.117  14.195  -4.309
   45    HA   LYS   7           HA       LYS   7  54.336  12.122  -3.540
   46    HB2  LYS   7           HB2      LYS   7  57.293  12.494  -2.920
   47    HB3  LYS   7           HB1      LYS   7  56.391  10.976  -2.692
   48    HG2  LYS   7           HG2      LYS   7  55.800  10.974  -5.107
   49    HG3  LYS   7           HG1      LYS   7  56.736  12.473  -5.328
   50    HD2  LYS   7           HD2      LYS   7  58.753  11.233  -4.399
   51    HD3  LYS   7           HD1      LYS   7  57.786   9.741  -4.487
   52    HE2  LYS   7           HE2      LYS   7  57.466  10.061  -6.907
   53    HE3  LYS   7           HE1      LYS   7  58.368  11.593  -6.840
   54    HZ1  LYS   7           HZ1      LYS   7  60.192  10.105  -5.785
   55    HZ2  LYS   7           HZ2      LYS   7  59.981  10.099  -7.471
   56    HZ3  LYS   7           HZ3      LYS   7  59.357   8.831  -6.530
   57    H    HIS   8           HN       HIS   8  56.863  13.154  -1.265
   58    HA   HIS   8           HA       HIS   8  55.098  12.622   0.994
   59    HB2  HIS   8           HB2      HIS   8  57.806  14.010   0.965
   60    HB3  HIS   8           HB1      HIS   8  57.003  13.251   2.360
   61    HD1  HIS   8           HD1      HIS   8  59.659  12.546   0.180
   62    HD2  HIS   8           HD2      HIS   8  56.271  10.325   1.309
   63    HE1  HIS   8           HE1      HIS   8  60.181  10.084  -0.261
   64    H    GLY   9           HN       GLY   9  53.334  14.060   0.641
   65    HA2  GLY   9           HA1      GLY   9  53.528  16.496   2.082
   66    HA3  GLY   9           HA2      GLY   9  53.652  16.885   0.354
   67    H    ARG  10           HN       ARG  10  51.953  15.007  -0.772
   68    HA   ARG  10           HA       ARG  10  49.341  15.218   0.617
   69    HB2  ARG  10           HB2      ARG  10  48.271  16.291  -1.383
   70    HB3  ARG  10           HB1      ARG  10  49.361  17.372  -0.486
   71    HG2  ARG  10           HG2      ARG  10  50.584  15.789  -2.758
   72    HG3  ARG  10           HG1      ARG  10  49.472  17.099  -3.202
   73    HD2  ARG  10           HD2      ARG  10  51.738  17.546  -1.229
   74    HD3  ARG  10           HD1      ARG  10  51.975  17.702  -2.985
   75    HE   ARG  10           HE       ARG  10  49.701  19.248  -2.352
   76   HH11  ARG  10          HH11      ARG  10  49.893  21.135  -0.921
   77   HH12  ARG  10          HH12      ARG  10  51.426  21.940  -0.921
   78   HH21  ARG  10          HH21      ARG  10  53.054  19.402  -2.637
   79   HH22  ARG  10          HH22      ARG  10  53.217  20.958  -1.894
   80    H    HIS  11           HN       HIS  11  51.271  13.147  -0.401
   81    HA   HIS  11           HA       HIS  11  49.232  11.435  -1.591
   82    HB2  HIS  11           HB2      HIS  11  50.100  12.761  -3.587
   83    HB3  HIS  11           HB1      HIS  11  51.687  12.011  -3.291
   84    HD1  HIS  11           HD1      HIS  11  48.126  10.538  -3.243
   85    HD2  HIS  11           HD2      HIS  11  51.874   9.883  -5.036
   86    HE1  HIS  11           HE1      HIS  11  47.917   8.456  -4.708
   87    H    ALA  12           HN       ALA  12  49.614   9.403  -1.595
   88    HA   ALA  12           HA       ALA  12  50.467   7.389  -0.946
   89    HB1  ALA  12           HB1      ALA  12  52.578   8.397  -1.921
   90    HB2  ALA  12           HB2      ALA  12  52.781   7.149  -0.666
   91    HB3  ALA  12           HB3      ALA  12  52.880   8.864  -0.256
   92    H    ALA  13           HN       ALA  13  51.258  10.327   0.847
   93    HA   ALA  13           HA       ALA  13  51.299   8.971   3.443
   94    HB1  ALA  13           HB1      ALA  13  50.719  11.189   4.330
   95    HB2  ALA  13           HB2      ALA  13  50.257  11.768   2.710
   96    HB3  ALA  13           HB3      ALA  13  51.967  11.451   3.088
   97    H    LYS  14           HN       LYS  14  49.980   9.022   0.550
   98    HA   LYS  14           HA       LYS  14  47.038   8.527   1.499
   99    HB2  LYS  14           HB2      LYS  14  47.784  10.358  -0.223
  100    HB3  LYS  14           HB1      LYS  14  48.210   8.956  -1.273
  101    HG2  LYS  14           HG2      LYS  14  45.972   8.542  -1.770
  102    HG3  LYS  14           HG1      LYS  14  45.414   8.891  -0.119
  103    HD2  LYS  14           HD2      LYS  14  45.460  11.278  -0.536
  104    HD3  LYS  14           HD1      LYS  14  46.267  11.041  -2.105
  105    HE2  LYS  14           HE2      LYS  14  44.310   9.931  -3.017
  106    HE3  LYS  14           HE1      LYS  14  43.514   9.924  -1.425
  107    HZ1  LYS  14           HZ1      LYS  14  43.577  11.978  -3.381
  108    HZ2  LYS  14           HZ2      LYS  14  44.241  12.548  -1.924
  109    HZ3  LYS  14           HZ3      LYS  14  42.673  11.893  -1.949
  110    H    HIS  15           HN       HIS  15  46.089   7.257  -0.593
  111    HA   HIS  15           HA       HIS  15  45.735   5.015  -1.175
  112    HB2  HIS  15           HB2      HIS  15  46.994   6.166  -3.034
  113    HB3  HIS  15           HB1      HIS  15  48.489   5.450  -2.385
  114    HD1  HIS  15           HD1      HIS  15  45.102   3.696  -2.504
  115    HD2  HIS  15           HD2      HIS  15  48.824   3.557  -4.455
  116    HE1  HIS  15           HE1      HIS  15  45.131   1.583  -3.941
  117    H    ILE  16           HN       ILE  16  47.410   5.474   1.359
  118    HA   ILE  16           HA       ILE  16  47.696   2.924   2.144
  119    HB   ILE  16           HB       ILE  16  49.442   2.350   0.633
  120   HG12  ILE  16          HG12      ILE  16  51.154   3.146   3.006
  121   HG13  ILE  16          HG11      ILE  16  49.825   1.996   3.263
  122   HG21  ILE  16          HG21      ILE  16  51.546   3.844   0.522
  123   HG22  ILE  16          HG22      ILE  16  50.612   5.057   1.398
  124   HG23  ILE  16          HG23      ILE  16  50.092   4.548  -0.220
  125   HD11  ILE  16           HD1      ILE  16  52.154   1.017   2.679
  126   HD12  ILE  16           HD2      ILE  16  51.839   1.586   1.024
  127   HD13  ILE  16           HD3      ILE  16  50.753   0.396   1.776
  128    H    GLY  17           HN       GLY  17  49.084   5.931   2.180
  129    HA2  GLY  17           HA1      GLY  17  49.536   5.867   5.093
  130    HA3  GLY  17           HA2      GLY  17  49.715   7.275   4.027
  131    H    HIS  18           HN       HIS  18  47.068   6.122   2.752
  132    HA   HIS  18           HA       HIS  18  45.263   7.704   4.575
  133    HB2  HIS  18           HB2      HIS  18  45.298   6.943   1.679
  134    HB3  HIS  18           HB1      HIS  18  43.692   6.906   2.434
  135    HD1  HIS  18           HD1      HIS  18  43.020   8.993   0.960
  136    HD2  HIS  18           HD2      HIS  18  46.155   9.700   3.673
  137    HE1  HIS  18           HE1      HIS  18  43.294  11.524   1.167
  138    H    ALA  19           HN       ALA  19  45.599   4.441   3.060
  139    HA   ALA  19           HA       ALA  19  44.757   2.939   5.246
  140    HB1  ALA  19           HB1      ALA  19  42.253   2.501   4.405
  141    HB2  ALA  19           HB2      ALA  19  42.408   4.166   3.798
  142    HB3  ALA  19           HB3      ALA  19  42.612   3.826   5.534
  143    H    ALA  20           HN       ALA  20  45.874   3.254   2.283
  144    HA   ALA  20           HA       ALA  20  46.359   1.774   0.559
  145    HB1  ALA  20           HB1      ALA  20  47.028   0.376   2.594
  146    HB2  ALA  20           HB2      ALA  20  46.652  -0.527   1.107
  147    HB3  ALA  20           HB3      ALA  20  45.459  -0.445   2.424
  148    H    VAL  21           HN       VAL  21  43.482   2.600   1.530
  149    HA   VAL  21           HA       VAL  21  42.088   1.231  -0.715
  150    HB   VAL  21           HB       VAL  21  40.995   1.297   2.138
  151   HG11  VAL  21          HG11      VAL  21  39.840   0.459  -0.550
  152   HG12  VAL  21          HG12      VAL  21  39.131   1.530   0.683
  153   HG13  VAL  21          HG13      VAL  21  39.211  -0.219   0.971
  154   HG21  VAL  21          HG21      VAL  21  42.023  -0.987   0.391
  155   HG22  VAL  21          HG22      VAL  21  41.101  -1.229   1.894
  156   HG23  VAL  21          HG23      VAL  21  42.690  -0.440   1.946
  157    H    ASN  22           HN       ASN  22  42.878   3.853   1.232
  158    HA   ASN  22           HA       ASN  22  42.419   6.117   0.622
  159    HB2  ASN  22           HB2      ASN  22  40.941   5.294  -1.342
  160    HB3  ASN  22           HB1      ASN  22  39.585   5.372  -0.185
  161   HD21  ASN  22          HD21      ASN  22  41.605   7.238  -2.319
  162   HD22  ASN  22          HD22      ASN  22  41.007   8.827  -1.830
  163    H    HIS  23           HN       HIS  23  40.108   3.918   2.108
  164    HA   HIS  23           HA       HIS  23  39.910   5.756   4.455
  165    HB2  HIS  23           HB2      HIS  23  37.536   4.687   2.879
  166    HB3  HIS  23           HB1      HIS  23  37.419   5.374   4.516
  167    HD1  HIS  23           HD1      HIS  23  39.051   7.832   4.516
  168    HD2  HIS  23           HD2      HIS  23  36.755   6.712   1.179
  169    HE1  HIS  23           HE1      HIS  23  38.688   9.929   3.102
  170    H    TYR  24           HN       TYR  24  40.426   4.599   6.176
  171    HA   TYR  24           HA       TYR  24  40.585   1.738   6.156
  172    HB2  TYR  24           HB2      TYR  24  40.883   1.970   8.613
  173    HB3  TYR  24           HB1      TYR  24  41.893   3.123   7.707
  174    HD1  TYR  24           HD1      TYR  24  41.292   5.524   7.599
  175    HD2  TYR  24           HD2      TYR  24  38.998   2.730   9.957
  176    HE1  TYR  24           HE1      TYR  24  40.212   7.422   8.797
  177    HE2  TYR  24           HE2      TYR  24  37.918   4.629  11.156
  178    HH   TYR  24           HH       TYR  24  38.281   7.924  10.008
  179    H    LEU  25           HN       LEU  25  37.908   3.714   6.103
  180    HA   LEU  25           HA       LEU  25  35.672   3.387   6.600
  181    HB2  LEU  25           HB2      LEU  25  35.872   1.522   5.076
  182    HB3  LEU  25           HB1      LEU  25  36.607   0.503   6.331
  183    HG   LEU  25           HG       LEU  25  34.528   0.411   7.580
  184   HD11  LEU  25          HD11      LEU  25  33.633   2.550   5.609
  185   HD12  LEU  25          HD12      LEU  25  33.603   2.599   7.388
  186   HD13  LEU  25          HD13      LEU  25  32.456   1.564   6.510
  187   HD21  LEU  25          HD21      LEU  25  33.903   0.103   4.611
  188   HD22  LEU  25          HD22      LEU  25  33.093  -0.729   5.962
  189   HD23  LEU  25          HD23      LEU  25  34.796  -1.090   5.585
  Start of MODEL   90
    1    H1   GLY   1           HT1      GLY   1  68.974  19.033  -6.183
    2    H2   GLY   1           HT2      GLY   1  70.256  18.988  -5.070
    3    H3   GLY   1           HT3      GLY   1  69.063  20.191  -4.950
    4    HA2  GLY   1           HA1      GLY   1  68.898  17.334  -4.339
    5    HA3  GLY   1           HA2      GLY   1  68.500  18.725  -3.311
    6    H    TRP   2           HN       TRP   2  67.402  19.498  -6.326
    7    HA   TRP   2           HA       TRP   2  65.241  19.692  -7.153
    8    HB2  TRP   2           HB2      TRP   2  64.945  16.828  -6.166
    9    HB3  TRP   2           HB1      TRP   2  64.041  17.614  -7.482
   10    HD1  TRP   2           HD1      TRP   2  67.086  15.616  -6.828
   11    HE1  TRP   2           HE1      TRP   2  68.603  15.486  -8.936
   12    HE3  TRP   2           HE3      TRP   2  64.860  19.263  -9.650
   13    HZ2  TRP   2           HZ2      TRP   2  68.795  16.803 -11.489
   14    HZ3  TRP   2           HZ3      TRP   2  65.728  19.808 -11.919
   15    HH2  TRP   2           HH2      TRP   2  67.691  18.583 -12.841
   16    H    GLY   3           HN       GLY   3  62.876  18.242  -6.244
   17    HA2  GLY   3           HA1      GLY   3  62.407  18.665  -3.460
   18    HA3  GLY   3           HA2      GLY   3  61.894  20.110  -4.354
   19    H    SER   4           HN       SER   4  61.617  17.623  -6.488
   20    HA   SER   4           HA       SER   4  59.771  16.528  -7.365
   21    HB2  SER   4           HB2      SER   4  60.129  15.240  -5.203
   22    HB3  SER   4           HB1      SER   4  58.850  16.243  -4.484
   23    HG   SER   4           HG       SER   4  58.661  14.538  -6.760
   24    H    ILE   5           HN       ILE   5  57.367  16.545  -7.589
   25    HA   ILE   5           HA       ILE   5  56.456  19.322  -7.574
   26    HB   ILE   5           HB       ILE   5  54.743  16.872  -8.163
   27   HG12  ILE   5          HG12      ILE   5  56.724  18.310  -9.991
   28   HG13  ILE   5          HG11      ILE   5  56.858  16.635  -9.410
   29   HG21  ILE   5          HG21      ILE   5  54.736  19.617  -9.484
   30   HG22  ILE   5          HG22      ILE   5  53.802  19.281  -8.007
   31   HG23  ILE   5          HG23      ILE   5  53.459  18.377  -9.501
   32   HD11  ILE   5           HD1      ILE   5  54.536  16.260 -10.506
   33   HD12  ILE   5           HD2      ILE   5  55.935  16.434 -11.591
   34   HD13  ILE   5           HD3      ILE   5  54.827  17.803 -11.344
   35    H    PHE   6           HN       PHE   6  55.638  16.319  -5.821
   36    HA   PHE   6           HA       PHE   6  54.724  17.845  -3.518
   37    HB2  PHE   6           HB2      PHE   6  52.379  17.005  -3.553
   38    HB3  PHE   6           HB1      PHE   6  52.719  18.138  -4.882
   39    HD1  PHE   6           HD1      PHE   6  52.577  17.432  -7.177
   40    HD2  PHE   6           HD2      PHE   6  52.402  14.513  -4.004
   41    HE1  PHE   6           HE1      PHE   6  51.914  15.684  -8.823
   42    HE2  PHE   6           HE2      PHE   6  51.740  12.765  -5.649
   43    HZ   PHE   6           HZ       PHE   6  51.466  13.356  -8.055
   44    H    LYS   7           HN       LYS   7  55.679  15.045  -5.173
   45    HA   LYS   7           HA       LYS   7  54.805  12.999  -3.377
   46    HB2  LYS   7           HB2      LYS   7  55.868  12.738  -5.693
   47    HB3  LYS   7           HB1      LYS   7  57.436  13.020  -4.901
   48    HG2  LYS   7           HG2      LYS   7  57.156  11.069  -3.487
   49    HG3  LYS   7           HG1      LYS   7  55.475  10.849  -4.032
   50    HD2  LYS   7           HD2      LYS   7  56.294  10.464  -6.351
   51    HD3  LYS   7           HD1      LYS   7  57.970  10.633  -5.774
   52    HE2  LYS   7           HE2      LYS   7  57.708   8.702  -4.299
   53    HE3  LYS   7           HE1      LYS   7  55.984   8.572  -4.723
   54    HZ1  LYS   7           HZ1      LYS   7  57.487   8.623  -7.093
   55    HZ2  LYS   7           HZ2      LYS   7  56.544   7.355  -6.469
   56    HZ3  LYS   7           HZ3      LYS   7  58.190   7.474  -6.061
   57    H    HIS   8           HN       HIS   8  56.838  15.632  -2.836
   58    HA   HIS   8           HA       HIS   8  58.856  14.487  -1.171
   59    HB2  HIS   8           HB2      HIS   8  58.938  16.806  -2.025
   60    HB3  HIS   8           HB1      HIS   8  57.555  17.232  -0.989
   61    HD1  HIS   8           HD1      HIS   8  61.220  16.223  -0.846
   62    HD2  HIS   8           HD2      HIS   8  58.183  17.502   1.767
   63    HE1  HIS   8           HE1      HIS   8  62.326  16.802   1.384
   64    H    GLY   9           HN       GLY   9  55.580  14.346  -0.788
   65    HA2  GLY   9           HA1      GLY   9  55.274  13.000   1.477
   66    HA3  GLY   9           HA2      GLY   9  55.626  14.589   2.188
   67    H    ARG  10           HN       ARG  10  53.584  13.259  -0.466
   68    HA   ARG  10           HA       ARG  10  51.164  14.221   0.864
   69    HB2  ARG  10           HB2      ARG  10  52.298  16.274  -0.312
   70    HB3  ARG  10           HB1      ARG  10  51.745  15.514  -1.822
   71    HG2  ARG  10           HG2      ARG  10  49.409  15.403  -0.725
   72    HG3  ARG  10           HG1      ARG  10  50.061  16.493   0.521
   73    HD2  ARG  10           HD2      ARG  10  50.729  18.093  -1.307
   74    HD3  ARG  10           HD1      ARG  10  49.908  17.031  -2.477
   75    HE   ARG  10           HE       ARG  10  47.842  17.872  -1.690
   76   HH11  ARG  10          HH11      ARG  10  46.734  17.995   0.493
   77   HH12  ARG  10          HH12      ARG  10  47.372  19.217   1.541
   78   HH21  ARG  10          HH21      ARG  10  50.256  19.687  -0.327
   79   HH22  ARG  10          HH22      ARG  10  49.366  20.176   1.078
   80    H    HIS  11           HN       HIS  11  52.269  11.733  -0.149
   81    HA   HIS  11           HA       HIS  11  49.925  10.783  -1.514
   82    HB2  HIS  11           HB2      HIS  11  51.093  11.968  -3.430
   83    HB3  HIS  11           HB1      HIS  11  52.439  10.822  -3.225
   84    HD1  HIS  11           HD1      HIS  11  51.957   8.271  -3.704
   85    HD2  HIS  11           HD2      HIS  11  48.858  10.909  -4.757
   86    HE1  HIS  11           HE1      HIS  11  50.316   6.972  -5.171
   87    H    ALA  12           HN       ALA  12  49.714   8.733  -1.624
   88    HA   ALA  12           HA       ALA  12  49.988   6.517  -1.134
   89    HB1  ALA  12           HB1      ALA  12  52.736   7.212  -0.469
   90    HB2  ALA  12           HB2      ALA  12  52.260   6.966  -2.153
   91    HB3  ALA  12           HB3      ALA  12  52.159   5.634  -0.973
   92    H    ALA  13           HN       ALA  13  51.617   8.995   0.777
   93    HA   ALA  13           HA       ALA  13  51.349   7.528   3.295
   94    HB1  ALA  13           HB1      ALA  13  51.328   9.824   4.286
   95    HB2  ALA  13           HB2      ALA  13  51.205  10.536   2.660
   96    HB3  ALA  13           HB3      ALA  13  52.690   9.687   3.151
   97    H    LYS  14           HN       LYS  14  50.021   8.128   0.463
   98    HA   LYS  14           HA       LYS  14  47.087   8.413   1.510
   99    HB2  LYS  14           HB2      LYS  14  48.257  10.066  -0.151
  100    HB3  LYS  14           HB1      LYS  14  48.251   8.665  -1.285
  101    HG2  LYS  14           HG2      LYS  14  45.974   8.901  -1.707
  102    HG3  LYS  14           HG1      LYS  14  45.579   9.297  -0.019
  103    HD2  LYS  14           HD2      LYS  14  46.240  11.602  -0.326
  104    HD3  LYS  14           HD1      LYS  14  46.944  11.248  -1.922
  105    HE2  LYS  14           HE2      LYS  14  44.724  12.296  -2.178
  106    HE3  LYS  14           HE1      LYS  14  44.686  10.616  -2.762
  107    HZ1  LYS  14           HZ1      LYS  14  42.828  10.714  -1.433
  108    HZ2  LYS  14           HZ2      LYS  14  43.536  11.763  -0.300
  109    HZ3  LYS  14           HZ3      LYS  14  43.974  10.122  -0.332
  110    H    HIS  15           HN       HIS  15  45.762   7.578  -0.602
  111    HA   HIS  15           HA       HIS  15  44.780   5.563  -1.284
  112    HB2  HIS  15           HB2      HIS  15  46.213   6.402  -3.147
  113    HB3  HIS  15           HB1      HIS  15  47.526   5.350  -2.570
  114    HD1  HIS  15           HD1      HIS  15  47.642   3.389  -4.110
  115    HD2  HIS  15           HD2      HIS  15  43.681   4.386  -3.109
  116    HE1  HIS  15           HE1      HIS  15  46.120   1.648  -5.197
  117    H    ILE  16           HN       ILE  16  46.593   5.389   1.201
  118    HA   ILE  16           HA       ILE  16  46.168   2.817   1.843
  119    HB   ILE  16           HB       ILE  16  47.637   1.866   0.238
  120   HG12  ILE  16          HG12      ILE  16  49.421   2.120   2.690
  121   HG13  ILE  16          HG11      ILE  16  47.944   1.132   2.698
  122   HG21  ILE  16          HG21      ILE  16  50.058   2.716   0.068
  123   HG22  ILE  16          HG22      ILE  16  49.560   4.082   1.068
  124   HG23  ILE  16          HG23      ILE  16  48.844   3.859  -0.538
  125   HD11  ILE  16           HD1      ILE  16  50.515   0.707   1.144
  126   HD12  ILE  16           HD2      ILE  16  48.990   0.032   0.523
  127   HD13  ILE  16           HD3      ILE  16  49.590  -0.449   2.124
  128    H    GLY  17           HN       GLY  17  48.390   5.272   1.967
  129    HA2  GLY  17           HA1      GLY  17  48.886   4.922   4.845
  130    HA3  GLY  17           HA2      GLY  17  49.405   6.293   3.845
  131    H    HIS  18           HN       HIS  18  46.525   6.014   2.643
  132    HA   HIS  18           HA       HIS  18  45.280   7.907   4.627
  133    HB2  HIS  18           HB2      HIS  18  45.003   7.335   1.703
  134    HB3  HIS  18           HB1      HIS  18  43.471   7.677   2.528
  135    HD1  HIS  18           HD1      HIS  18  46.691   9.285   3.704
  136    HD2  HIS  18           HD2      HIS  18  43.255  10.309   1.508
  137    HE1  HIS  18           HE1      HIS  18  46.733  11.816   3.359
  138    H    ALA  19           HN       ALA  19  44.587   4.799   2.908
  139    HA   ALA  19           HA       ALA  19  43.460   3.448   5.087
  140    HB1  ALA  19           HB1      ALA  19  41.680   4.960   5.459
  141    HB2  ALA  19           HB2      ALA  19  40.933   3.717   4.441
  142    HB3  ALA  19           HB3      ALA  19  41.450   5.259   3.720
  143    H    ALA  20           HN       ALA  20  44.487   3.655   2.058
  144    HA   ALA  20           HA       ALA  20  44.469   2.208   0.242
  145    HB1  ALA  20           HB1      ALA  20  44.791   0.541   2.176
  146    HB2  ALA  20           HB2      ALA  20  44.159  -0.112   0.646
  147    HB3  ALA  20           HB3      ALA  20  43.055   0.185   2.010
  148    H    VAL  21           HN       VAL  21  42.014   3.745   1.453
  149    HA   VAL  21           HA       VAL  21  40.141   2.962  -0.732
  150    HB   VAL  21           HB       VAL  21  39.347   3.228   2.208
  151   HG11  VAL  21          HG11      VAL  21  37.565   4.201   0.973
  152   HG12  VAL  21          HG12      VAL  21  37.056   2.512   1.177
  153   HG13  VAL  21          HG13      VAL  21  37.746   3.051  -0.374
  154   HG21  VAL  21          HG21      VAL  21  39.296   0.876   0.260
  155   HG22  VAL  21          HG22      VAL  21  38.573   0.857   1.886
  156   HG23  VAL  21          HG23      VAL  21  40.331   1.038   1.697
  157    H    ASN  22           HN       ASN  22  41.817   5.163   1.184
  158    HA   ASN  22           HA       ASN  22  42.068   7.466   0.626
  159    HB2  ASN  22           HB2      ASN  22  40.335   7.166  -1.282
  160    HB3  ASN  22           HB1      ASN  22  39.121   7.671  -0.078
  161   HD21  ASN  22          HD21      ASN  22  41.577   8.790  -2.284
  162   HD22  ASN  22          HD22      ASN  22  41.533  10.487  -1.794
  163    H    HIS  23           HN       HIS  23  39.235   6.108   2.201
  164    HA   HIS  23           HA       HIS  23  38.503   6.426   4.391
  165    HB2  HIS  23           HB2      HIS  23  40.973   7.278   4.815
  166    HB3  HIS  23           HB1      HIS  23  40.236   8.892   4.782
  167    HD1  HIS  23           HD1      HIS  23  40.582   5.810   6.865
  168    HD2  HIS  23           HD2      HIS  23  38.320   9.355   6.899
  169    HE1  HIS  23           HE1      HIS  23  39.492   5.997   9.170
  170    H    TYR  24           HN       TYR  24  37.153   7.354   2.177
  171    HA   TYR  24           HA       TYR  24  36.433  10.137   2.375
  172    HB2  TYR  24           HB2      TYR  24  34.538   9.530   0.933
  173    HB3  TYR  24           HB1      TYR  24  36.036   8.762   0.352
  174    HD1  TYR  24           HD1      TYR  24  32.872   8.184   2.253
  175    HD2  TYR  24           HD2      TYR  24  36.286   6.363   0.340
  176    HE1  TYR  24           HE1      TYR  24  31.796   5.946   2.460
  177    HE2  TYR  24           HE2      TYR  24  35.210   4.126   0.548
  178    HH   TYR  24           HH       TYR  24  33.223   3.074   0.958
  179    H    LEU  25           HN       LEU  25  35.330   7.199   3.987
  180    HA   LEU  25           HA       LEU  25  32.855   8.204   4.983
  181    HB2  LEU  25           HB2      LEU  25  32.858   6.355   6.468
  182    HB3  LEU  25           HB1      LEU  25  33.747   5.795   5.038
  183    HG   LEU  25           HG       LEU  25  34.932   6.712   7.700
  184   HD11  LEU  25          HD11      LEU  25  34.043   4.418   7.673
  185   HD12  LEU  25          HD12      LEU  25  35.822   4.388   7.710
  186   HD13  LEU  25          HD13      LEU  25  34.957   4.065   6.188
  187   HD21  LEU  25          HD21      LEU  25  36.246   6.050   5.029
  188   HD22  LEU  25          HD22      LEU  25  37.127   6.020   6.574
  189   HD23  LEU  25          HD23      LEU  25  36.420   7.541   5.986
  Start of MODEL   91
    1    H1   GLY   1           HT1      GLY   1  55.866  18.571  14.561
    2    H2   GLY   1           HT2      GLY   1  54.828  18.422  13.224
    3    H3   GLY   1           HT3      GLY   1  54.997  19.918  14.013
    4    HA2  GLY   1           HA1      GLY   1  57.034  20.331  13.164
    5    HA3  GLY   1           HA2      GLY   1  57.338  18.607  12.873
    6    H    TRP   2           HN       TRP   2  55.215  21.312  11.875
    7    HA   TRP   2           HA       TRP   2  54.241  21.766   9.817
    8    HB2  TRP   2           HB2      TRP   2  56.725  20.354   8.764
    9    HB3  TRP   2           HB1      TRP   2  55.685  21.480   7.858
   10    HD1  TRP   2           HD1      TRP   2  58.241  21.367  10.705
   11    HE1  TRP   2           HE1      TRP   2  59.116  23.768  11.187
   12    HE3  TRP   2           HE3      TRP   2  55.078  24.002   7.663
   13    HZ2  TRP   2           HZ2      TRP   2  58.500  26.452  10.346
   14    HZ3  TRP   2           HZ3      TRP   2  55.241  26.483   7.518
   15    HH2  TRP   2           HH2      TRP   2  56.947  27.709   8.856
   16    H    GLY   3           HN       GLY   3  54.251  20.448   7.367
   17    HA2  GLY   3           HA1      GLY   3  53.632  17.640   7.655
   18    HA3  GLY   3           HA2      GLY   3  52.151  18.619   7.644
   19    H    SER   4           HN       SER   4  54.585  20.187   5.932
   20    HA   SER   4           HA       SER   4  54.868  20.580   3.666
   21    HB2  SER   4           HB2      SER   4  55.630  18.135   3.858
   22    HB3  SER   4           HB1      SER   4  54.034  17.692   3.211
   23    HG   SER   4           HG       SER   4  56.191  18.516   1.892
   24    H    ILE   5           HN       ILE   5  53.336  18.898   1.619
   25    HA   ILE   5           HA       ILE   5  50.532  19.663   2.045
   26    HB   ILE   5           HB       ILE   5  51.563  21.836   1.313
   27   HG12  ILE   5          HG12      ILE   5  49.762  20.528  -0.782
   28   HG13  ILE   5          HG11      ILE   5  49.196  21.193   0.767
   29   HG21  ILE   5          HG21      ILE   5  53.337  20.644  -0.117
   30   HG22  ILE   5          HG22      ILE   5  52.568  22.070  -0.851
   31   HG23  ILE   5          HG23      ILE   5  52.065  20.434  -1.343
   32   HD11  ILE   5           HD1      ILE   5  48.837  22.945  -0.801
   33   HD12  ILE   5           HD2      ILE   5  50.405  22.674  -1.593
   34   HD13  ILE   5           HD3      ILE   5  50.342  23.403   0.029
   35    H    PHE   6           HN       PHE   6  53.137  18.585  -0.116
   36    HA   PHE   6           HA       PHE   6  51.259  17.179  -1.901
   37    HB2  PHE   6           HB2      PHE   6  54.282  16.878  -1.743
   38    HB3  PHE   6           HB1      PHE   6  53.215  16.516  -3.122
   39    HD1  PHE   6           HD1      PHE   6  55.125  19.093  -1.396
   40    HD2  PHE   6           HD2      PHE   6  51.939  18.424  -4.231
   41    HE1  PHE   6           HE1      PHE   6  55.355  21.437  -2.209
   42    HE2  PHE   6           HE2      PHE   6  52.170  20.767  -5.043
   43    HZ   PHE   6           HZ       PHE   6  53.838  22.290  -3.992
   44    H    LYS   7           HN       LYS   7  50.389  16.140   0.228
   45    HA   LYS   7           HA       LYS   7  50.232  14.281   1.608
   46    HB2  LYS   7           HB2      LYS   7  51.495  12.674  -0.623
   47    HB3  LYS   7           HB1      LYS   7  50.140  12.244   0.443
   48    HG2  LYS   7           HG2      LYS   7  50.114  14.346  -1.769
   49    HG3  LYS   7           HG1      LYS   7  49.284  12.773  -1.786
   50    HD2  LYS   7           HD2      LYS   7  48.046  13.537   0.318
   51    HD3  LYS   7           HD1      LYS   7  48.710  15.160   0.016
   52    HE2  LYS   7           HE2      LYS   7  47.681  15.154  -2.246
   53    HE3  LYS   7           HE1      LYS   7  46.989  13.547  -1.917
   54    HZ1  LYS   7           HZ1      LYS   7  45.269  14.644  -1.066
   55    HZ2  LYS   7           HZ2      LYS   7  46.092  16.130  -1.058
   56    HZ3  LYS   7           HZ3      LYS   7  46.265  15.053   0.245
   57    H    HIS   8           HN       HIS   8  52.820  15.783   1.736
   58    HA   HIS   8           HA       HIS   8  54.940  15.513   2.658
   59    HB2  HIS   8           HB2      HIS   8  53.500  14.821   4.564
   60    HB3  HIS   8           HB1      HIS   8  53.609  13.132   4.008
   61    HD1  HIS   8           HD1      HIS   8  56.007  16.008   4.919
   62    HD2  HIS   8           HD2      HIS   8  55.740  11.817   5.158
   63    HE1  HIS   8           HE1      HIS   8  58.102  15.179   6.123
   64    H    GLY   9           HN       GLY   9  53.967  13.703   0.264
   65    HA2  GLY   9           HA1      GLY   9  56.543  12.551  -0.266
   66    HA3  GLY   9           HA2      GLY   9  55.417  11.286   0.270
   67    H    ARG  10           HN       ARG  10  53.245  13.150  -0.865
   68    HA   ARG  10           HA       ARG  10  52.039  13.355  -2.809
   69    HB2  ARG  10           HB2      ARG  10  54.230  14.418  -3.606
   70    HB3  ARG  10           HB1      ARG  10  54.602  12.853  -4.365
   71    HG2  ARG  10           HG2      ARG  10  52.643  12.974  -5.772
   72    HG3  ARG  10           HG1      ARG  10  52.022  14.391  -4.893
   73    HD2  ARG  10           HD2      ARG  10  53.142  14.949  -7.092
   74    HD3  ARG  10           HD1      ARG  10  53.850  15.772  -5.679
   75    HE   ARG  10           HE       ARG  10  55.217  13.276  -6.215
   76   HH11  ARG  10          HH11      ARG  10  54.862  15.075  -8.784
   77   HH12  ARG  10          HH12      ARG  10  56.416  15.840  -8.804
   78   HH21  ARG  10          HH21      ARG  10  57.220  14.889  -5.567
   79   HH22  ARG  10          HH22      ARG  10  57.751  15.734  -6.983
   80    H    HIS  11           HN       HIS  11  50.748  11.662  -2.621
   81    HA   HIS  11           HA       HIS  11  49.786   9.673  -3.263
   82    HB2  HIS  11           HB2      HIS  11  51.989   9.225  -5.294
   83    HB3  HIS  11           HB1      HIS  11  50.279   8.737  -5.376
   84    HD1  HIS  11           HD1      HIS  11  49.588  11.828  -4.181
   85    HD2  HIS  11           HD2      HIS  11  51.356  10.651  -7.809
   86    HE1  HIS  11           HE1      HIS  11  49.305  13.761  -5.829
   87    H    ALA  12           HN       ALA  12  49.684   7.754  -2.728
   88    HA   ALA  12           HA       ALA  12  50.092   5.792  -1.706
   89    HB1  ALA  12           HB1      ALA  12  52.901   6.494  -2.020
   90    HB2  ALA  12           HB2      ALA  12  51.979   5.800  -3.360
   91    HB3  ALA  12           HB3      ALA  12  52.265   4.862  -1.871
   92    H    ALA  13           HN       ALA  13  52.200   8.532  -0.954
   93    HA   ALA  13           HA       ALA  13  52.573   7.725   1.834
   94    HB1  ALA  13           HB1      ALA  13  52.655  10.286   2.138
   95    HB2  ALA  13           HB2      ALA  13  52.479  10.425   0.372
   96    HB3  ALA  13           HB3      ALA  13  53.917   9.639   1.065
   97    H    LYS  14           HN       LYS  14  50.556   7.783  -0.653
   98    HA   LYS  14           HA       LYS  14  48.013   8.551   0.995
   99    HB2  LYS  14           HB2      LYS  14  48.758   9.631  -1.272
  100    HB3  LYS  14           HB1      LYS  14  48.427   7.990  -1.959
  101    HG2  LYS  14           HG2      LYS  14  46.124   8.326  -1.871
  102    HG3  LYS  14           HG1      LYS  14  46.182   9.160  -0.301
  103    HD2  LYS  14           HD2      LYS  14  46.801  11.248  -1.350
  104    HD3  LYS  14           HD1      LYS  14  47.060  10.450  -2.919
  105    HE2  LYS  14           HE2      LYS  14  44.859  11.651  -2.784
  106    HE3  LYS  14           HE1      LYS  14  44.680   9.906  -3.086
  107    HZ1  LYS  14           HZ1      LYS  14  43.226  10.948  -1.295
  108    HZ2  LYS  14           HZ2      LYS  14  44.629  11.024  -0.342
  109    HZ3  LYS  14           HZ3      LYS  14  44.050   9.523  -0.888
  110    H    HIS  15           HN       HIS  15  46.165   7.345  -0.438
  111    HA   HIS  15           HA       HIS  15  44.989   5.324  -0.300
  112    HB2  HIS  15           HB2      HIS  15  47.273   4.494  -2.124
  113    HB3  HIS  15           HB1      HIS  15  45.595   3.898  -2.143
  114    HD1  HIS  15           HD1      HIS  15  47.750   6.288  -3.781
  115    HD2  HIS  15           HD2      HIS  15  43.696   6.220  -2.660
  116    HE1  HIS  15           HE1      HIS  15  46.560   8.111  -5.119
  117    H    ILE  16           HN       ILE  16  47.354   5.594   1.622
  118    HA   ILE  16           HA       ILE  16  47.073   3.303   2.979
  119    HB   ILE  16           HB       ILE  16  48.054   1.870   1.344
  120   HG12  ILE  16          HG12      ILE  16  50.134   1.061   2.370
  121   HG13  ILE  16          HG11      ILE  16  50.277   2.555   3.318
  122   HG21  ILE  16          HG21      ILE  16  49.079   3.486  -0.172
  123   HG22  ILE  16          HG22      ILE  16  50.376   2.416   0.408
  124   HG23  ILE  16          HG23      ILE  16  50.187   4.028   1.104
  125   HD11  ILE  16           HD1      ILE  16  47.831   0.744   3.458
  126   HD12  ILE  16           HD2      ILE  16  48.292   2.044   4.581
  127   HD13  ILE  16           HD3      ILE  16  49.237   0.540   4.527
  128    H    GLY  17           HN       GLY  17  49.361   5.451   1.915
  129    HA2  GLY  17           HA1      GLY  17  50.543   5.805   4.576
  130    HA3  GLY  17           HA2      GLY  17  50.823   6.834   3.159
  131    H    HIS  18           HN       HIS  18  47.719   6.550   2.803
  132    HA   HIS  18           HA       HIS  18  47.087   8.973   4.475
  133    HB2  HIS  18           HB2      HIS  18  46.039   7.730   1.964
  134    HB3  HIS  18           HB1      HIS  18  44.780   8.384   3.028
  135    HD1  HIS  18           HD1      HIS  18  44.317  10.277   1.254
  136    HD2  HIS  18           HD2      HIS  18  48.197  10.323   2.874
  137    HE1  HIS  18           HE1      HIS  18  45.345  12.552   0.709
  138    H    ALA  19           HN       ALA  19  45.884   5.628   3.835
  139    HA   ALA  19           HA       ALA  19  45.361   4.886   6.462
  140    HB1  ALA  19           HB1      ALA  19  43.838   6.564   7.047
  141    HB2  ALA  19           HB2      ALA  19  42.724   5.331   6.418
  142    HB3  ALA  19           HB3      ALA  19  43.204   6.703   5.391
  143    H    ALA  20           HN       ALA  20  45.557   4.300   3.374
  144    HA   ALA  20           HA       ALA  20  44.999   2.507   2.017
  145    HB1  ALA  20           HB1      ALA  20  45.612   1.286   4.191
  146    HB2  ALA  20           HB2      ALA  20  44.595   0.399   3.030
  147    HB3  ALA  20           HB3      ALA  20  43.864   1.139   4.474
  148    H    VAL  21           HN       VAL  21  42.939   4.551   3.352
  149    HA   VAL  21           HA       VAL  21  40.616   3.515   1.775
  150    HB   VAL  21           HB       VAL  21  40.407   4.545   4.644
  151   HG11  VAL  21          HG11      VAL  21  38.424   5.207   3.510
  152   HG12  VAL  21          HG12      VAL  21  37.980   3.661   4.264
  153   HG13  VAL  21          HG13      VAL  21  38.377   3.723   2.531
  154   HG21  VAL  21          HG21      VAL  21  39.621   2.208   5.130
  155   HG22  VAL  21          HG22      VAL  21  41.314   2.263   4.592
  156   HG23  VAL  21          HG23      VAL  21  40.041   1.752   3.461
  157    H    ASN  22           HN       ASN  22  42.763   5.887   2.761
  158    HA   ASN  22           HA       ASN  22  42.976   7.965   1.560
  159    HB2  ASN  22           HB2      ASN  22  40.756   7.606   0.335
  160    HB3  ASN  22           HB1      ASN  22  39.966   8.348   1.751
  161   HD21  ASN  22          HD21      ASN  22  41.467   9.031  -1.258
  162   HD22  ASN  22          HD22      ASN  22  41.718  10.761  -0.999
  163    H    HIS  23           HN       HIS  23  40.713   7.297   4.189
  164    HA   HIS  23           HA       HIS  23  42.185   8.981   6.009
  165    HB2  HIS  23           HB2      HIS  23  41.032  10.766   4.695
  166    HB3  HIS  23           HB1      HIS  23  39.467  10.049   5.143
  167    HD1  HIS  23           HD1      HIS  23  42.665  11.080   7.040
  168    HD2  HIS  23           HD2      HIS  23  38.480  11.220   7.433
  169    HE1  HIS  23           HE1      HIS  23  42.144  12.317   9.214
  170    H    TYR  24           HN       TYR  24  38.972   9.424   6.795
  171    HA   TYR  24           HA       TYR  24  37.671   8.439   8.450
  172    HB2  TYR  24           HB2      TYR  24  38.537   5.944   6.936
  173    HB3  TYR  24           HB1      TYR  24  37.210   6.007   8.122
  174    HD1  TYR  24           HD1      TYR  24  38.383   7.228   4.802
  175    HD2  TYR  24           HD2      TYR  24  35.084   7.043   7.580
  176    HE1  TYR  24           HE1      TYR  24  36.840   8.052   3.026
  177    HE2  TYR  24           HE2      TYR  24  33.543   7.868   5.805
  178    HH   TYR  24           HH       TYR  24  33.950   9.364   3.568
  179    H    LEU  25           HN       LEU  25  40.814   8.501   8.660
  180    HA   LEU  25           HA       LEU  25  40.880   7.503  11.367
  181    HB2  LEU  25           HB2      LEU  25  40.983   5.302  10.393
  182    HB3  LEU  25           HB1      LEU  25  42.191   5.818   9.197
  183    HG   LEU  25           HG       LEU  25  43.888   6.078  10.906
  184   HD11  LEU  25          HD11      LEU  25  42.725   7.040  12.755
  185   HD12  LEU  25          HD12      LEU  25  43.245   5.442  13.338
  186   HD13  LEU  25          HD13      LEU  25  41.559   5.699  12.829
  187   HD21  LEU  25          HD21      LEU  25  42.280   3.537  11.428
  188   HD22  LEU  25          HD22      LEU  25  44.006   3.773  11.796
  189   HD23  LEU  25          HD23      LEU  25  43.448   3.769  10.105
  Start of MODEL   92
    1    H1   GLY   1           HT1      GLY   1  64.119  10.471   1.698
    2    H2   GLY   1           HT2      GLY   1  65.507   9.561   2.061
    3    H3   GLY   1           HT3      GLY   1  65.534  10.693   0.794
    4    HA2  GLY   1           HA1      GLY   1  65.005  11.433   3.584
    5    HA3  GLY   1           HA2      GLY   1  66.642  11.358   2.905
    6    H    TRP   2           HN       TRP   2  65.520  12.156   0.207
    7    HA   TRP   2           HA       TRP   2  65.937  15.005   0.553
    8    HB2  TRP   2           HB2      TRP   2  64.912  13.420  -1.838
    9    HB3  TRP   2           HB1      TRP   2  65.446  15.118  -1.873
   10    HD1  TRP   2           HD1      TRP   2  66.817  11.592  -1.090
   11    HE1  TRP   2           HE1      TRP   2  69.381  11.558  -1.528
   12    HE3  TRP   2           HE3      TRP   2  67.514  16.543  -2.191
   13    HZ2  TRP   2           HZ2      TRP   2  71.429  13.446  -2.257
   14    HZ3  TRP   2           HZ3      TRP   2  69.781  17.404  -2.754
   15    HH2  TRP   2           HH2      TRP   2  71.737  15.863  -2.788
   16    H    GLY   3           HN       GLY   3  63.157  12.895   0.522
   17    HA2  GLY   3           HA1      GLY   3  60.939  13.374   0.996
   18    HA3  GLY   3           HA2      GLY   3  61.427  15.029   1.410
   19    H    SER   4           HN       SER   4  62.586  14.309  -1.644
   20    HA   SER   4           HA       SER   4  61.974  15.125  -3.731
   21    HB2  SER   4           HB2      SER   4  60.461  13.230  -3.725
   22    HB3  SER   4           HB1      SER   4  59.275  14.123  -2.746
   23    HG   SER   4           HG       SER   4  59.769  14.200  -5.441
   24    H    ILE   5           HN       ILE   5  60.058  16.509  -4.870
   25    HA   ILE   5           HA       ILE   5  60.246  19.101  -3.554
   26    HB   ILE   5           HB       ILE   5  58.438  18.436  -5.916
   27   HG12  ILE   5          HG12      ILE   5  61.450  18.948  -5.899
   28   HG13  ILE   5          HG11      ILE   5  60.642  17.434  -6.370
   29   HG21  ILE   5          HG21      ILE   5  58.480  20.738  -4.721
   30   HG22  ILE   5          HG22      ILE   5  58.718  20.734  -6.483
   31   HG23  ILE   5          HG23      ILE   5  60.115  20.923  -5.396
   32   HD11  ILE   5           HD1      ILE   5  61.099  18.539  -8.429
   33   HD12  ILE   5           HD2      ILE   5  60.592  20.119  -7.791
   34   HD13  ILE   5           HD3      ILE   5  59.375  18.861  -8.124
   35    H    PHE   6           HN       PHE   6  57.613  16.773  -4.236
   36    HA   PHE   6           HA       PHE   6  56.144  17.709  -1.873
   37    HB2  PHE   6           HB2      PHE   6  55.118  18.275  -4.682
   38    HB3  PHE   6           HB1      PHE   6  54.045  18.189  -3.266
   39    HD1  PHE   6           HD1      PHE   6  54.898  19.589  -1.144
   40    HD2  PHE   6           HD2      PHE   6  56.011  20.394  -5.240
   41    HE1  PHE   6           HE1      PHE   6  55.472  21.933  -0.530
   42    HE2  PHE   6           HE2      PHE   6  56.585  22.737  -4.621
   43    HZ   PHE   6           HZ       PHE   6  56.358  23.493  -2.259
   44    H    LYS   7           HN       LYS   7  56.892  15.523  -4.386
   45    HA   LYS   7           HA       LYS   7  54.685  13.798  -4.495
   46    HB2  LYS   7           HB2      LYS   7  57.619  12.993  -4.361
   47    HB3  LYS   7           HB1      LYS   7  56.287  12.020  -5.030
   48    HG2  LYS   7           HG2      LYS   7  55.852  13.756  -6.730
   49    HG3  LYS   7           HG1      LYS   7  57.157  14.758  -6.052
   50    HD2  LYS   7           HD2      LYS   7  58.808  13.011  -6.574
   51    HD3  LYS   7           HD1      LYS   7  57.517  11.953  -7.193
   52    HE2  LYS   7           HE2      LYS   7  58.625  13.080  -9.071
   53    HE3  LYS   7           HE1      LYS   7  56.960  13.688  -8.908
   54    HZ1  LYS   7           HZ1      LYS   7  58.926  15.343  -9.161
   55    HZ2  LYS   7           HZ2      LYS   7  59.156  15.063  -7.501
   56    HZ3  LYS   7           HZ3      LYS   7  57.678  15.684  -8.065
   57    H    HIS   8           HN       HIS   8  57.511  13.399  -2.299
   58    HA   HIS   8           HA       HIS   8  56.022  11.502  -0.635
   59    HB2  HIS   8           HB2      HIS   8  58.500  11.396  -1.009
   60    HB3  HIS   8           HB1      HIS   8  58.666  12.902  -0.075
   61    HD1  HIS   8           HD1      HIS   8  55.944  10.706   1.130
   62    HD2  HIS   8           HD2      HIS   8  60.039  11.244   1.924
   63    HE1  HIS   8           HE1      HIS   8  56.464   9.485   3.313
   64    H    GLY   9           HN       GLY   9  54.290  13.394  -0.538
   65    HA2  GLY   9           HA1      GLY   9  54.249  14.242   2.204
   66    HA3  GLY   9           HA2      GLY   9  54.675  15.613   1.162
   67    H    ARG  10           HN       ARG  10  52.986  13.981  -0.951
   68    HA   ARG  10           HA       ARG  10  50.261  14.722   0.077
   69    HB2  ARG  10           HB2      ARG  10  51.452  15.574  -2.598
   70    HB3  ARG  10           HB1      ARG  10  49.757  15.794  -2.103
   71    HG2  ARG  10           HG2      ARG  10  50.495  17.170  -0.177
   72    HG3  ARG  10           HG1      ARG  10  52.189  16.959  -0.679
   73    HD2  ARG  10           HD2      ARG  10  51.288  19.125  -1.478
   74    HD3  ARG  10           HD1      ARG  10  51.690  18.054  -2.842
   75    HE   ARG  10           HE       ARG  10  49.405  18.085  -3.410
   76   HH11  ARG  10          HH11      ARG  10  49.902  19.501  -0.339
   77   HH12  ARG  10          HH12      ARG  10  48.221  19.541   0.077
   78   HH21  ARG  10          HH21      ARG  10  47.202  17.847  -2.773
   79   HH22  ARG  10          HH22      ARG  10  46.693  18.603  -1.300
   80    H    HIS  11           HN       HIS  11  52.077  12.292  -0.705
   81    HA   HIS  11           HA       HIS  11  49.851  10.747  -1.818
   82    HB2  HIS  11           HB2      HIS  11  52.397  11.170  -3.434
   83    HB3  HIS  11           HB1      HIS  11  51.231   9.859  -3.738
   84    HD1  HIS  11           HD1      HIS  11  48.854  10.510  -4.626
   85    HD2  HIS  11           HD2      HIS  11  51.563  13.711  -4.328
   86    HE1  HIS  11           HE1      HIS  11  47.834  12.490  -5.877
   87    H    ALA  12           HN       ALA  12  49.949   8.700  -1.570
   88    HA   ALA  12           HA       ALA  12  50.513   6.672  -0.684
   89    HB1  ALA  12           HB1      ALA  12  52.764   6.177  -0.257
   90    HB2  ALA  12           HB2      ALA  12  53.064   7.897  -0.004
   91    HB3  ALA  12           HB3      ALA  12  52.775   7.296  -1.639
   92    H    ALA  13           HN       ALA  13  51.599   9.669   0.824
   93    HA   ALA  13           HA       ALA  13  51.351   8.632   3.553
   94    HB1  ALA  13           HB1      ALA  13  52.321  10.855   3.441
   95    HB2  ALA  13           HB2      ALA  13  50.626  11.136   3.909
   96    HB3  ALA  13           HB3      ALA  13  51.138  11.384   2.222
   97    H    LYS  14           HN       LYS  14  50.178   8.510   0.601
   98    HA   LYS  14           HA       LYS  14  47.161   8.494   1.425
   99    HB2  LYS  14           HB2      LYS  14  48.198  10.011  -0.443
  100    HB3  LYS  14           HB1      LYS  14  48.491   8.454  -1.306
  101    HG2  LYS  14           HG2      LYS  14  46.243   8.239  -1.870
  102    HG3  LYS  14           HG1      LYS  14  45.663   8.870  -0.311
  103    HD2  LYS  14           HD2      LYS  14  46.125  11.171  -1.044
  104    HD3  LYS  14           HD1      LYS  14  46.810  10.568  -2.572
  105    HE2  LYS  14           HE2      LYS  14  44.634   9.572  -3.175
  106    HE3  LYS  14           HE1      LYS  14  43.940  10.130  -1.634
  107    HZ1  LYS  14           HZ1      LYS  14  43.690  12.181  -2.432
  108    HZ2  LYS  14           HZ2      LYS  14  43.971  11.526  -3.973
  109    HZ3  LYS  14           HZ3      LYS  14  45.248  12.226  -3.101
  110    H    HIS  15           HN       HIS  15  46.144   7.119  -0.559
  111    HA   HIS  15           HA       HIS  15  45.525   4.886  -0.907
  112    HB2  HIS  15           HB2      HIS  15  46.946   5.621  -2.829
  113    HB3  HIS  15           HB1      HIS  15  48.352   4.888  -2.022
  114    HD1  HIS  15           HD1      HIS  15  45.028   3.187  -1.661
  115    HD2  HIS  15           HD2      HIS  15  48.486   2.831  -4.026
  116    HE1  HIS  15           HE1      HIS  15  44.881   0.954  -2.895
  117    H    ILE  16           HN       ILE  16  47.140   5.426   1.646
  118    HA   ILE  16           HA       ILE  16  47.070   2.971   2.718
  119    HB   ILE  16           HB       ILE  16  48.784   2.013   1.372
  120   HG12  ILE  16          HG12      ILE  16  50.426   2.888   3.774
  121   HG13  ILE  16          HG11      ILE  16  49.003   1.852   4.007
  122   HG21  ILE  16          HG21      ILE  16  49.744   4.004   0.325
  123   HG22  ILE  16          HG22      ILE  16  51.063   3.207   1.203
  124   HG23  ILE  16          HG23      ILE  16  50.269   4.617   1.904
  125   HD11  ILE  16           HD1      ILE  16  51.486   1.231   2.348
  126   HD12  ILE  16           HD2      ILE  16  50.001   0.252   2.287
  127   HD13  ILE  16           HD3      ILE  16  50.912   0.395   3.806
  128    H    GLY  17           HN       GLY  17  48.830   5.768   2.500
  129    HA2  GLY  17           HA1      GLY  17  49.165   5.977   5.422
  130    HA3  GLY  17           HA2      GLY  17  49.558   7.225   4.222
  131    H    HIS  18           HN       HIS  18  46.841   6.271   2.946
  132    HA   HIS  18           HA       HIS  18  45.184   8.249   4.514
  133    HB2  HIS  18           HB2      HIS  18  45.214   7.201   1.704
  134    HB3  HIS  18           HB1      HIS  18  43.598   7.480   2.385
  135    HD1  HIS  18           HD1      HIS  18  46.483   9.642   3.501
  136    HD2  HIS  18           HD2      HIS  18  43.327   9.825   0.729
  137    HE1  HIS  18           HE1      HIS  18  46.279  12.072   2.739
  138    H    ALA  19           HN       ALA  19  45.145   4.828   3.339
  139    HA   ALA  19           HA       ALA  19  44.009   3.689   5.611
  140    HB1  ALA  19           HB1      ALA  19  41.992   4.865   5.684
  141    HB2  ALA  19           HB2      ALA  19  41.508   3.495   4.664
  142    HB3  ALA  19           HB3      ALA  19  41.921   5.058   3.917
  143    H    ALA  20           HN       ALA  20  45.315   3.523   2.725
  144    HA   ALA  20           HA       ALA  20  45.666   1.818   1.187
  145    HB1  ALA  20           HB1      ALA  20  44.384  -0.034   3.222
  146    HB2  ALA  20           HB2      ALA  20  46.051   0.569   3.376
  147    HB3  ALA  20           HB3      ALA  20  45.592  -0.436   1.981
  148    H    VAL  21           HN       VAL  21  42.887   3.121   1.870
  149    HA   VAL  21           HA       VAL  21  41.434   1.704  -0.304
  150    HB   VAL  21           HB       VAL  21  40.234   2.194   2.464
  151   HG11  VAL  21          HG11      VAL  21  38.296   0.847   1.335
  152   HG12  VAL  21          HG12      VAL  21  39.073   1.294  -0.201
  153   HG13  VAL  21          HG13      VAL  21  38.482   2.558   0.903
  154   HG21  VAL  21          HG21      VAL  21  39.977  -0.340   2.420
  155   HG22  VAL  21          HG22      VAL  21  41.657   0.226   2.516
  156   HG23  VAL  21          HG23      VAL  21  41.004  -0.354   0.966
  157    H    ASN  22           HN       ASN  22  42.464   4.392   1.421
  158    HA   ASN  22           HA       ASN  22  42.353   6.620   0.567
  159    HB2  ASN  22           HB2      ASN  22  40.878   5.795  -1.399
  160    HB3  ASN  22           HB1      ASN  22  39.488   6.167  -0.344
  161   HD21  ASN  22          HD21      ASN  22  40.287   7.546  -2.893
  162   HD22  ASN  22          HD22      ASN  22  40.554   9.232  -2.437
  163    H    HIS  23           HN       HIS  23  39.698   4.908   2.108
  164    HA   HIS  23           HA       HIS  23  39.681   6.910   4.300
  165    HB2  HIS  23           HB2      HIS  23  37.218   6.280   2.626
  166    HB3  HIS  23           HB1      HIS  23  37.199   7.145   4.181
  167    HD1  HIS  23           HD1      HIS  23  37.339   7.758   0.626
  168    HD2  HIS  23           HD2      HIS  23  39.164   9.514   3.984
  169    HE1  HIS  23           HE1      HIS  23  38.112  10.093  -0.062
  170    H    TYR  24           HN       TYR  24  39.788   5.794   6.106
  171    HA   TYR  24           HA       TYR  24  39.225   2.953   6.179
  172    HB2  TYR  24           HB2      TYR  24  39.696   3.149   8.578
  173    HB3  TYR  24           HB1      TYR  24  40.901   4.068   7.645
  174    HD1  TYR  24           HD1      TYR  24  37.907   4.316   9.831
  175    HD2  TYR  24           HD2      TYR  24  40.962   6.506   7.711
  176    HE1  TYR  24           HE1      TYR  24  37.284   6.385  11.072
  177    HE2  TYR  24           HE2      TYR  24  40.339   8.575   8.952
  178    HH   TYR  24           HH       TYR  24  37.537   8.601  11.171
  179    H    LEU  25           HN       LEU  25  37.148   5.403   5.788
  180    HA   LEU  25           HA       LEU  25  34.902   5.734   6.268
  181    HB2  LEU  25           HB2      LEU  25  34.954   2.727   6.763
  182    HB3  LEU  25           HB1      LEU  25  33.508   3.717   6.475
  183    HG   LEU  25           HG       LEU  25  35.126   4.391   4.273
  184   HD11  LEU  25          HD11      LEU  25  35.326   1.366   4.564
  185   HD12  LEU  25          HD12      LEU  25  36.648   2.454   5.041
  186   HD13  LEU  25          HD13      LEU  25  36.097   2.416   3.351
  187   HD21  LEU  25          HD21      LEU  25  33.571   3.003   2.952
  188   HD22  LEU  25          HD22      LEU  25  32.692   3.870   4.234
  189   HD23  LEU  25          HD23      LEU  25  33.066   2.140   4.425
  Start of MODEL   93
    1    H1   GLY   1           HT1      GLY   1  68.007   8.565   0.864
    2    H2   GLY   1           HT2      GLY   1  66.762   9.720   0.939
    3    H3   GLY   1           HT3      GLY   1  68.248  10.015   1.707
    4    HA2  GLY   1           HA1      GLY   1  69.118  10.867  -0.075
    5    HA3  GLY   1           HA2      GLY   1  68.657   9.427  -1.004
    6    H    TRP   2           HN       TRP   2  68.428  11.208  -2.666
    7    HA   TRP   2           HA       TRP   2  67.065  12.597  -3.934
    8    HB2  TRP   2           HB2      TRP   2  64.797  11.056  -2.619
    9    HB3  TRP   2           HB1      TRP   2  64.780  11.864  -4.204
   10    HD1  TRP   2           HD1      TRP   2  66.243  10.764  -6.160
   11    HE1  TRP   2           HE1      TRP   2  67.071   8.331  -6.561
   12    HE3  TRP   2           HE3      TRP   2  65.600   8.903  -1.434
   13    HZ2  TRP   2           HZ2      TRP   2  67.396   5.924  -5.015
   14    HZ3  TRP   2           HZ3      TRP   2  66.175   6.535  -0.920
   15    HH2  TRP   2           HH2      TRP   2  67.072   5.045  -2.704
   16    H    GLY   3           HN       GLY   3  64.237  13.258  -3.167
   17    HA2  GLY   3           HA1      GLY   3  64.124  14.611  -0.689
   18    HA3  GLY   3           HA2      GLY   3  64.796  15.749  -1.872
   19    H    SER   4           HN       SER   4  63.003  13.770  -3.718
   20    HA   SER   4           HA       SER   4  60.992  14.110  -4.826
   21    HB2  SER   4           HB2      SER   4  59.011  14.143  -3.424
   22    HB3  SER   4           HB1      SER   4  60.223  13.085  -2.667
   23    HG   SER   4           HG       SER   4  59.128  15.436  -1.790
   24    H    ILE   5           HN       ILE   5  58.812  15.745  -4.389
   25    HA   ILE   5           HA       ILE   5  59.848  18.539  -4.209
   26    HB   ILE   5           HB       ILE   5  58.216  17.621  -6.618
   27   HG12  ILE   5          HG12      ILE   5  61.231  18.014  -6.337
   28   HG13  ILE   5          HG11      ILE   5  60.389  16.500  -6.735
   29   HG21  ILE   5          HG21      ILE   5  58.692  19.807  -7.483
   30   HG22  ILE   5          HG22      ILE   5  59.928  20.114  -6.240
   31   HG23  ILE   5          HG23      ILE   5  58.206  20.061  -5.793
   32   HD11  ILE   5           HD1      ILE   5  59.414  17.807  -8.767
   33   HD12  ILE   5           HD2      ILE   5  61.123  17.317  -8.839
   34   HD13  ILE   5           HD3      ILE   5  60.697  18.997  -8.435
   35    H    PHE   6           HN       PHE   6  57.272  16.163  -4.324
   36    HA   PHE   6           HA       PHE   6  55.658  17.697  -2.478
   37    HB2  PHE   6           HB2      PHE   6  53.687  18.021  -3.947
   38    HB3  PHE   6           HB1      PHE   6  55.082  18.983  -4.491
   39    HD1  PHE   6           HD1      PHE   6  56.069  18.619  -6.649
   40    HD2  PHE   6           HD2      PHE   6  53.174  15.816  -5.099
   41    HE1  PHE   6           HE1      PHE   6  55.968  17.494  -8.869
   42    HE2  PHE   6           HE2      PHE   6  53.074  14.693  -7.320
   43    HZ   PHE   6           HZ       PHE   6  54.444  15.554  -9.216
   44    H    LYS   7           HN       LYS   7  56.314  15.020  -4.575
   45    HA   LYS   7           HA       LYS   7  54.093  13.352  -4.240
   46    HB2  LYS   7           HB2      LYS   7  57.040  12.591  -4.132
   47    HB3  LYS   7           HB1      LYS   7  55.695  11.458  -4.416
   48    HG2  LYS   7           HG2      LYS   7  55.025  12.955  -6.389
   49    HG3  LYS   7           HG1      LYS   7  56.592  13.772  -6.179
   50    HD2  LYS   7           HD2      LYS   7  56.228  10.776  -6.636
   51    HD3  LYS   7           HD1      LYS   7  56.686  11.950  -7.891
   52    HE2  LYS   7           HE2      LYS   7  58.771  11.091  -7.196
   53    HE3  LYS   7           HE1      LYS   7  58.639  12.584  -6.239
   54    HZ1  LYS   7           HZ1      LYS   7  59.002  11.227  -4.514
   55    HZ2  LYS   7           HZ2      LYS   7  58.604   9.822  -5.384
   56    HZ3  LYS   7           HZ3      LYS   7  57.378  10.769  -4.687
   57    H    HIS   8           HN       HIS   8  57.039  13.098  -2.198
   58    HA   HIS   8           HA       HIS   8  55.516  11.736  -0.097
   59    HB2  HIS   8           HB2      HIS   8  57.938  11.278  -0.651
   60    HB3  HIS   8           HB1      HIS   8  58.335  12.876   0.024
   61    HD1  HIS   8           HD1      HIS   8  55.689  10.535   1.456
   62    HD2  HIS   8           HD2      HIS   8  59.498  12.029   2.429
   63    HE1  HIS   8           HE1      HIS   8  56.219   9.779   3.839
   64    H    GLY   9           HN       GLY   9  53.996  13.769  -0.178
   65    HA2  GLY   9           HA1      GLY   9  54.512  15.209   2.299
   66    HA3  GLY   9           HA2      GLY   9  54.657  16.250   0.871
   67    H    ARG  10           HN       ARG  10  52.599  14.520  -0.548
   68    HA   ARG  10           HA       ARG  10  50.141  15.079   1.025
   69    HB2  ARG  10           HB2      ARG  10  49.147  16.512  -0.670
   70    HB3  ARG  10           HB1      ARG  10  50.679  17.235  -0.123
   71    HG2  ARG  10           HG2      ARG  10  51.786  16.034  -2.115
   72    HG3  ARG  10           HG1      ARG  10  50.137  15.718  -2.706
   73    HD2  ARG  10           HD2      ARG  10  51.528  18.387  -2.312
   74    HD3  ARG  10           HD1      ARG  10  50.756  17.743  -3.780
   75    HE   ARG  10           HE       ARG  10  48.821  18.016  -1.649
   76   HH11  ARG  10          HH11      ARG  10  47.802  18.782  -4.148
   77   HH12  ARG  10          HH12      ARG  10  47.946  20.506  -4.211
   78   HH21  ARG  10          HH21      ARG  10  50.261  20.670  -1.634
   79   HH22  ARG  10          HH22      ARG  10  49.338  21.576  -2.786
   80    H    HIS  11           HN       HIS  11  51.865  12.976  -0.660
   81    HA   HIS  11           HA       HIS  11  49.453  11.516  -1.558
   82    HB2  HIS  11           HB2      HIS  11  50.120  12.821  -3.578
   83    HB3  HIS  11           HB1      HIS  11  51.743  12.098  -3.478
   84    HD1  HIS  11           HD1      HIS  11  48.485  10.228  -2.804
   85    HD2  HIS  11           HD2      HIS  11  51.476  10.447  -5.752
   86    HE1  HIS  11           HE1      HIS  11  48.107   8.286  -4.421
   87    H    ALA  12           HN       ALA  12  49.573   9.460  -1.629
   88    HA   ALA  12           HA       ALA  12  50.273   7.324  -1.178
   89    HB1  ALA  12           HB1      ALA  12  52.303   8.127  -2.460
   90    HB2  ALA  12           HB2      ALA  12  52.559   6.817  -1.279
   91    HB3  ALA  12           HB3      ALA  12  52.926   8.490  -0.861
   92    H    ALA  13           HN       ALA  13  51.594  10.097   0.537
   93    HA   ALA  13           HA       ALA  13  51.888   8.646   3.070
   94    HB1  ALA  13           HB1      ALA  13  52.804  10.939   3.013
   95    HB2  ALA  13           HB2      ALA  13  51.319  10.993   3.994
   96    HB3  ALA  13           HB3      ALA  13  51.297  11.567   2.308
   97    H    LYS  14           HN       LYS  14  50.209   8.937   0.379
   98    HA   LYS  14           HA       LYS  14  47.388   8.662   1.690
   99    HB2  LYS  14           HB2      LYS  14  48.118  10.487  -0.082
  100    HB3  LYS  14           HB1      LYS  14  48.137   9.092  -1.219
  101    HG2  LYS  14           HG2      LYS  14  45.605   8.964   0.197
  102    HG3  LYS  14           HG1      LYS  14  45.838  10.684  -0.154
  103    HD2  LYS  14           HD2      LYS  14  46.368   9.994  -2.569
  104    HD3  LYS  14           HD1      LYS  14  45.771   8.375  -2.138
  105    HE2  LYS  14           HE2      LYS  14  43.902   9.569  -3.079
  106    HE3  LYS  14           HE1      LYS  14  43.633   9.501  -1.321
  107    HZ1  LYS  14           HZ1      LYS  14  45.185  11.778  -2.122
  108    HZ2  LYS  14           HZ2      LYS  14  43.784  11.702  -1.163
  109    HZ3  LYS  14           HZ3      LYS  14  43.656  11.757  -2.856
  110    H    HIS  15           HN       HIS  15  46.181   7.595  -0.562
  111    HA   HIS  15           HA       HIS  15  45.585   5.399  -1.153
  112    HB2  HIS  15           HB2      HIS  15  46.846   6.481  -3.042
  113    HB3  HIS  15           HB1      HIS  15  48.312   5.647  -2.475
  114    HD1  HIS  15           HD1      HIS  15  44.916   3.987  -2.282
  115    HD2  HIS  15           HD2      HIS  15  48.378   3.839  -4.665
  116    HE1  HIS  15           HE1      HIS  15  44.700   1.955  -3.814
  117    H    ILE  16           HN       ILE  16  47.342   5.589   1.333
  118    HA   ILE  16           HA       ILE  16  47.483   3.004   2.015
  119    HB   ILE  16           HB       ILE  16  49.104   2.353   0.378
  120   HG12  ILE  16          HG12      ILE  16  51.086   1.733   1.674
  121   HG13  ILE  16          HG11      ILE  16  50.659   2.901   2.942
  122   HG21  ILE  16          HG21      ILE  16  51.297   3.600   0.158
  123   HG22  ILE  16          HG22      ILE  16  50.640   4.848   1.217
  124   HG23  ILE  16          HG23      ILE  16  49.905   4.573  -0.375
  125   HD11  ILE  16           HD1      ILE  16  49.985   0.453   3.363
  126   HD12  ILE  16           HD2      ILE  16  48.776   0.670   2.075
  127   HD13  ILE  16           HD3      ILE  16  48.694   1.660   3.550
  128    H    GLY  17           HN       GLY  17  49.318   5.765   2.061
  129    HA2  GLY  17           HA1      GLY  17  49.899   5.621   4.912
  130    HA3  GLY  17           HA2      GLY  17  50.111   7.044   3.872
  131    H    HIS  18           HN       HIS  18  47.269   6.207   2.835
  132    HA   HIS  18           HA       HIS  18  45.799   7.854   4.897
  133    HB2  HIS  18           HB2      HIS  18  45.493   7.285   1.965
  134    HB3  HIS  18           HB1      HIS  18  43.973   7.400   2.872
  135    HD1  HIS  18           HD1      HIS  18  43.466   9.652   1.565
  136    HD2  HIS  18           HD2      HIS  18  46.884   9.770   4.010
  137    HE1  HIS  18           HE1      HIS  18  44.092  12.108   1.883
  138    H    ALA  19           HN       ALA  19  45.663   4.711   3.142
  139    HA   ALA  19           HA       ALA  19  44.903   3.072   5.222
  140    HB1  ALA  19           HB1      ALA  19  42.269   3.015   4.719
  141    HB2  ALA  19           HB2      ALA  19  42.552   4.723   4.303
  142    HB3  ALA  19           HB3      ALA  19  42.943   4.124   5.934
  143    H    ALA  20           HN       ALA  20  45.686   3.609   2.213
  144    HA   ALA  20           HA       ALA  20  45.772   2.310   0.293
  145    HB1  ALA  20           HB1      ALA  20  46.401   0.579   2.077
  146    HB2  ALA  20           HB2      ALA  20  45.781  -0.054   0.534
  147    HB3  ALA  20           HB3      ALA  20  44.722   0.005   1.961
  148    H    VAL  21           HN       VAL  21  43.115   3.352   1.704
  149    HA   VAL  21           HA       VAL  21  41.351   2.449  -0.535
  150    HB   VAL  21           HB       VAL  21  40.527   2.392   2.407
  151   HG11  VAL  21          HG11      VAL  21  38.603   3.012   1.152
  152   HG12  VAL  21          HG12      VAL  21  38.457   1.249   1.303
  153   HG13  VAL  21          HG13      VAL  21  39.045   1.965  -0.216
  154   HG21  VAL  21          HG21      VAL  21  40.278  -0.076   1.988
  155   HG22  VAL  21          HG22      VAL  21  41.962   0.479   1.856
  156   HG23  VAL  21          HG23      VAL  21  41.015   0.154   0.385
  157    H    ASN  22           HN       ASN  22  42.670   4.743   1.526
  158    HA   ASN  22           HA       ASN  22  42.499   7.099   1.042
  159    HB2  ASN  22           HB2      ASN  22  40.630   6.727  -0.662
  160    HB3  ASN  22           HB1      ASN  22  39.493   6.774   0.714
  161   HD21  ASN  22          HD21      ASN  22  39.341   8.803   1.971
  162   HD22  ASN  22          HD22      ASN  22  39.874  10.322   1.243
  163    H    HIS  23           HN       HIS  23  40.153   5.171   2.857
  164    HA   HIS  23           HA       HIS  23  40.899   6.419   5.343
  165    HB2  HIS  23           HB2      HIS  23  38.634   7.476   5.807
  166    HB3  HIS  23           HB1      HIS  23  39.645   8.341   4.625
  167    HD1  HIS  23           HD1      HIS  23  38.540   5.388   2.933
  168    HD2  HIS  23           HD2      HIS  23  36.695   9.036   3.928
  169    HE1  HIS  23           HE1      HIS  23  36.524   5.669   1.388
  170    H    TYR  24           HN       TYR  24  41.012   4.415   6.226
  171    HA   TYR  24           HA       TYR  24  38.499   3.193   7.036
  172    HB2  TYR  24           HB2      TYR  24  38.737   2.340   4.677
  173    HB3  TYR  24           HB1      TYR  24  40.264   1.566   5.166
  174    HD1  TYR  24           HD1      TYR  24  36.582   1.676   5.809
  175    HD2  TYR  24           HD2      TYR  24  40.271  -0.471   6.453
  176    HE1  TYR  24           HE1      TYR  24  35.300  -0.252   6.728
  177    HE2  TYR  24           HE2      TYR  24  38.988  -2.400   7.372
  178    HH   TYR  24           HH       TYR  24  36.926  -2.875   8.379
  179    H    LEU  25           HN       LEU  25  41.606   4.026   7.500
  180    HA   LEU  25           HA       LEU  25  43.259   3.387   9.002
  181    HB2  LEU  25           HB2      LEU  25  41.066   1.985  10.565
  182    HB3  LEU  25           HB1      LEU  25  42.507   2.829  11.180
  183    HG   LEU  25           HG       LEU  25  40.108   4.108   9.796
  184   HD11  LEU  25          HD11      LEU  25  39.857   3.341  12.206
  185   HD12  LEU  25          HD12      LEU  25  39.646   5.091  11.958
  186   HD13  LEU  25          HD13      LEU  25  41.171   4.463  12.630
  187   HD21  LEU  25          HD21      LEU  25  41.347   6.256  10.534
  188   HD22  LEU  25          HD22      LEU  25  42.024   5.389   9.138
  189   HD23  LEU  25          HD23      LEU  25  42.783   5.224  10.740
  Start of MODEL   94
    1    H1   GLY   1           HT1      GLY   1  69.259  13.620  -0.966
    2    H2   GLY   1           HT2      GLY   1  68.145  14.384   0.064
    3    H3   GLY   1           HT3      GLY   1  67.962  14.490  -1.623
    4    HA2  GLY   1           HA1      GLY   1  68.083  11.819  -0.602
    5    HA3  GLY   1           HA2      GLY   1  66.693  12.768  -0.042
    6    H    TRP   2           HN       TRP   2  64.986  12.148  -1.189
    7    HA   TRP   2           HA       TRP   2  65.238  11.284  -3.968
    8    HB2  TRP   2           HB2      TRP   2  62.771  11.920  -2.300
    9    HB3  TRP   2           HB1      TRP   2  62.785  11.072  -3.866
   10    HD1  TRP   2           HD1      TRP   2  64.065   8.674  -3.929
   11    HE1  TRP   2           HE1      TRP   2  64.384   6.862  -2.091
   12    HE3  TRP   2           HE3      TRP   2  63.058  11.529   0.200
   13    HZ2  TRP   2           HZ2      TRP   2  64.216   6.708   0.780
   14    HZ3  TRP   2           HZ3      TRP   2  63.143  10.528   2.479
   15    HH2  TRP   2           HH2      TRP   2  63.720   8.122   2.772
   16    H    GLY   3           HN       GLY   3  64.615  12.318  -5.828
   17    HA2  GLY   3           HA1      GLY   3  64.803  15.200  -5.803
   18    HA3  GLY   3           HA2      GLY   3  64.419  14.175  -7.201
   19    H    SER   4           HN       SER   4  62.317  13.284  -4.817
   20    HA   SER   4           HA       SER   4  60.028  14.350  -6.125
   21    HB2  SER   4           HB2      SER   4  60.388  13.384  -3.264
   22    HB3  SER   4           HB1      SER   4  58.817  13.702  -4.031
   23    HG   SER   4           HG       SER   4  59.884  12.219  -5.751
   24    H    ILE   5           HN       ILE   5  58.323  15.575  -4.596
   25    HA   ILE   5           HA       ILE   5  59.620  17.901  -3.252
   26    HB   ILE   5           HB       ILE   5  57.537  18.345  -5.436
   27   HG12  ILE   5          HG12      ILE   5  60.583  18.509  -5.592
   28   HG13  ILE   5          HG11      ILE   5  59.525  17.422  -6.522
   29   HG21  ILE   5          HG21      ILE   5  57.926  20.017  -3.514
   30   HG22  ILE   5          HG22      ILE   5  58.089  20.660  -5.165
   31   HG23  ILE   5          HG23      ILE   5  59.543  20.281  -4.210
   32   HD11  ILE   5           HD1      ILE   5  59.819  20.435  -6.761
   33   HD12  ILE   5           HD2      ILE   5  58.382  19.593  -7.392
   34   HD13  ILE   5           HD3      ILE   5  59.996  19.198  -8.026
   35    H    PHE   6           HN       PHE   6  56.355  17.234  -4.589
   36    HA   PHE   6           HA       PHE   6  55.199  17.770  -1.896
   37    HB2  PHE   6           HB2      PHE   6  53.970  17.323  -4.645
   38    HB3  PHE   6           HB1      PHE   6  53.025  17.586  -3.160
   39    HD1  PHE   6           HD1      PHE   6  55.287  19.127  -5.644
   40    HD2  PHE   6           HD2      PHE   6  53.073  19.757  -1.993
   41    HE1  PHE   6           HE1      PHE   6  55.597  21.587  -5.882
   42    HE2  PHE   6           HE2      PHE   6  53.382  22.219  -2.232
   43    HZ   PHE   6           HZ       PHE   6  54.641  23.134  -4.177
   44    H    LYS   7           HN       LYS   7  55.618  15.173  -4.276
   45    HA   LYS   7           HA       LYS   7  53.863  13.243  -3.212
   46    HB2  LYS   7           HB2      LYS   7  56.658  12.701  -4.290
   47    HB3  LYS   7           HB1      LYS   7  55.270  11.586  -4.283
   48    HG2  LYS   7           HG2      LYS   7  54.020  13.278  -5.704
   49    HG3  LYS   7           HG1      LYS   7  55.545  14.184  -5.849
   50    HD2  LYS   7           HD2      LYS   7  56.630  12.101  -6.758
   51    HD3  LYS   7           HD1      LYS   7  55.032  11.314  -6.745
   52    HE2  LYS   7           HE2      LYS   7  55.848  13.789  -8.326
   53    HE3  LYS   7           HE1      LYS   7  55.419  12.190  -8.979
   54    HZ1  LYS   7           HZ1      LYS   7  53.696  14.289  -7.886
   55    HZ2  LYS   7           HZ2      LYS   7  53.248  12.680  -7.571
   56    HZ3  LYS   7           HZ3      LYS   7  53.423  13.218  -9.173
   57    H    HIS   8           HN       HIS   8  57.044  14.312  -2.088
   58    HA   HIS   8           HA       HIS   8  57.335  12.149  -0.152
   59    HB2  HIS   8           HB2      HIS   8  59.259  13.411  -1.117
   60    HB3  HIS   8           HB1      HIS   8  58.704  14.866  -0.253
   61    HD1  HIS   8           HD1      HIS   8  59.952  15.214   1.867
   62    HD2  HIS   8           HD2      HIS   8  59.343  11.131   1.062
   63    HE1  HIS   8           HE1      HIS   8  61.033  13.893   3.768
   64    H    GLY   9           HN       GLY   9  54.881  14.057  -0.216
   65    HA2  GLY   9           HA1      GLY   9  54.406  14.013   2.600
   66    HA3  GLY   9           HA2      GLY   9  54.907  15.650   2.131
   67    H    ARG  10           HN       ARG  10  53.213  13.601  -0.145
   68    HA   ARG  10           HA       ARG  10  50.559  14.614   0.559
   69    HB2  ARG  10           HB2      ARG  10  51.859  16.529  -0.677
   70    HB3  ARG  10           HB1      ARG  10  51.623  15.539  -2.133
   71    HG2  ARG  10           HG2      ARG  10  49.183  15.584  -1.803
   72    HG3  ARG  10           HG1      ARG  10  49.383  16.477  -0.277
   73    HD2  ARG  10           HD2      ARG  10  50.302  18.393  -1.436
   74    HD3  ARG  10           HD1      ARG  10  50.374  17.495  -2.971
   75    HE   ARG  10           HE       ARG  10  48.045  18.842  -1.929
   76   HH11  ARG  10          HH11      ARG  10  48.216  18.421  -4.783
   77   HH12  ARG  10          HH12      ARG  10  47.127  17.108  -5.083
   78   HH21  ARG  10          HH21      ARG  10  47.017  16.092  -1.769
   79   HH22  ARG  10          HH22      ARG  10  46.449  15.789  -3.377
   80    H    HIS  11           HN       HIS  11  52.234  12.142  -0.137
   81    HA   HIS  11           HA       HIS  11  50.107  10.778  -1.561
   82    HB2  HIS  11           HB2      HIS  11  51.348  11.921  -3.460
   83    HB3  HIS  11           HB1      HIS  11  52.777  10.962  -3.007
   84    HD1  HIS  11           HD1      HIS  11  49.247  10.628  -4.382
   85    HD2  HIS  11           HD2      HIS  11  52.698   8.288  -3.857
   86    HE1  HIS  11           HE1      HIS  11  48.851   8.409  -5.583
   87    H    ALA  12           HN       ALA  12  50.116   8.720  -1.431
   88    HA   ALA  12           HA       ALA  12  50.585   6.606  -0.671
   89    HB1  ALA  12           HB1      ALA  12  52.891   7.223  -1.532
   90    HB2  ALA  12           HB2      ALA  12  52.806   6.005  -0.233
   91    HB3  ALA  12           HB3      ALA  12  53.162   7.694   0.137
   92    H    ALA  13           HN       ALA  13  51.738   9.457   1.054
   93    HA   ALA  13           HA       ALA  13  51.397   8.259   3.701
   94    HB1  ALA  13           HB1      ALA  13  51.329  11.088   2.535
   95    HB2  ALA  13           HB2      ALA  13  52.431  10.443   3.776
   96    HB3  ALA  13           HB3      ALA  13  50.727  10.771   4.178
   97    H    LYS  14           HN       LYS  14  50.283   8.376   0.714
   98    HA   LYS  14           HA       LYS  14  47.248   8.428   1.471
   99    HB2  LYS  14           HB2      LYS  14  48.397   9.997  -0.283
  100    HB3  LYS  14           HB1      LYS  14  48.636   8.487  -1.233
  101    HG2  LYS  14           HG2      LYS  14  46.404   8.440  -1.880
  102    HG3  LYS  14           HG1      LYS  14  45.808   8.933  -0.282
  103    HD2  LYS  14           HD2      LYS  14  46.342  11.277  -0.762
  104    HD3  LYS  14           HD1      LYS  14  47.077  10.820  -2.316
  105    HE2  LYS  14           HE2      LYS  14  44.185  10.151  -1.646
  106    HE3  LYS  14           HE1      LYS  14  44.651  11.699  -2.390
  107    HZ1  LYS  14           HZ1      LYS  14  44.067   9.576  -3.824
  108    HZ2  LYS  14           HZ2      LYS  14  45.717   9.247  -3.584
  109    HZ3  LYS  14           HZ3      LYS  14  45.235  10.699  -4.323
  110    H    HIS  15           HN       HIS  15  46.223   7.204  -0.626
  111    HA   HIS  15           HA       HIS  15  45.521   5.006  -1.084
  112    HB2  HIS  15           HB2      HIS  15  48.331   5.192  -2.221
  113    HB3  HIS  15           HB1      HIS  15  47.133   3.960  -2.685
  114    HD1  HIS  15           HD1      HIS  15  44.720   6.203  -2.357
  115    HD2  HIS  15           HD2      HIS  15  48.053   6.272  -4.916
  116    HE1  HIS  15           HE1      HIS  15  44.173   7.796  -4.277
  117    H    ILE  16           HN       ILE  16  47.021   5.317   1.525
  118    HA   ILE  16           HA       ILE  16  46.924   2.817   2.422
  119    HB   ILE  16           HB       ILE  16  48.648   1.866   1.084
  120   HG12  ILE  16          HG12      ILE  16  50.375   2.590   3.466
  121   HG13  ILE  16          HG11      ILE  16  48.868   1.702   3.766
  122   HG21  ILE  16          HG21      ILE  16  50.950   2.998   0.962
  123   HG22  ILE  16          HG22      ILE  16  50.215   4.405   1.725
  124   HG23  ILE  16          HG23      ILE  16  49.667   3.892   0.123
  125   HD11  ILE  16           HD1      ILE  16  49.554  -0.145   2.420
  126   HD12  ILE  16           HD2      ILE  16  50.981   0.284   3.391
  127   HD13  ILE  16           HD3      ILE  16  50.886   0.776   1.685
  128    H    GLY  17           HN       GLY  17  48.900   5.477   2.419
  129    HA2  GLY  17           HA1      GLY  17  49.130   5.546   5.342
  130    HA3  GLY  17           HA2      GLY  17  49.597   6.839   4.219
  131    H    HIS  18           HN       HIS  18  46.893   6.106   2.826
  132    HA   HIS  18           HA       HIS  18  45.296   8.093   4.398
  133    HB2  HIS  18           HB2      HIS  18  45.353   7.073   1.605
  134    HB3  HIS  18           HB1      HIS  18  43.706   7.223   2.243
  135    HD1  HIS  18           HD1      HIS  18  43.214   9.249   0.672
  136    HD2  HIS  18           HD2      HIS  18  46.416   9.889   3.319
  137    HE1  HIS  18           HE1      HIS  18  43.703  11.755   0.684
  138    H    ALA  19           HN       ALA  19  45.122   4.624   3.319
  139    HA   ALA  19           HA       ALA  19  43.600   4.000   5.737
  140    HB1  ALA  19           HB1      ALA  19  41.812   5.148   4.523
  141    HB2  ALA  19           HB2      ALA  19  41.464   3.410   4.671
  142    HB3  ALA  19           HB3      ALA  19  42.057   4.072   3.129
  143    H    ALA  20           HN       ALA  20  45.902   2.930   4.163
  144    HA   ALA  20           HA       ALA  20  46.705   0.824   3.567
  145    HB1  ALA  20           HB1      ALA  20  45.863  -1.046   4.755
  146    HB2  ALA  20           HB2      ALA  20  44.249  -0.316   4.919
  147    HB3  ALA  20           HB3      ALA  20  45.625   0.353   5.828
  148    H    VAL  21           HN       VAL  21  43.884   2.084   2.313
  149    HA   VAL  21           HA       VAL  21  43.944   0.139   0.070
  150    HB   VAL  21           HB       VAL  21  41.336   0.767   1.532
  151   HG11  VAL  21          HG11      VAL  21  40.475  -1.022  -0.036
  152   HG12  VAL  21          HG12      VAL  21  42.052  -0.989  -0.857
  153   HG13  VAL  21          HG13      VAL  21  41.016   0.456  -0.861
  154   HG21  VAL  21          HG21      VAL  21  41.388  -1.731   2.020
  155   HG22  VAL  21          HG22      VAL  21  42.602  -0.781   2.904
  156   HG23  VAL  21          HG23      VAL  21  43.082  -1.735   1.479
  157    H    ASN  22           HN       ASN  22  43.061   3.148   1.572
  158    HA   ASN  22           HA       ASN  22  43.460   5.146   0.055
  159    HB2  ASN  22           HB2      ASN  22  42.990   4.115  -2.108
  160    HB3  ASN  22           HB1      ASN  22  41.319   3.739  -1.610
  161   HD21  ASN  22          HD21      ASN  22  40.170   5.082  -3.075
  162   HD22  ASN  22          HD22      ASN  22  40.362   6.838  -3.109
  163    H    HIS  23           HN       HIS  23  40.520   3.368   0.968
  164    HA   HIS  23           HA       HIS  23  39.745   5.547   2.752
  165    HB2  HIS  23           HB2      HIS  23  38.948   6.351   0.482
  166    HB3  HIS  23           HB1      HIS  23  37.873   4.934   0.434
  167    HD1  HIS  23           HD1      HIS  23  37.087   4.908   3.488
  168    HD2  HIS  23           HD2      HIS  23  36.972   8.287   0.985
  169    HE1  HIS  23           HE1      HIS  23  35.451   6.572   4.529
  170    H    TYR  24           HN       TYR  24  39.662   4.082   4.386
  171    HA   TYR  24           HA       TYR  24  37.248   2.454   4.541
  172    HB2  TYR  24           HB2      TYR  24  38.666   0.920   3.221
  173    HB3  TYR  24           HB1      TYR  24  39.946   1.041   4.452
  174    HD1  TYR  24           HD1      TYR  24  39.765  -0.115   6.580
  175    HD2  TYR  24           HD2      TYR  24  36.492  -0.171   3.766
  176    HE1  TYR  24           HE1      TYR  24  38.661  -1.915   7.899
  177    HE2  TYR  24           HE2      TYR  24  35.388  -1.972   5.087
  178    HH   TYR  24           HH       TYR  24  36.898  -3.747   7.481
  179    H    LEU  25           HN       LEU  25  39.831   4.188   5.756
  180    HA   LEU  25           HA       LEU  25  40.285   3.091   8.321
  181    HB2  LEU  25           HB2      LEU  25  41.658   4.892   7.505
  182    HB3  LEU  25           HB1      LEU  25  40.253   5.962   7.312
  183    HG   LEU  25           HG       LEU  25  39.958   6.138   9.710
  184   HD11  LEU  25          HD11      LEU  25  40.397   3.933  10.518
  185   HD12  LEU  25          HD12      LEU  25  41.690   4.934  11.218
  186   HD13  LEU  25          HD13      LEU  25  42.027   3.905   9.803
  187   HD21  LEU  25          HD21      LEU  25  42.121   7.139  10.365
  188   HD22  LEU  25          HD22      LEU  25  41.722   7.555   8.681
  189   HD23  LEU  25          HD23      LEU  25  42.929   6.293   9.024
  Start of MODEL   95
    1    H1   GLY   1           HT1      GLY   1  62.462  20.485  -8.168
    2    H2   GLY   1           HT2      GLY   1  62.102  18.933  -7.578
    3    H3   GLY   1           HT3      GLY   1  63.338  19.145  -8.725
    4    HA2  GLY   1           HA1      GLY   1  64.832  19.650  -7.236
    5    HA3  GLY   1           HA2      GLY   1  63.707  20.748  -6.414
    6    H    TRP   2           HN       TRP   2  65.276  19.461  -4.758
    7    HA   TRP   2           HA       TRP   2  65.359  17.926  -3.014
    8    HB2  TRP   2           HB2      TRP   2  62.343  18.174  -3.339
    9    HB3  TRP   2           HB1      TRP   2  63.155  17.430  -1.941
   10    HD1  TRP   2           HD1      TRP   2  61.892  20.664  -3.131
   11    HE1  TRP   2           HE1      TRP   2  62.782  22.638  -1.693
   12    HE3  TRP   2           HE3      TRP   2  65.614  18.213  -0.609
   13    HZ2  TRP   2           HZ2      TRP   2  64.835  23.063   0.280
   14    HZ3  TRP   2           HZ3      TRP   2  67.026  19.424   1.046
   15    HH2  TRP   2           HH2      TRP   2  66.640  21.844   1.492
   16    H    GLY   3           HN       GLY   3  64.098  15.740  -2.205
   17    HA2  GLY   3           HA1      GLY   3  64.900  13.760  -4.104
   18    HA3  GLY   3           HA2      GLY   3  63.942  13.473  -2.638
   19    H    SER   4           HN       SER   4  62.056  15.649  -3.890
   20    HA   SER   4           HA       SER   4  60.910  14.290  -6.199
   21    HB2  SER   4           HB2      SER   4  59.304  14.171  -3.622
   22    HB3  SER   4           HB1      SER   4  58.867  13.493  -5.206
   23    HG   SER   4           HG       SER   4  60.241  12.348  -3.258
   24    H    ILE   5           HN       ILE   5  58.792  15.305  -6.834
   25    HA   ILE   5           HA       ILE   5  59.073  18.190  -6.600
   26    HB   ILE   5           HB       ILE   5  56.639  16.728  -7.708
   27   HG12  ILE   5          HG12      ILE   5  59.322  17.271  -9.065
   28   HG13  ILE   5          HG11      ILE   5  58.663  15.671  -8.653
   29   HG21  ILE   5          HG21      ILE   5  56.341  18.692  -9.024
   30   HG22  ILE   5          HG22      ILE   5  57.995  19.266  -8.704
   31   HG23  ILE   5          HG23      ILE   5  56.773  19.304  -7.411
   32   HD11  ILE   5           HD1      ILE   5  57.640  17.659 -10.711
   33   HD12  ILE   5           HD2      ILE   5  56.617  16.336 -10.099
   34   HD13  ILE   5           HD3      ILE   5  58.131  15.967 -10.956
   35    H    PHE   6           HN       PHE   6  56.497  15.872  -5.621
   36    HA   PHE   6           HA       PHE   6  56.011  17.394  -3.162
   37    HB2  PHE   6           HB2      PHE   6  53.693  17.999  -3.655
   38    HB3  PHE   6           HB1      PHE   6  54.778  18.763  -4.839
   39    HD1  PHE   6           HD1      PHE   6  54.734  18.127  -7.180
   40    HD2  PHE   6           HD2      PHE   6  52.348  15.991  -4.286
   41    HE1  PHE   6           HE1      PHE   6  53.499  17.004  -9.028
   42    HE2  PHE   6           HE2      PHE   6  51.111  14.870  -6.136
   43    HZ   PHE   6           HZ       PHE   6  51.704  15.357  -8.506
   44    H    LYS   7           HN       LYS   7  56.225  14.610  -4.844
   45    HA   LYS   7           HA       LYS   7  53.965  13.082  -3.986
   46    HB2  LYS   7           HB2      LYS   7  56.821  12.379  -4.738
   47    HB3  LYS   7           HB1      LYS   7  55.683  11.123  -4.199
   48    HG2  LYS   7           HG2      LYS   7  55.682  11.311  -6.664
   49    HG3  LYS   7           HG1      LYS   7  54.102  11.779  -5.992
   50    HD2  LYS   7           HD2      LYS   7  54.520  14.105  -6.326
   51    HD3  LYS   7           HD1      LYS   7  56.264  13.841  -6.575
   52    HE2  LYS   7           HE2      LYS   7  55.833  12.697  -8.692
   53    HE3  LYS   7           HE1      LYS   7  54.076  12.786  -8.421
   54    HZ1  LYS   7           HZ1      LYS   7  54.059  14.812  -9.285
   55    HZ2  LYS   7           HZ2      LYS   7  55.717  14.681  -9.635
   56    HZ3  LYS   7           HZ3      LYS   7  55.207  15.360  -8.163
   57    H    HIS   8           HN       HIS   8  57.289  13.159  -2.588
   58    HA   HIS   8           HA       HIS   8  56.430  11.772  -0.188
   59    HB2  HIS   8           HB2      HIS   8  58.772  11.756  -1.096
   60    HB3  HIS   8           HB1      HIS   8  58.926  13.461  -0.610
   61    HD1  HIS   8           HD1      HIS   8  58.122  10.035   0.929
   62    HD2  HIS   8           HD2      HIS   8  59.582  13.812   2.070
   63    HE1  HIS   8           HE1      HIS   8  58.869   9.859   3.367
   64    H    GLY   9           HN       GLY   9  54.529  13.223   0.176
   65    HA2  GLY   9           HA1      GLY   9  54.776  14.743   2.466
   66    HA3  GLY   9           HA2      GLY   9  55.059  15.919   1.166
   67    H    ARG  10           HN       ARG  10  53.272  14.254  -0.632
   68    HA   ARG  10           HA       ARG  10  50.599  14.797   0.616
   69    HB2  ARG  10           HB2      ARG  10  51.597  15.913  -2.036
   70    HB3  ARG  10           HB1      ARG  10  49.889  15.885  -1.542
   71    HG2  ARG  10           HG2      ARG  10  50.418  17.247   0.444
   72    HG3  ARG  10           HG1      ARG  10  52.142  17.243   0.001
   73    HD2  ARG  10           HD2      ARG  10  50.871  19.330  -0.700
   74    HD3  ARG  10           HD1      ARG  10  51.714  18.484  -2.022
   75    HE   ARG  10           HE       ARG  10  48.865  17.761  -1.595
   76   HH11  ARG  10          HH11      ARG  10  50.780  17.590  -4.084
   77   HH12  ARG  10          HH12      ARG  10  49.989  18.723  -5.128
   78   HH21  ARG  10          HH21      ARG  10  48.031  20.082  -2.609
   79   HH22  ARG  10          HH22      ARG  10  48.432  20.133  -4.293
   80    H    HIS  11           HN       HIS  11  52.443  12.491  -0.350
   81    HA   HIS  11           HA       HIS  11  50.231  10.950  -1.548
   82    HB2  HIS  11           HB2      HIS  11  51.426  12.034  -3.516
   83    HB3  HIS  11           HB1      HIS  11  52.886  11.140  -3.028
   84    HD1  HIS  11           HD1      HIS  11  49.187  10.378  -3.791
   85    HD2  HIS  11           HD2      HIS  11  53.007   8.691  -4.277
   86    HE1  HIS  11           HE1      HIS  11  48.890   8.159  -5.024
   87    H    ALA  12           HN       ALA  12  50.315   8.917  -1.361
   88    HA   ALA  12           HA       ALA  12  50.829   6.858  -0.522
   89    HB1  ALA  12           HB1      ALA  12  53.357   8.031   0.320
   90    HB2  ALA  12           HB2      ALA  12  53.137   7.481  -1.344
   91    HB3  ALA  12           HB3      ALA  12  53.047   6.335   0.016
   92    H    ALA  13           HN       ALA  13  51.809   9.819   1.092
   93    HA   ALA  13           HA       ALA  13  51.415   8.743   3.787
   94    HB1  ALA  13           HB1      ALA  13  50.747  11.206   4.213
   95    HB2  ALA  13           HB2      ALA  13  51.165  11.529   2.513
   96    HB3  ALA  13           HB3      ALA  13  52.421  10.989   3.652
   97    H    LYS  14           HN       LYS  14  50.421   8.602   0.781
   98    HA   LYS  14           HA       LYS  14  47.363   8.564   1.440
   99    HB2  LYS  14           HB2      LYS  14  48.483  10.170  -0.306
  100    HB3  LYS  14           HB1      LYS  14  48.844   8.656  -1.215
  101    HG2  LYS  14           HG2      LYS  14  46.643   8.463  -1.935
  102    HG3  LYS  14           HG1      LYS  14  45.959   8.976  -0.378
  103    HD2  LYS  14           HD2      LYS  14  46.378  11.323  -0.921
  104    HD3  LYS  14           HD1      LYS  14  47.216  10.860  -2.421
  105    HE2  LYS  14           HE2      LYS  14  44.939  11.509  -2.988
  106    HE3  LYS  14           HE1      LYS  14  45.084   9.746  -3.188
  107    HZ1  LYS  14           HZ1      LYS  14  43.486   9.470  -1.698
  108    HZ2  LYS  14           HZ2      LYS  14  43.307  11.154  -1.557
  109    HZ3  LYS  14           HZ3      LYS  14  44.369  10.320  -0.526
  110    H    HIS  15           HN       HIS  15  46.481   7.252  -0.688
  111    HA   HIS  15           HA       HIS  15  45.915   5.001  -1.101
  112    HB2  HIS  15           HB2      HIS  15  48.707   5.444  -2.201
  113    HB3  HIS  15           HB1      HIS  15  47.750   3.993  -2.575
  114    HD1  HIS  15           HD1      HIS  15  48.375   5.600  -4.976
  115    HD2  HIS  15           HD2      HIS  15  45.164   6.701  -2.504
  116    HE1  HIS  15           HE1      HIS  15  46.732   6.933  -6.404
  117    H    ILE  16           HN       ILE  16  47.175   5.430   1.560
  118    HA   ILE  16           HA       ILE  16  47.225   2.980   2.555
  119    HB   ILE  16           HB       ILE  16  49.067   2.122   1.232
  120   HG12  ILE  16          HG12      ILE  16  50.278   2.913   3.915
  121   HG13  ILE  16          HG11      ILE  16  49.092   1.607   3.712
  122   HG21  ILE  16          HG21      ILE  16  51.336   3.363   1.367
  123   HG22  ILE  16          HG22      ILE  16  50.428   4.724   2.036
  124   HG23  ILE  16          HG23      ILE  16  50.094   4.168   0.384
  125   HD11  ILE  16           HD1      ILE  16  51.987   1.707   2.868
  126   HD12  ILE  16           HD2      ILE  16  50.864   0.790   1.836
  127   HD13  ILE  16           HD3      ILE  16  51.052   0.358   3.549
  128    H    GLY  17           HN       GLY  17  48.745   5.918   2.459
  129    HA2  GLY  17           HA1      GLY  17  48.973   6.018   5.415
  130    HA3  GLY  17           HA2      GLY  17  49.366   7.324   4.284
  131    H    HIS  18           HN       HIS  18  46.827   6.263   2.779
  132    HA   HIS  18           HA       HIS  18  44.938   8.119   4.204
  133    HB2  HIS  18           HB2      HIS  18  45.180   8.177   1.698
  134    HB3  HIS  18           HB1      HIS  18  44.487   6.545   1.638
  135    HD1  HIS  18           HD1      HIS  18  43.579  10.070   1.598
  136    HD2  HIS  18           HD2      HIS  18  41.793   6.579   3.102
  137    HE1  HIS  18           HE1      HIS  18  41.091  10.556   1.901
  138    H    ALA  19           HN       ALA  19  45.254   4.627   3.284
  139    HA   ALA  19           HA       ALA  19  43.173   4.078   5.409
  140    HB1  ALA  19           HB1      ALA  19  41.877   4.232   3.368
  141    HB2  ALA  19           HB2      ALA  19  41.964   2.538   3.899
  142    HB3  ALA  19           HB3      ALA  19  42.972   3.098   2.547
  143    H    ALA  20           HN       ALA  20  46.158   3.572   4.965
  144    HA   ALA  20           HA       ALA  20  47.617   1.843   5.502
  145    HB1  ALA  20           HB1      ALA  20  45.220   0.275   6.474
  146    HB2  ALA  20           HB2      ALA  20  45.889   1.651   7.379
  147    HB3  ALA  20           HB3      ALA  20  46.898   0.221   7.061
  148    H    VAL  21           HN       VAL  21  45.251   1.562   3.163
  149    HA   VAL  21           HA       VAL  21  46.659  -0.754   1.947
  150    HB   VAL  21           HB       VAL  21  43.629  -0.778   2.334
  151   HG11  VAL  21          HG11      VAL  21  45.614  -2.686   1.021
  152   HG12  VAL  21          HG12      VAL  21  44.271  -1.819   0.238
  153   HG13  VAL  21          HG13      VAL  21  43.930  -3.123   1.397
  154   HG21  VAL  21          HG21      VAL  21  45.872  -2.360   3.667
  155   HG22  VAL  21          HG22      VAL  21  44.164  -2.851   3.718
  156   HG23  VAL  21          HG23      VAL  21  44.667  -1.317   4.459
  157    H    ASN  22           HN       ASN  22  44.431   1.987   1.781
  158    HA   ASN  22           HA       ASN  22  45.260   2.761  -0.810
  159    HB2  ASN  22           HB2      ASN  22  42.968   2.118  -1.990
  160    HB3  ASN  22           HB1      ASN  22  44.296   0.940  -1.930
  161   HD21  ASN  22          HD21      ASN  22  42.731   1.618   1.137
  162   HD22  ASN  22          HD22      ASN  22  41.781   0.131   1.199
  163    H    HIS  23           HN       HIS  23  41.817   2.454   0.040
  164    HA   HIS  23           HA       HIS  23  41.744   5.168   1.202
  165    HB2  HIS  23           HB2      HIS  23  40.174   6.047  -0.481
  166    HB3  HIS  23           HB1      HIS  23  41.741   5.645  -1.220
  167    HD1  HIS  23           HD1      HIS  23  39.681   5.683  -3.277
  168    HD2  HIS  23           HD2      HIS  23  40.239   2.286  -0.864
  169    HE1  HIS  23           HE1      HIS  23  38.624   3.700  -4.494
  170    H    TYR  24           HN       TYR  24  39.137   5.759   1.121
  171    HA   TYR  24           HA       TYR  24  37.139   5.252   2.177
  172    HB2  TYR  24           HB2      TYR  24  37.001   3.737   0.142
  173    HB3  TYR  24           HB1      TYR  24  37.585   2.413   1.179
  174    HD1  TYR  24           HD1      TYR  24  36.082   1.257   2.637
  175    HD2  TYR  24           HD2      TYR  24  34.882   4.996   0.843
  176    HE1  TYR  24           HE1      TYR  24  33.762   0.919   3.483
  177    HE2  TYR  24           HE2      TYR  24  32.563   4.658   1.691
  178    HH   TYR  24           HH       TYR  24  31.160   3.244   2.691
  179    H    LEU  25           HN       LEU  25  39.871   4.675   3.469
  180    HA   LEU  25           HA       LEU  25  40.653   3.760   5.459
  181    HB2  LEU  25           HB2      LEU  25  37.755   3.752   6.366
  182    HB3  LEU  25           HB1      LEU  25  39.221   4.013   7.341
  183    HG   LEU  25           HG       LEU  25  38.135   5.875   5.180
  184   HD11  LEU  25          HD11      LEU  25  36.869   5.885   7.320
  185   HD12  LEU  25          HD12      LEU  25  37.754   7.410   7.076
  186   HD13  LEU  25          HD13      LEU  25  38.382   6.187   8.206
  187   HD21  LEU  25          HD21      LEU  25  40.517   6.081   5.103
  188   HD22  LEU  25          HD22      LEU  25  40.672   5.914   6.869
  189   HD23  LEU  25          HD23      LEU  25  39.985   7.400   6.171
  Start of MODEL   96
    1    H1   GLY   1           HT1      GLY   1  66.997   9.995  -0.066
    2    H2   GLY   1           HT2      GLY   1  65.590  10.932  -0.239
    3    H3   GLY   1           HT3      GLY   1  66.663  11.232   1.044
    4    HA2  GLY   1           HA1      GLY   1  68.383  11.797  -0.573
    5    HA3  GLY   1           HA2      GLY   1  67.142  11.644  -1.832
    6    H    TRP   2           HN       TRP   2  66.466  13.553  -2.507
    7    HA   TRP   2           HA       TRP   2  66.811  15.965  -0.972
    8    HB2  TRP   2           HB2      TRP   2  65.032  15.401  -3.378
    9    HB3  TRP   2           HB1      TRP   2  65.450  17.015  -2.757
   10    HD1  TRP   2           HD1      TRP   2  66.841  14.093  -4.730
   11    HE1  TRP   2           HE1      TRP   2  69.160  14.714  -5.731
   12    HE3  TRP   2           HE3      TRP   2  67.610  18.530  -2.295
   13    HZ2  TRP   2           HZ2      TRP   2  71.066  16.859  -5.485
   14    HZ3  TRP   2           HZ3      TRP   2  69.685  19.847  -2.693
   15    HH2  TRP   2           HH2      TRP   2  71.412  19.016  -4.284
   16    H    GLY   3           HN       GLY   3  64.371  13.508  -1.026
   17    HA2  GLY   3           HA1      GLY   3  62.503  13.277   0.336
   18    HA3  GLY   3           HA2      GLY   3  62.948  14.787   1.157
   19    H    SER   4           HN       SER   4  62.740  14.924  -2.278
   20    HA   SER   4           HA       SER   4  61.261  16.029  -3.675
   21    HB2  SER   4           HB2      SER   4  59.087  15.196  -1.725
   22    HB3  SER   4           HB1      SER   4  58.924  15.532  -3.462
   23    HG   SER   4           HG       SER   4  60.736  13.566  -2.577
   24    H    ILE   5           HN       ILE   5  58.702  17.243  -2.822
   25    HA   ILE   5           HA       ILE   5  59.582  19.411  -0.969
   26    HB   ILE   5           HB       ILE   5  58.401  20.094  -3.698
   27   HG12  ILE   5          HG12      ILE   5  61.324  20.006  -2.819
   28   HG13  ILE   5          HG11      ILE   5  60.570  19.043  -4.110
   29   HG21  ILE   5          HG21      ILE   5  58.231  21.669  -1.669
   30   HG22  ILE   5          HG22      ILE   5  58.995  22.346  -3.124
   31   HG23  ILE   5          HG23      ILE   5  60.002  21.812  -1.755
   32   HD11  ILE   5           HD1      ILE   5  59.939  21.334  -5.179
   33   HD12  ILE   5           HD2      ILE   5  61.639  20.817  -5.269
   34   HD13  ILE   5           HD3      ILE   5  61.141  22.025  -4.062
   35    H    PHE   6           HN       PHE   6  57.165  17.578  -2.708
   36    HA   PHE   6           HA       PHE   6  55.156  18.317  -0.662
   37    HB2  PHE   6           HB2      PHE   6  53.456  18.998  -2.275
   38    HB3  PHE   6           HB1      PHE   6  54.878  20.056  -2.436
   39    HD1  PHE   6           HD1      PHE   6  56.159  20.115  -4.475
   40    HD2  PHE   6           HD2      PHE   6  53.113  17.109  -3.914
   41    HE1  PHE   6           HE1      PHE   6  56.352  19.472  -6.875
   42    HE2  PHE   6           HE2      PHE   6  53.305  16.467  -6.313
   43    HZ   PHE   6           HZ       PHE   6  54.965  17.609  -7.780
   44    H    LYS   7           HN       LYS   7  56.454  16.328  -3.184
   45    HA   LYS   7           HA       LYS   7  54.314  14.505  -3.590
   46    HB2  LYS   7           HB2      LYS   7  56.544  14.622  -4.828
   47    HB3  LYS   7           HB1      LYS   7  57.258  13.752  -3.448
   48    HG2  LYS   7           HG2      LYS   7  55.466  11.972  -3.777
   49    HG3  LYS   7           HG1      LYS   7  55.032  12.794  -5.295
   50    HD2  LYS   7           HD2      LYS   7  57.450  12.571  -6.014
   51    HD3  LYS   7           HD1      LYS   7  57.724  11.562  -4.573
   52    HE2  LYS   7           HE2      LYS   7  55.768  10.997  -6.842
   53    HE3  LYS   7           HE1      LYS   7  57.268  10.108  -6.486
   54    HZ1  LYS   7           HZ1      LYS   7  54.674   9.906  -5.253
   55    HZ2  LYS   7           HZ2      LYS   7  55.933  10.064  -4.122
   56    HZ3  LYS   7           HZ3      LYS   7  55.961   8.802  -5.259
   57    H    HIS   8           HN       HIS   8  57.070  14.292  -1.289
   58    HA   HIS   8           HA       HIS   8  55.836  12.019   0.101
   59    HB2  HIS   8           HB2      HIS   8  58.242  13.762   0.771
   60    HB3  HIS   8           HB1      HIS   8  57.766  12.295   1.658
   61    HD1  HIS   8           HD1      HIS   8  60.257  13.120  -0.572
   62    HD2  HIS   8           HD2      HIS   8  57.183  10.262  -0.835
   63    HE1  HIS   8           HE1      HIS   8  61.009  11.344  -2.248
   64    H    GLY   9           HN       GLY   9  53.974  14.028   0.052
   65    HA2  GLY   9           HA1      GLY   9  53.542  14.435   2.909
   66    HA3  GLY   9           HA2      GLY   9  53.897  15.944   2.043
   67    H    ARG  10           HN       ARG  10  52.623  14.494  -0.400
   68    HA   ARG  10           HA       ARG  10  49.741  14.877   0.412
   69    HB2  ARG  10           HB2      ARG  10  51.148  15.897  -2.092
   70    HB3  ARG  10           HB1      ARG  10  49.386  15.919  -1.833
   71    HG2  ARG  10           HG2      ARG  10  49.714  17.301   0.209
   72    HG3  ARG  10           HG1      ARG  10  51.469  17.308  -0.090
   73    HD2  ARG  10           HD2      ARG  10  50.471  19.375  -0.966
   74    HD3  ARG  10           HD1      ARG  10  51.058  18.371  -2.313
   75    HE   ARG  10           HE       ARG  10  48.361  17.659  -1.935
   76   HH11  ARG  10          HH11      ARG  10  49.173  20.823  -1.531
   77   HH12  ARG  10          HH12      ARG  10  48.397  21.421  -2.959
   78   HH21  ARG  10          HH21      ARG  10  47.798  18.270  -4.276
   79   HH22  ARG  10          HH22      ARG  10  47.619  19.977  -4.513
   80    H    HIS  11           HN       HIS  11  51.830  12.616  -0.251
   81    HA   HIS  11           HA       HIS  11  49.842  10.912  -1.561
   82    HB2  HIS  11           HB2      HIS  11  50.952  12.028  -3.523
   83    HB3  HIS  11           HB1      HIS  11  52.507  11.370  -2.961
   84    HD1  HIS  11           HD1      HIS  11  52.786   8.733  -2.961
   85    HD2  HIS  11           HD2      HIS  11  49.340  10.184  -4.885
   86    HE1  HIS  11           HE1      HIS  11  51.807   6.807  -4.324
   87    H    ALA  12           HN       ALA  12  50.109   8.876  -1.356
   88    HA   ALA  12           HA       ALA  12  50.783   6.879  -0.473
   89    HB1  ALA  12           HB1      ALA  12  53.041   7.722  -1.259
   90    HB2  ALA  12           HB2      ALA  12  53.033   6.565   0.097
   91    HB3  ALA  12           HB3      ALA  12  53.172   8.300   0.394
   92    H    ALA  13           HN       ALA  13  51.500   9.914   1.176
   93    HA   ALA  13           HA       ALA  13  51.162   8.774   3.855
   94    HB1  ALA  13           HB1      ALA  13  50.412  11.126   4.399
   95    HB2  ALA  13           HB2      ALA  13  50.537  11.548   2.674
   96    HB3  ALA  13           HB3      ALA  13  52.000  11.136   3.599
   97    H    LYS  14           HN       LYS  14  50.207   8.643   0.822
   98    HA   LYS  14           HA       LYS  14  47.154   8.351   1.433
   99    HB2  LYS  14           HB2      LYS  14  48.177  10.004  -0.317
  100    HB3  LYS  14           HB1      LYS  14  48.668   8.508  -1.197
  101    HG2  LYS  14           HG2      LYS  14  46.497   8.133  -1.945
  102    HG3  LYS  14           HG1      LYS  14  45.755   8.615  -0.403
  103    HD2  LYS  14           HD2      LYS  14  45.926  10.962  -0.972
  104    HD3  LYS  14           HD1      LYS  14  46.921  10.598  -2.403
  105    HE2  LYS  14           HE2      LYS  14  45.037   9.389  -3.433
  106    HE3  LYS  14           HE1      LYS  14  44.040   9.683  -1.989
  107    HZ1  LYS  14           HZ1      LYS  14  43.418  11.397  -3.368
  108    HZ2  LYS  14           HZ2      LYS  14  44.966  11.590  -4.040
  109    HZ3  LYS  14           HZ3      LYS  14  44.645  12.147  -2.467
  110    H    HIS  15           HN       HIS  15  46.410   6.939  -0.678
  111    HA   HIS  15           HA       HIS  15  46.027   4.666  -1.114
  112    HB2  HIS  15           HB2      HIS  15  48.879   5.160  -2.042
  113    HB3  HIS  15           HB1      HIS  15  47.881   3.774  -2.541
  114    HD1  HIS  15           HD1      HIS  15  45.181   5.654  -2.532
  115    HD2  HIS  15           HD2      HIS  15  48.712   6.173  -4.753
  116    HE1  HIS  15           HE1      HIS  15  44.607   7.118  -4.545
  117    H    ILE  16           HN       ILE  16  47.349   5.269   1.571
  118    HA   ILE  16           HA       ILE  16  47.445   2.791   2.581
  119    HB   ILE  16           HB       ILE  16  49.347   2.033   1.377
  120   HG12  ILE  16          HG12      ILE  16  50.534   3.053   3.990
  121   HG13  ILE  16          HG11      ILE  16  49.378   1.706   3.925
  122   HG21  ILE  16          HG21      ILE  16  50.547   4.745   2.073
  123   HG22  ILE  16          HG22      ILE  16  50.193   4.142   0.445
  124   HG23  ILE  16          HG23      ILE  16  51.505   3.425   1.398
  125   HD11  ILE  16           HD1      ILE  16  51.087   0.720   2.125
  126   HD12  ILE  16           HD2      ILE  16  51.425   0.557   3.861
  127   HD13  ILE  16           HD3      ILE  16  52.234   1.825   2.918
  128    H    GLY  17           HN       GLY  17  49.009   5.712   2.585
  129    HA2  GLY  17           HA1      GLY  17  49.050   5.890   5.521
  130    HA3  GLY  17           HA2      GLY  17  49.414   7.202   4.383
  131    H    HIS  18           HN       HIS  18  46.936   6.054   2.857
  132    HA   HIS  18           HA       HIS  18  44.948   7.800   4.302
  133    HB2  HIS  18           HB2      HIS  18  45.352   6.849   1.490
  134    HB3  HIS  18           HB1      HIS  18  43.658   6.921   2.013
  135    HD1  HIS  18           HD1      HIS  18  43.288   8.932   0.343
  136    HD2  HIS  18           HD2      HIS  18  46.058   9.693   3.414
  137    HE1  HIS  18           HE1      HIS  18  43.648  11.460   0.436
  138    H    ALA  19           HN       ALA  19  45.252   4.452   2.932
  139    HA   ALA  19           HA       ALA  19  44.050   3.130   5.104
  140    HB1  ALA  19           HB1      ALA  19  41.952   4.179   4.968
  141    HB2  ALA  19           HB2      ALA  19  41.689   2.745   3.956
  142    HB3  ALA  19           HB3      ALA  19  42.026   4.320   3.194
  143    H    ALA  20           HN       ALA  20  45.659   3.155   2.369
  144    HA   ALA  20           HA       ALA  20  46.307   1.526   0.845
  145    HB1  ALA  20           HB1      ALA  20  44.932  -0.493   2.643
  146    HB2  ALA  20           HB2      ALA  20  46.506   0.234   3.044
  147    HB3  ALA  20           HB3      ALA  20  46.327  -0.742   1.567
  148    H    VAL  21           HN       VAL  21  43.380   2.613   1.249
  149    HA   VAL  21           HA       VAL  21  42.272   1.178  -1.115
  150    HB   VAL  21           HB       VAL  21  40.742   1.558   1.502
  151   HG11  VAL  21          HG11      VAL  21  39.033   0.105   0.145
  152   HG12  VAL  21          HG12      VAL  21  39.952   0.628  -1.285
  153   HG13  VAL  21          HG13      VAL  21  39.157   1.832  -0.244
  154   HG21  VAL  21          HG21      VAL  21  41.806  -0.930   0.087
  155   HG22  VAL  21          HG22      VAL  21  40.649  -0.977   1.439
  156   HG23  VAL  21          HG23      VAL  21  42.282  -0.322   1.690
  157    H    ASN  22           HN       ASN  22  42.987   3.851   0.730
  158    HA   ASN  22           HA       ASN  22  42.882   6.094  -0.063
  159    HB2  ASN  22           HB2      ASN  22  40.189   5.515  -1.339
  160    HB3  ASN  22           HB1      ASN  22  41.225   6.940  -1.553
  161   HD21  ASN  22          HD21      ASN  22  40.274   5.033  -3.675
  162   HD22  ASN  22          HD22      ASN  22  41.750   4.389  -4.404
  163    H    HIS  23           HN       HIS  23  40.101   4.281   1.120
  164    HA   HIS  23           HA       HIS  23  39.864   6.105   3.408
  165    HB2  HIS  23           HB2      HIS  23  37.681   5.970   1.290
  166    HB3  HIS  23           HB1      HIS  23  37.410   6.561   2.946
  167    HD1  HIS  23           HD1      HIS  23  39.056   8.618   3.713
  168    HD2  HIS  23           HD2      HIS  23  38.783   7.872  -0.416
  169    HE1  HIS  23           HE1      HIS  23  39.878  10.714   2.504
  170    H    TYR  24           HN       TYR  24  39.877   4.593   4.946
  171    HA   TYR  24           HA       TYR  24  38.885   1.930   4.607
  172    HB2  TYR  24           HB2      TYR  24  40.531   2.671   6.347
  173    HB3  TYR  24           HB1      TYR  24  39.200   3.484   7.205
  174    HD1  TYR  24           HD1      TYR  24  40.415   0.167   5.964
  175    HD2  TYR  24           HD2      TYR  24  37.660   2.238   8.564
  176    HE1  TYR  24           HE1      TYR  24  39.796  -1.997   7.032
  177    HE2  TYR  24           HE2      TYR  24  37.043   0.072   9.632
  178    HH   TYR  24           HH       TYR  24  38.395  -2.316   9.880
  179    H    LEU  25           HN       LEU  25  37.242   4.884   4.953
  180    HA   LEU  25           HA       LEU  25  35.042   5.418   5.440
  181    HB2  LEU  25           HB2      LEU  25  34.590   4.112   3.462
  182    HB3  LEU  25           HB1      LEU  25  34.742   2.588   4.361
  183    HG   LEU  25           HG       LEU  25  32.704   3.027   5.602
  184   HD11  LEU  25          HD11      LEU  25  32.922   5.790   4.344
  185   HD12  LEU  25          HD12      LEU  25  32.774   5.365   6.067
  186   HD13  LEU  25          HD13      LEU  25  31.378   5.174   4.984
  187   HD21  LEU  25          HD21      LEU  25  31.073   3.072   3.779
  188   HD22  LEU  25          HD22      LEU  25  32.506   2.154   3.255
  189   HD23  LEU  25          HD23      LEU  25  32.263   3.824   2.690
  Start of MODEL   97
    1    H1   GLY   1           HT1      GLY   1  65.621   9.252  -2.045
    2    H2   GLY   1           HT2      GLY   1  67.070   9.066  -1.176
    3    H3   GLY   1           HT3      GLY   1  66.889   8.336  -2.699
    4    HA2  GLY   1           HA1      GLY   1  67.036  11.213  -2.095
    5    HA3  GLY   1           HA2      GLY   1  68.257  10.226  -2.924
    6    H    TRP   2           HN       TRP   2  64.888   9.571  -3.510
    7    HA   TRP   2           HA       TRP   2  65.202  10.078  -6.340
    8    HB2  TRP   2           HB2      TRP   2  62.656   9.713  -4.710
    9    HB3  TRP   2           HB1      TRP   2  62.810   9.559  -6.476
   10    HD1  TRP   2           HD1      TRP   2  63.959   7.874  -3.212
   11    HE1  TRP   2           HE1      TRP   2  64.613   5.405  -3.705
   12    HE3  TRP   2           HE3      TRP   2  63.520   7.926  -8.312
   13    HZ2  TRP   2           HZ2      TRP   2  64.898   3.712  -6.018
   14    HZ3  TRP   2           HZ3      TRP   2  63.988   5.873  -9.642
   15    HH2  TRP   2           HH2      TRP   2  64.676   3.769  -8.500
   16    H    GLY   3           HN       GLY   3  63.365  11.414  -7.467
   17    HA2  GLY   3           HA1      GLY   3  63.888  14.169  -6.793
   18    HA3  GLY   3           HA2      GLY   3  62.752  13.578  -8.022
   19    H    SER   4           HN       SER   4  61.472  11.869  -5.824
   20    HA   SER   4           HA       SER   4  59.506  12.113  -4.602
   21    HB2  SER   4           HB2      SER   4  60.993  14.471  -3.388
   22    HB3  SER   4           HB1      SER   4  59.693  13.521  -2.636
   23    HG   SER   4           HG       SER   4  61.823  12.866  -1.995
   24    H    ILE   5           HN       ILE   5  59.244  13.230  -7.112
   25    HA   ILE   5           HA       ILE   5  58.445  15.939  -7.204
   26    HB   ILE   5           HB       ILE   5  58.726  14.640  -9.239
   27   HG12  ILE   5          HG12      ILE   5  55.786  15.431  -8.972
   28   HG13  ILE   5          HG11      ILE   5  57.123  16.582  -9.205
   29   HG21  ILE   5          HG21      ILE   5  57.661  12.504  -8.076
   30   HG22  ILE   5          HG22      ILE   5  57.511  12.726  -9.833
   31   HG23  ILE   5          HG23      ILE   5  56.143  13.116  -8.772
   32   HD11  ILE   5           HD1      ILE   5  56.292  14.336 -11.089
   33   HD12  ILE   5           HD2      ILE   5  57.758  15.324 -11.297
   34   HD13  ILE   5           HD3      ILE   5  56.150  16.086 -11.379
   35    H    PHE   6           HN       PHE   6  57.340  16.552  -5.357
   36    HA   PHE   6           HA       PHE   6  55.500  16.806  -3.961
   37    HB2  PHE   6           HB2      PHE   6  54.107  16.218  -6.601
   38    HB3  PHE   6           HB1      PHE   6  53.287  16.838  -5.148
   39    HD1  PHE   6           HD1      PHE   6  55.399  17.678  -8.005
   40    HD2  PHE   6           HD2      PHE   6  54.020  19.054  -4.154
   41    HE1  PHE   6           HE1      PHE   6  56.108  19.995  -8.581
   42    HE2  PHE   6           HE2      PHE   6  54.727  21.372  -4.731
   43    HZ   PHE   6           HZ       PHE   6  55.781  21.841  -6.939
   44    H    LYS   7           HN       LYS   7  56.549  13.925  -4.742
   45    HA   LYS   7           HA       LYS   7  54.239  12.225  -4.285
   46    HB2  LYS   7           HB2      LYS   7  56.423  11.574  -5.437
   47    HB3  LYS   7           HB1      LYS   7  57.156  11.508  -3.815
   48    HG2  LYS   7           HG2      LYS   7  55.204   9.930  -3.180
   49    HG3  LYS   7           HG1      LYS   7  54.884   9.816  -4.927
   50    HD2  LYS   7           HD2      LYS   7  57.504   9.116  -3.526
   51    HD3  LYS   7           HD1      LYS   7  56.333   7.960  -4.201
   52    HE2  LYS   7           HE2      LYS   7  57.964   8.145  -5.906
   53    HE3  LYS   7           HE1      LYS   7  56.685   9.256  -6.450
   54    HZ1  LYS   7           HZ1      LYS   7  59.312   9.888  -6.079
   55    HZ2  LYS   7           HZ2      LYS   7  58.571  10.502  -4.677
   56    HZ3  LYS   7           HZ3      LYS   7  58.035  10.996  -6.213
   57    H    HIS   8           HN       HIS   8  57.182  12.628  -2.261
   58    HA   HIS   8           HA       HIS   8  55.710  11.767   0.121
   59    HB2  HIS   8           HB2      HIS   8  58.159  11.301  -0.333
   60    HB3  HIS   8           HB1      HIS   8  58.474  13.028  -0.046
   61    HD1  HIS   8           HD1      HIS   8  59.266  13.429   2.277
   62    HD2  HIS   8           HD2      HIS   8  56.380  10.375   2.109
   63    HE1  HIS   8           HE1      HIS   8  58.901  12.593   4.665
   64    H    GLY   9           HN       GLY   9  54.091  13.626  -0.407
   65    HA2  GLY   9           HA1      GLY   9  54.555  15.671   1.615
   66    HA3  GLY   9           HA2      GLY   9  54.603  16.323  -0.035
   67    H    ARG  10           HN       ARG  10  52.663  14.219  -0.948
   68    HA   ARG  10           HA       ARG  10  50.204  14.734   0.551
   69    HB2  ARG  10           HB2      ARG  10  49.057  15.940  -1.312
   70    HB3  ARG  10           HB1      ARG  10  50.363  16.896  -0.570
   71    HG2  ARG  10           HG2      ARG  10  51.900  16.053  -2.406
   72    HG3  ARG  10           HG1      ARG  10  50.469  15.343  -3.189
   73    HD2  ARG  10           HD2      ARG  10  50.806  18.291  -2.478
   74    HD3  ARG  10           HD1      ARG  10  51.000  17.598  -4.106
   75    HE   ARG  10           HE       ARG  10  48.487  18.249  -2.865
   76   HH11  ARG  10          HH11      ARG  10  46.788  16.552  -3.105
   77   HH12  ARG  10          HH12      ARG  10  46.795  15.714  -4.621
   78   HH21  ARG  10          HH21      ARG  10  49.930  16.873  -5.547
   79   HH22  ARG  10          HH22      ARG  10  48.574  15.897  -6.003
   80    H    HIS  11           HN       HIS  11  51.912  12.569  -0.649
   81    HA   HIS  11           HA       HIS  11  49.672  11.007  -1.723
   82    HB2  HIS  11           HB2      HIS  11  52.087  11.666  -3.453
   83    HB3  HIS  11           HB1      HIS  11  50.971  10.318  -3.781
   84    HD1  HIS  11           HD1      HIS  11  48.245  11.506  -3.260
   85    HD2  HIS  11           HD2      HIS  11  51.285  13.575  -5.298
   86    HE1  HIS  11           HE1      HIS  11  47.125  13.344  -4.636
   87    H    ALA  12           HN       ALA  12  49.875   8.943  -1.658
   88    HA   ALA  12           HA       ALA  12  50.582   6.879  -0.969
   89    HB1  ALA  12           HB1      ALA  12  52.758   7.704  -1.985
   90    HB2  ALA  12           HB2      ALA  12  52.872   6.469  -0.705
   91    HB3  ALA  12           HB3      ALA  12  53.107   8.178  -0.331
   92    H    ALA  13           HN       ALA  13  51.620   9.799   0.720
   93    HA   ALA  13           HA       ALA  13  51.586   8.541   3.361
   94    HB1  ALA  13           HB1      ALA  13  50.801  11.382   2.485
   95    HB2  ALA  13           HB2      ALA  13  52.450  10.925   2.974
   96    HB3  ALA  13           HB3      ALA  13  51.116  10.846   4.151
   97    H    LYS  14           HN       LYS  14  50.238   8.600   0.479
   98    HA   LYS  14           HA       LYS  14  47.275   8.374   1.463
   99    HB2  LYS  14           HB2      LYS  14  48.158  10.071  -0.336
  100    HB3  LYS  14           HB1      LYS  14  48.446   8.600  -1.333
  101    HG2  LYS  14           HG2      LYS  14  46.164   8.301  -1.734
  102    HG3  LYS  14           HG1      LYS  14  45.668   8.930  -0.144
  103    HD2  LYS  14           HD2      LYS  14  46.846  10.788  -2.248
  104    HD3  LYS  14           HD1      LYS  14  45.131  10.328  -2.315
  105    HE2  LYS  14           HE2      LYS  14  46.265  11.341   0.304
  106    HE3  LYS  14           HE1      LYS  14  45.866  12.504  -0.984
  107    HZ1  LYS  14           HZ1      LYS  14  44.019  12.004   0.594
  108    HZ2  LYS  14           HZ2      LYS  14  43.978  10.419  -0.018
  109    HZ3  LYS  14           HZ3      LYS  14  43.639  11.736  -1.036
  110    H    HIS  15           HN       HIS  15  46.202   7.112  -0.555
  111    HA   HIS  15           HA       HIS  15  45.655   4.883  -1.044
  112    HB2  HIS  15           HB2      HIS  15  48.400   5.126  -2.324
  113    HB3  HIS  15           HB1      HIS  15  47.077   4.050  -2.835
  114    HD1  HIS  15           HD1      HIS  15  44.643   5.718  -2.970
  115    HD2  HIS  15           HD2      HIS  15  48.398   7.314  -3.994
  116    HE1  HIS  15           HE1      HIS  15  44.227   7.729  -4.489
  117    H    ILE  16           HN       ILE  16  47.360   5.292   1.453
  118    HA   ILE  16           HA       ILE  16  47.490   2.774   2.315
  119    HB   ILE  16           HB       ILE  16  49.170   1.977   0.823
  120   HG12  ILE  16          HG12      ILE  16  51.016   2.791   3.084
  121   HG13  ILE  16          HG11      ILE  16  49.611   1.779   3.472
  122   HG21  ILE  16          HG21      ILE  16  49.952   4.084  -0.168
  123   HG22  ILE  16          HG22      ILE  16  51.363   3.291   0.557
  124   HG23  ILE  16          HG23      ILE  16  50.576   4.621   1.402
  125   HD11  ILE  16           HD1      ILE  16  51.829   0.572   2.878
  126   HD12  ILE  16           HD2      ILE  16  51.487   1.043   1.197
  127   HD13  ILE  16           HD3      ILE  16  50.345   0.003   2.079
  128    H    GLY  17           HN       GLY  17  49.228   5.595   2.220
  129    HA2  GLY  17           HA1      GLY  17  49.718   5.609   5.111
  130    HA3  GLY  17           HA2      GLY  17  49.953   6.970   3.997
  131    H    HIS  18           HN       HIS  18  47.192   6.035   2.837
  132    HA   HIS  18           HA       HIS  18  45.601   7.779   4.715
  133    HB2  HIS  18           HB2      HIS  18  45.427   6.994   1.829
  134    HB3  HIS  18           HB1      HIS  18  43.866   7.140   2.659
  135    HD1  HIS  18           HD1      HIS  18  46.844   9.286   3.623
  136    HD2  HIS  18           HD2      HIS  18  43.214   9.649   1.528
  137    HE1  HIS  18           HE1      HIS  18  46.458  11.775   3.193
  138    H    ALA  19           HN       ALA  19  45.589   4.435   3.306
  139    HA   ALA  19           HA       ALA  19  44.269   3.455   5.719
  140    HB1  ALA  19           HB1      ALA  19  42.089   2.978   4.912
  141    HB2  ALA  19           HB2      ALA  19  42.534   3.392   3.237
  142    HB3  ALA  19           HB3      ALA  19  42.394   4.674   4.466
  143    H    ALA  20           HN       ALA  20  46.578   2.660   4.260
  144    HA   ALA  20           HA       ALA  20  47.538   0.680   3.541
  145    HB1  ALA  20           HB1      ALA  20  46.582  -1.364   4.164
  146    HB2  ALA  20           HB2      ALA  20  44.920  -0.791   3.897
  147    HB3  ALA  20           HB3      ALA  20  45.842  -0.225   5.311
  148    H    VAL  21           HN       VAL  21  44.645   1.954   2.115
  149    HA   VAL  21           HA       VAL  21  45.533   0.914  -0.530
  150    HB   VAL  21           HB       VAL  21  42.646   0.587   0.398
  151   HG11  VAL  21          HG11      VAL  21  42.899   0.953  -2.009
  152   HG12  VAL  21          HG12      VAL  21  42.513  -0.760  -1.717
  153   HG13  VAL  21          HG13      VAL  21  44.185  -0.275  -2.091
  154   HG21  VAL  21          HG21      VAL  21  43.201  -1.888   0.259
  155   HG22  VAL  21          HG22      VAL  21  43.983  -1.035   1.611
  156   HG23  VAL  21          HG23      VAL  21  44.917  -1.433   0.149
  157    H    ASN  22           HN       ASN  22  43.481   2.972   1.473
  158    HA   ASN  22           HA       ASN  22  43.845   5.417   0.378
  159    HB2  ASN  22           HB2      ASN  22  43.358   4.966  -1.891
  160    HB3  ASN  22           HB1      ASN  22  42.037   3.844  -1.487
  161   HD21  ASN  22          HD21      ASN  22  40.004   4.884  -0.538
  162   HD22  ASN  22          HD22      ASN  22  39.615   6.531  -1.047
  163    H    HIS  23           HN       HIS  23  41.122   3.157   0.892
  164    HA   HIS  23           HA       HIS  23  40.288   4.584   3.278
  165    HB2  HIS  23           HB2      HIS  23  39.384   6.165   1.630
  166    HB3  HIS  23           HB1      HIS  23  38.546   4.838   0.791
  167    HD1  HIS  23           HD1      HIS  23  38.753   6.113   4.428
  168    HD2  HIS  23           HD2      HIS  23  35.959   4.574   1.690
  169    HE1  HIS  23           HE1      HIS  23  36.471   6.135   5.576
  170    H    TYR  24           HN       TYR  24  37.597   3.443   1.530
  171    HA   TYR  24           HA       TYR  24  36.240   1.598   1.952
  172    HB2  TYR  24           HB2      TYR  24  38.934   0.227   1.580
  173    HB3  TYR  24           HB1      TYR  24  37.356  -0.596   1.531
  174    HD1  TYR  24           HD1      TYR  24  39.640   1.716  -0.226
  175    HD2  TYR  24           HD2      TYR  24  35.750  -0.155  -0.293
  176    HE1  TYR  24           HE1      TYR  24  39.371   2.361  -2.617
  177    HE2  TYR  24           HE2      TYR  24  35.483   0.489  -2.684
  178    HH   TYR  24           HH       TYR  24  36.551   2.279  -4.312
  179    H    LEU  25           HN       LEU  25  37.852   2.863   4.275
  180    HA   LEU  25           HA       LEU  25  36.840   1.031   6.296
  181    HB2  LEU  25           HB2      LEU  25  38.843  -0.231   5.852
  182    HB3  LEU  25           HB1      LEU  25  39.841   1.238   5.831
  183    HG   LEU  25           HG       LEU  25  39.549   1.567   8.214
  184   HD11  LEU  25          HD11      LEU  25  38.193  -0.223   9.511
  185   HD12  LEU  25          HD12      LEU  25  37.468  -0.638   7.939
  186   HD13  LEU  25          HD13      LEU  25  37.266   0.998   8.612
  187   HD21  LEU  25          HD21      LEU  25  40.554  -0.506   9.090
  188   HD22  LEU  25          HD22      LEU  25  41.235  -0.120   7.491
  189   HD23  LEU  25          HD23      LEU  25  40.005  -1.397   7.651
  Start of MODEL   98
    1    H1   GLY   1           HT1      GLY   1  60.432  20.905  -9.568
    2    H2   GLY   1           HT2      GLY   1  61.078  22.356  -8.963
    3    H3   GLY   1           HT3      GLY   1  61.015  20.973  -7.978
    4    HA2  GLY   1           HA1      GLY   1  62.371  20.378 -10.350
    5    HA3  GLY   1           HA2      GLY   1  63.066  21.825  -9.595
    6    H    TRP   2           HN       TRP   2  61.928  18.518  -8.809
    7    HA   TRP   2           HA       TRP   2  64.426  17.902  -7.467
    8    HB2  TRP   2           HB2      TRP   2  63.283  19.379  -5.760
    9    HB3  TRP   2           HB1      TRP   2  61.983  18.167  -5.672
   10    HD1  TRP   2           HD1      TRP   2  62.337  16.271  -4.014
   11    HE1  TRP   2           HE1      TRP   2  64.330  15.291  -2.660
   12    HE3  TRP   2           HE3      TRP   2  66.126  19.080  -6.006
   13    HZ2  TRP   2           HZ2      TRP   2  67.176  15.694  -2.491
   14    HZ3  TRP   2           HZ3      TRP   2  68.472  18.764  -5.233
   15    HH2  TRP   2           HH2      TRP   2  69.000  17.076  -3.479
   16    H    GLY   3           HN       GLY   3  61.570  17.161  -8.994
   17    HA2  GLY   3           HA1      GLY   3  60.825  15.097  -9.766
   18    HA3  GLY   3           HA2      GLY   3  62.120  14.300  -8.851
   19    H    SER   4           HN       SER   4  60.579  16.336  -6.736
   20    HA   SER   4           HA       SER   4  58.194  14.797  -6.151
   21    HB2  SER   4           HB2      SER   4  60.701  14.238  -4.526
   22    HB3  SER   4           HB1      SER   4  59.060  13.897  -3.931
   23    HG   SER   4           HG       SER   4  59.956  12.082  -4.974
   24    H    ILE   5           HN       ILE   5  58.168  17.362  -6.475
   25    HA   ILE   5           HA       ILE   5  58.797  18.819  -3.985
   26    HB   ILE   5           HB       ILE   5  57.829  20.772  -5.165
   27   HG12  ILE   5          HG12      ILE   5  57.208  18.685  -7.307
   28   HG13  ILE   5          HG11      ILE   5  56.036  19.679  -6.411
   29   HG21  ILE   5          HG21      ILE   5  60.225  19.913  -5.539
   30   HG22  ILE   5          HG22      ILE   5  59.571  20.977  -6.804
   31   HG23  ILE   5          HG23      ILE   5  59.632  19.218  -7.067
   32   HD11  ILE   5           HD1      ILE   5  56.257  20.789  -8.497
   33   HD12  ILE   5           HD2      ILE   5  58.019  20.552  -8.538
   34   HD13  ILE   5           HD3      ILE   5  57.304  21.724  -7.404
   35    H    PHE   6           HN       PHE   6  56.723  16.551  -4.165
   36    HA   PHE   6           HA       PHE   6  54.792  17.859  -2.410
   37    HB2  PHE   6           HB2      PHE   6  52.795  17.488  -3.733
   38    HB3  PHE   6           HB1      PHE   6  53.919  18.500  -4.670
   39    HD1  PHE   6           HD1      PHE   6  52.092  15.351  -4.553
   40    HD2  PHE   6           HD2      PHE   6  55.383  17.401  -6.445
   41    HE1  PHE   6           HE1      PHE   6  52.067  13.683  -6.403
   42    HE2  PHE   6           HE2      PHE   6  55.358  15.734  -8.295
   43    HZ   PHE   6           HZ       PHE   6  53.599  13.971  -8.348
   44    H    LYS   7           HN       LYS   7  55.735  15.042  -4.368
   45    HA   LYS   7           HA       LYS   7  54.113  13.090  -3.112
   46    HB2  LYS   7           HB2      LYS   7  56.998  12.724  -4.019
   47    HB3  LYS   7           HB1      LYS   7  55.754  11.461  -3.861
   48    HG2  LYS   7           HG2      LYS   7  54.411  12.515  -5.625
   49    HG3  LYS   7           HG1      LYS   7  55.582  13.853  -5.747
   50    HD2  LYS   7           HD2      LYS   7  57.356  12.221  -6.377
   51    HD3  LYS   7           HD1      LYS   7  56.156  10.910  -6.310
   52    HE2  LYS   7           HE2      LYS   7  54.845  11.968  -8.091
   53    HE3  LYS   7           HE1      LYS   7  55.955  13.359  -8.117
   54    HZ1  LYS   7           HZ1      LYS   7  57.439  12.228  -9.316
   55    HZ2  LYS   7           HZ2      LYS   7  56.187  11.126  -9.641
   56    HZ3  LYS   7           HZ3      LYS   7  57.287  10.820  -8.383
   57    H    HIS   8           HN       HIS   8  57.184  14.570  -2.109
   58    HA   HIS   8           HA       HIS   8  57.669  12.784   0.102
   59    HB2  HIS   8           HB2      HIS   8  59.352  14.333  -0.993
   60    HB3  HIS   8           HB1      HIS   8  58.553  15.684  -0.153
   61    HD1  HIS   8           HD1      HIS   8  58.302  12.776   1.979
   62    HD2  HIS   8           HD2      HIS   8  61.283  15.634   1.186
   63    HE1  HIS   8           HE1      HIS   8  59.996  12.658   3.887
   64    H    GLY   9           HN       GLY   9  55.052  14.642  -0.370
   65    HA2  GLY   9           HA1      GLY   9  54.490  14.798   2.527
   66    HA3  GLY   9           HA2      GLY   9  54.512  16.348   1.660
   67    H    ARG  10           HN       ARG  10  53.621  13.846  -0.409
   68    HA   ARG  10           HA       ARG  10  50.756  13.830   0.293
   69    HB2  ARG  10           HB2      ARG  10  51.806  15.231  -2.200
   70    HB3  ARG  10           HB1      ARG  10  50.123  14.682  -2.017
   71    HG2  ARG  10           HG2      ARG  10  50.057  16.058   0.156
   72    HG3  ARG  10           HG1      ARG  10  51.602  16.771  -0.365
   73    HD2  ARG  10           HD2      ARG  10  50.529  17.489  -2.497
   74    HD3  ARG  10           HD1      ARG  10  48.981  16.825  -1.922
   75    HE   ARG  10           HE       ARG  10  49.955  18.636   0.054
   76   HH11  ARG  10          HH11      ARG  10  48.154  20.169   0.217
   77   HH12  ARG  10          HH12      ARG  10  47.777  21.063  -1.219
   78   HH21  ARG  10          HH21      ARG  10  49.752  19.096  -3.281
   79   HH22  ARG  10          HH22      ARG  10  48.681  20.455  -3.198
   80    H    HIS  11           HN       HIS  11  49.518  12.484  -1.230
   81    HA   HIS  11           HA       HIS  11  49.241  10.429  -2.243
   82    HB2  HIS  11           HB2      HIS  11  50.222  11.628  -4.186
   83    HB3  HIS  11           HB1      HIS  11  51.849  11.151  -3.642
   84    HD1  HIS  11           HD1      HIS  11  49.139   8.634  -3.137
   85    HD2  HIS  11           HD2      HIS  11  52.072   9.507  -6.021
   86    HE1  HIS  11           HE1      HIS  11  49.297   6.617  -4.697
   87    H    ALA  12           HN       ALA  12  49.449   8.471  -1.867
   88    HA   ALA  12           HA       ALA  12  50.145   6.486  -0.989
   89    HB1  ALA  12           HB1      ALA  12  52.300   7.190  -2.110
   90    HB2  ALA  12           HB2      ALA  12  52.445   6.096  -0.711
   91    HB3  ALA  12           HB3      ALA  12  52.684   7.835  -0.525
   92    H    ALA  13           HN       ALA  13  51.218   9.540   0.421
   93    HA   ALA  13           HA       ALA  13  51.184   8.526   3.164
   94    HB1  ALA  13           HB1      ALA  13  52.069  10.791   2.919
   95    HB2  ALA  13           HB2      ALA  13  50.425  10.992   3.572
   96    HB3  ALA  13           HB3      ALA  13  50.733  11.257   1.839
   97    H    LYS  14           HN       LYS  14  49.824   8.351   0.271
   98    HA   LYS  14           HA       LYS  14  46.870   8.232   1.296
   99    HB2  LYS  14           HB2      LYS  14  47.746   9.742  -0.663
  100    HB3  LYS  14           HB1      LYS  14  48.021   8.180  -1.517
  101    HG2  LYS  14           HG2      LYS  14  45.747   7.913  -1.938
  102    HG3  LYS  14           HG1      LYS  14  45.254   8.523  -0.342
  103    HD2  LYS  14           HD2      LYS  14  45.480  10.818  -1.067
  104    HD3  LYS  14           HD1      LYS  14  46.264  10.322  -2.586
  105    HE2  LYS  14           HE2      LYS  14  43.445   9.459  -1.824
  106    HE3  LYS  14           HE1      LYS  14  43.786  10.925  -2.774
  107    HZ1  LYS  14           HZ1      LYS  14  44.154   8.100  -3.504
  108    HZ2  LYS  14           HZ2      LYS  14  45.208   9.254  -4.170
  109    HZ3  LYS  14           HZ3      LYS  14  43.533   9.383  -4.424
  110    H    HIS  15           HN       HIS  15  45.769   6.789  -0.601
  111    HA   HIS  15           HA       HIS  15  45.206   4.532  -0.876
  112    HB2  HIS  15           HB2      HIS  15  47.955   4.640  -2.171
  113    HB3  HIS  15           HB1      HIS  15  46.638   3.511  -2.568
  114    HD1  HIS  15           HD1      HIS  15  47.999   6.814  -3.418
  115    HD2  HIS  15           HD2      HIS  15  44.222   4.967  -3.570
  116    HE1  HIS  15           HE1      HIS  15  46.536   8.200  -4.988
  117    H    ILE  16           HN       ILE  16  46.958   5.168   1.559
  118    HA   ILE  16           HA       ILE  16  47.036   2.732   2.670
  119    HB   ILE  16           HB       ILE  16  48.694   1.797   1.246
  120   HG12  ILE  16          HG12      ILE  16  50.339   2.844   3.583
  121   HG13  ILE  16          HG11      ILE  16  49.085   1.604   3.793
  122   HG21  ILE  16          HG21      ILE  16  50.908   3.049   0.883
  123   HG22  ILE  16          HG22      ILE  16  50.139   4.455   1.619
  124   HG23  ILE  16          HG23      ILE  16  49.510   3.807   0.095
  125   HD11  ILE  16           HD1      ILE  16  51.017   0.295   3.497
  126   HD12  ILE  16           HD2      ILE  16  51.728   1.414   2.317
  127   HD13  ILE  16           HD3      ILE  16  50.382   0.354   1.839
  128    H    GLY  17           HN       GLY  17  48.758   5.540   2.310
  129    HA2  GLY  17           HA1      GLY  17  49.251   5.814   5.194
  130    HA3  GLY  17           HA2      GLY  17  49.511   7.061   3.959
  131    H    HIS  18           HN       HIS  18  46.749   6.029   2.875
  132    HA   HIS  18           HA       HIS  18  45.144   7.958   4.549
  133    HB2  HIS  18           HB2      HIS  18  45.002   6.873   1.758
  134    HB3  HIS  18           HB1      HIS  18  43.433   7.101   2.554
  135    HD1  HIS  18           HD1      HIS  18  46.367   9.367   3.337
  136    HD2  HIS  18           HD2      HIS  18  42.765   9.469   1.174
  137    HE1  HIS  18           HE1      HIS  18  45.994  11.782   2.591
  138    H    ALA  19           HN       ALA  19  45.088   4.532   3.377
  139    HA   ALA  19           HA       ALA  19  44.183   3.378   5.754
  140    HB1  ALA  19           HB1      ALA  19  42.145   4.513   5.959
  141    HB2  ALA  19           HB2      ALA  19  41.632   3.092   5.028
  142    HB3  ALA  19           HB3      ALA  19  41.922   4.642   4.198
  143    H    ALA  20           HN       ALA  20  45.263   3.218   2.774
  144    HA   ALA  20           HA       ALA  20  45.563   1.499   1.243
  145    HB1  ALA  20           HB1      ALA  20  44.420  -0.383   3.330
  146    HB2  ALA  20           HB2      ALA  20  46.067   0.279   3.441
  147    HB3  ALA  20           HB3      ALA  20  45.606  -0.735   2.053
  148    H    VAL  21           HN       VAL  21  42.786   2.738   2.128
  149    HA   VAL  21           HA       VAL  21  41.237   1.298   0.030
  150    HB   VAL  21           HB       VAL  21  40.157   1.825   2.840
  151   HG11  VAL  21          HG11      VAL  21  38.229   0.377   1.847
  152   HG12  VAL  21          HG12      VAL  21  38.935   0.764   0.262
  153   HG13  VAL  21          HG13      VAL  21  38.343   2.068   1.318
  154   HG21  VAL  21          HG21      VAL  21  40.007  -0.698   2.930
  155   HG22  VAL  21          HG22      VAL  21  41.675  -0.088   2.873
  156   HG23  VAL  21          HG23      VAL  21  40.925  -0.760   1.406
  157    H    ASN  22           HN       ASN  22  42.341   4.003   1.662
  158    HA   ASN  22           HA       ASN  22  42.175   6.209   0.765
  159    HB2  ASN  22           HB2      ASN  22  40.559   5.384  -1.069
  160    HB3  ASN  22           HB1      ASN  22  39.248   5.750   0.084
  161   HD21  ASN  22          HD21      ASN  22  38.358   7.611  -0.923
  162   HD22  ASN  22          HD22      ASN  22  39.288   9.091  -1.177
  163    H    HIS  23           HN       HIS  23  39.596   4.581   2.559
  164    HA   HIS  23           HA       HIS  23  39.943   6.259   4.863
  165    HB2  HIS  23           HB2      HIS  23  38.818   7.966   3.458
  166    HB3  HIS  23           HB1      HIS  23  37.458   6.850   3.199
  167    HD1  HIS  23           HD1      HIS  23  35.558   7.682   4.591
  168    HD2  HIS  23           HD2      HIS  23  39.230   7.926   6.627
  169    HE1  HIS  23           HE1      HIS  23  35.056   8.445   6.978
  170    H    TYR  24           HN       TYR  24  40.061   3.919   5.420
  171    HA   TYR  24           HA       TYR  24  37.549   2.400   5.373
  172    HB2  TYR  24           HB2      TYR  24  39.860   1.376   5.237
  173    HB3  TYR  24           HB1      TYR  24  40.087   1.816   6.947
  174    HD1  TYR  24           HD1      TYR  24  38.074  -0.242   4.580
  175    HD2  TYR  24           HD2      TYR  24  38.952   0.612   8.719
  176    HE1  TYR  24           HE1      TYR  24  36.826  -2.286   5.267
  177    HE2  TYR  24           HE2      TYR  24  37.704  -1.432   9.405
  178    HH   TYR  24           HH       TYR  24  35.700  -2.713   8.348
  179    H    LEU  25           HN       LEU  25  39.101   4.690   7.464
  180    HA   LEU  25           HA       LEU  25  37.821   3.817   9.927
  181    HB2  LEU  25           HB2      LEU  25  38.777   6.637   9.332
  182    HB3  LEU  25           HB1      LEU  25  38.735   5.783  10.892
  183    HG   LEU  25           HG       LEU  25  40.533   5.135   8.514
  184   HD11  LEU  25          HD11      LEU  25  42.337   5.878   9.945
  185   HD12  LEU  25          HD12      LEU  25  41.239   6.042  11.336
  186   HD13  LEU  25          HD13      LEU  25  41.095   7.152   9.951
  187   HD21  LEU  25          HD21      LEU  25  40.055   3.731  11.176
  188   HD22  LEU  25          HD22      LEU  25  41.563   3.520  10.253
  189   HD23  LEU  25          HD23      LEU  25  40.009   3.034   9.540
  Start of MODEL   99
    1    H1   GLY   1           HT1      GLY   1  63.131  13.724   7.371
    2    H2   GLY   1           HT2      GLY   1  62.689  12.108   7.086
    3    H3   GLY   1           HT3      GLY   1  62.415  13.291   5.897
    4    HA2  GLY   1           HA1      GLY   1  64.641  13.533   5.420
    5    HA3  GLY   1           HA2      GLY   1  65.099  12.666   6.899
    6    H    TRP   2           HN       TRP   2  62.378  11.290   5.405
    7    HA   TRP   2           HA       TRP   2  63.788   8.851   4.809
    8    HB2  TRP   2           HB2      TRP   2  61.333   9.070   5.386
    9    HB3  TRP   2           HB1      TRP   2  61.070   9.721   3.752
   10    HD1  TRP   2           HD1      TRP   2  61.239   8.065   1.720
   11    HE1  TRP   2           HE1      TRP   2  61.305   5.474   1.508
   12    HE3  TRP   2           HE3      TRP   2  62.211   6.878   6.605
   13    HZ2  TRP   2           HZ2      TRP   2  61.724   3.218   3.247
   14    HZ3  TRP   2           HZ3      TRP   2  62.439   4.499   7.306
   15    HH2  TRP   2           HH2      TRP   2  62.197   2.670   5.632
   16    H    GLY   3           HN       GLY   3  63.981  11.744   3.268
   17    HA2  GLY   3           HA1      GLY   3  65.047  12.229   1.249
   18    HA3  GLY   3           HA2      GLY   3  65.055  10.503   0.840
   19    H    SER   4           HN       SER   4  61.963  11.070   1.737
   20    HA   SER   4           HA       SER   4  61.034  11.071  -1.031
   21    HB2  SER   4           HB2      SER   4  58.781  11.029   0.004
   22    HB3  SER   4           HB1      SER   4  59.856   9.802   0.709
   23    HG   SER   4           HG       SER   4  58.877  12.203   1.790
   24    H    ILE   5           HN       ILE   5  60.023  12.662  -2.183
   25    HA   ILE   5           HA       ILE   5  60.604  15.413  -1.344
   26    HB   ILE   5           HB       ILE   5  59.145  14.286  -3.783
   27   HG12  ILE   5          HG12      ILE   5  61.238  15.053  -4.953
   28   HG13  ILE   5          HG11      ILE   5  61.932  15.477  -3.373
   29   HG21  ILE   5          HG21      ILE   5  59.552  16.667  -4.673
   30   HG22  ILE   5          HG22      ILE   5  59.879  17.134  -2.987
   31   HG23  ILE   5          HG23      ILE   5  58.279  16.505  -3.443
   32   HD11  ILE   5           HD1      ILE   5  62.451  13.108  -4.482
   33   HD12  ILE   5           HD2      ILE   5  60.870  12.668  -3.796
   34   HD13  ILE   5           HD3      ILE   5  62.182  13.231  -2.731
   35    H    PHE   6           HN       PHE   6  59.375  15.850   0.481
   36    HA   PHE   6           HA       PHE   6  57.457  16.352   1.697
   37    HB2  PHE   6           HB2      PHE   6  56.455  17.107  -1.077
   38    HB3  PHE   6           HB1      PHE   6  55.737  17.629   0.465
   39    HD1  PHE   6           HD1      PHE   6  57.389  18.765   2.181
   40    HD2  PHE   6           HD2      PHE   6  58.138  18.456  -2.061
   41    HE1  PHE   6           HE1      PHE   6  59.013  20.649   2.328
   42    HE2  PHE   6           HE2      PHE   6  59.762  20.339  -1.910
   43    HZ   PHE   6           HZ       PHE   6  60.140  21.484   0.269
   44    H    LYS   7           HN       LYS   7  57.481  13.776   1.679
   45    HA   LYS   7           HA       LYS   7  56.193  11.842   1.671
   46    HB2  LYS   7           HB2      LYS   7  53.787  13.692   1.547
   47    HB3  LYS   7           HB1      LYS   7  53.902  12.081   2.295
   48    HG2  LYS   7           HG2      LYS   7  55.601  12.998   3.906
   49    HG3  LYS   7           HG1      LYS   7  55.356  14.607   3.195
   50    HD2  LYS   7           HD2      LYS   7  53.879  14.708   5.014
   51    HD3  LYS   7           HD1      LYS   7  52.786  14.140   3.732
   52    HE2  LYS   7           HE2      LYS   7  52.505  12.812   5.807
   53    HE3  LYS   7           HE1      LYS   7  53.127  11.795   4.488
   54    HZ1  LYS   7           HZ1      LYS   7  55.113  13.131   6.155
   55    HZ2  LYS   7           HZ2      LYS   7  55.123  11.568   5.486
   56    HZ3  LYS   7           HZ3      LYS   7  54.230  11.887   6.896
   57    H    HIS   8           HN       HIS   8  57.197  12.115  -0.716
   58    HA   HIS   8           HA       HIS   8  56.892  11.634  -2.961
   59    HB2  HIS   8           HB2      HIS   8  55.751   9.646  -1.896
   60    HB3  HIS   8           HB1      HIS   8  54.207  10.509  -2.086
   61    HD1  HIS   8           HD1      HIS   8  53.910   8.160  -3.641
   62    HD2  HIS   8           HD2      HIS   8  56.156  11.362  -5.186
   63    HE1  HIS   8           HE1      HIS   8  54.089   7.820  -6.166
   64    H    GLY   9           HN       GLY   9  55.725  14.143  -1.671
   65    HA2  GLY   9           HA1      GLY   9  54.808  16.055  -2.634
   66    HA3  GLY   9           HA2      GLY   9  54.461  15.136  -4.111
   67    H    ARG  10           HN       ARG  10  53.429  14.961  -0.663
   68    HA   ARG  10           HA       ARG  10  51.302  14.729   0.235
   69    HB2  ARG  10           HB2      ARG  10  50.734  16.531  -2.148
   70    HB3  ARG  10           HB1      ARG  10  49.479  16.081  -0.970
   71    HG2  ARG  10           HG2      ARG  10  50.489  18.233  -0.341
   72    HG3  ARG  10           HG1      ARG  10  50.894  16.993   0.867
   73    HD2  ARG  10           HD2      ARG  10  53.136  16.840   0.144
   74    HD3  ARG  10           HD1      ARG  10  52.775  17.533  -1.457
   75    HE   ARG  10           HE       ARG  10  53.367  19.038   0.972
   76   HH11  ARG  10          HH11      ARG  10  51.053  20.505   0.679
   77   HH12  ARG  10          HH12      ARG  10  51.293  21.560  -0.674
   78   HH21  ARG  10          HH21      ARG  10  53.959  19.750  -1.953
   79   HH22  ARG  10          HH22      ARG  10  52.938  21.134  -2.163
   80    H    HIS  11           HN       HIS  11  52.193  12.570  -1.240
   81    HA   HIS  11           HA       HIS  11  49.609  11.359  -1.861
   82    HB2  HIS  11           HB2      HIS  11  50.175  12.355  -4.072
   83    HB3  HIS  11           HB1      HIS  11  51.741  11.511  -4.034
   84    HD1  HIS  11           HD1      HIS  11  48.031  10.951  -4.483
   85    HD2  HIS  11           HD2      HIS  11  51.602   8.737  -4.595
   86    HE1  HIS  11           HE1      HIS  11  47.465   8.641  -5.415
   87    H    ALA  12           HN       ALA  12  50.361  10.597   0.065
   88    HA   ALA  12           HA       ALA  12  51.159   7.903  -0.104
   89    HB1  ALA  12           HB1      ALA  12  53.341   8.260   1.096
   90    HB2  ALA  12           HB2      ALA  12  53.017   9.987   0.809
   91    HB3  ALA  12           HB3      ALA  12  53.350   8.909  -0.560
   92    H    ALA  13           HN       ALA  13  51.114  11.037   1.400
   93    HA   ALA  13           HA       ALA  13  50.499  10.069   4.111
   94    HB1  ALA  13           HB1      ALA  13  49.636  12.594   2.577
   95    HB2  ALA  13           HB2      ALA  13  51.005  12.514   3.711
   96    HB3  ALA  13           HB3      ALA  13  49.341  12.297   4.307
   97    H    LYS  14           HN       LYS  14  50.050   9.674   0.959
   98    HA   LYS  14           HA       LYS  14  47.049   8.853   1.124
   99    HB2  LYS  14           HB2      LYS  14  48.072  10.608  -0.505
  100    HB3  LYS  14           HB1      LYS  14  48.974   9.196  -1.204
  101    HG2  LYS  14           HG2      LYS  14  47.067   8.456  -2.326
  102    HG3  LYS  14           HG1      LYS  14  45.989   8.777  -0.948
  103    HD2  LYS  14           HD2      LYS  14  46.017  11.209  -1.529
  104    HD3  LYS  14           HD1      LYS  14  47.028  10.838  -2.945
  105    HE2  LYS  14           HE2      LYS  14  44.329   9.511  -2.472
  106    HE3  LYS  14           HE1      LYS  14  44.504  11.031  -3.380
  107    HZ1  LYS  14           HZ1      LYS  14  44.565   9.242  -4.922
  108    HZ2  LYS  14           HZ2      LYS  14  45.731   8.397  -4.018
  109    HZ3  LYS  14           HZ3      LYS  14  46.146   9.845  -4.804
  110    H    HIS  15           HN       HIS  15  46.957   7.265  -1.026
  111    HA   HIS  15           HA       HIS  15  47.057   4.955  -1.397
  112    HB2  HIS  15           HB2      HIS  15  48.717   6.118  -2.897
  113    HB3  HIS  15           HB1      HIS  15  49.989   5.682  -1.730
  114    HD1  HIS  15           HD1      HIS  15  47.021   3.552  -2.906
  115    HD2  HIS  15           HD2      HIS  15  51.219   3.597  -3.121
  116    HE1  HIS  15           HE1      HIS  15  47.754   1.330  -3.929
  117    H    ILE  16           HN       ILE  16  47.755   5.853   1.457
  118    HA   ILE  16           HA       ILE  16  48.033   3.455   2.611
  119    HB   ILE  16           HB       ILE  16  50.228   2.975   1.794
  120   HG12  ILE  16          HG12      ILE  16  50.747   4.210   4.528
  121   HG13  ILE  16          HG11      ILE  16  49.804   2.718   4.329
  122   HG21  ILE  16          HG21      ILE  16  50.895   5.833   2.632
  123   HG22  ILE  16          HG22      ILE  16  50.863   5.222   0.964
  124   HG23  ILE  16          HG23      ILE  16  52.106   4.662   2.101
  125   HD11  ILE  16           HD1      ILE  16  52.752   3.196   3.788
  126   HD12  ILE  16           HD2      ILE  16  51.898   1.884   2.941
  127   HD13  ILE  16           HD3      ILE  16  51.978   1.895   4.716
  128    H    GLY  17           HN       GLY  17  49.108   6.587   2.705
  129    HA2  GLY  17           HA1      GLY  17  48.625   6.865   5.589
  130    HA3  GLY  17           HA2      GLY  17  48.974   8.179   4.448
  131    H    HIS  18           HN       HIS  18  46.961   6.591   2.620
  132    HA   HIS  18           HA       HIS  18  44.541   8.070   3.646
  133    HB2  HIS  18           HB2      HIS  18  45.510   7.074   0.993
  134    HB3  HIS  18           HB1      HIS  18  43.765   6.885   1.257
  135    HD1  HIS  18           HD1      HIS  18  45.647   9.766   2.833
  136    HD2  HIS  18           HD2      HIS  18  43.044   9.068  -0.392
  137    HE1  HIS  18           HE1      HIS  18  44.963  12.043   1.900
  138    H    ALA  19           HN       ALA  19  45.648   4.775   2.700
  139    HA   ALA  19           HA       ALA  19  44.413   3.327   4.706
  140    HB1  ALA  19           HB1      ALA  19  42.274   2.519   3.309
  141    HB2  ALA  19           HB2      ALA  19  42.400   4.151   2.613
  142    HB3  ALA  19           HB3      ALA  19  42.183   3.944   4.368
  143    H    ALA  20           HN       ALA  20  46.216   3.596   2.095
  144    HA   ALA  20           HA       ALA  20  47.275   2.089   0.680
  145    HB1  ALA  20           HB1      ALA  20  47.680  -0.118   1.502
  146    HB2  ALA  20           HB2      ALA  20  46.206  -0.094   2.499
  147    HB3  ALA  20           HB3      ALA  20  47.593   0.933   2.934
  148    H    VAL  21           HN       VAL  21  44.195   2.602   0.833
  149    HA   VAL  21           HA       VAL  21  43.530   0.848  -1.487
  150    HB   VAL  21           HB       VAL  21  41.830   1.133   1.034
  151   HG11  VAL  21          HG11      VAL  21  40.372  -0.584  -0.323
  152   HG12  VAL  21          HG12      VAL  21  41.243   0.040  -1.743
  153   HG13  VAL  21          HG13      VAL  21  40.262   1.138  -0.744
  154   HG21  VAL  21          HG21      VAL  21  43.618  -0.523   1.293
  155   HG22  VAL  21          HG22      VAL  21  43.208  -1.259  -0.274
  156   HG23  VAL  21          HG23      VAL  21  42.071  -1.374   1.090
  157    H    ASN  22           HN       ASN  22  43.670   3.735   0.166
  158    HA   ASN  22           HA       ASN  22  43.253   5.863  -0.822
  159    HB2  ASN  22           HB2      ASN  22  40.781   4.744  -2.186
  160    HB3  ASN  22           HB1      ASN  22  41.582   6.303  -2.464
  161   HD21  ASN  22          HD21      ASN  22  41.121   4.323  -4.569
  162   HD22  ASN  22          HD22      ASN  22  42.715   3.792  -5.120
  163    H    HIS  23           HN       HIS  23  40.729   3.697   0.358
  164    HA   HIS  23           HA       HIS  23  40.077   5.589   2.490
  165    HB2  HIS  23           HB2      HIS  23  37.637   5.734   1.856
  166    HB3  HIS  23           HB1      HIS  23  38.732   6.642   0.785
  167    HD1  HIS  23           HD1      HIS  23  39.124   5.743  -1.625
  168    HD2  HIS  23           HD2      HIS  23  36.484   3.400   0.663
  169    HE1  HIS  23           HE1      HIS  23  37.942   4.142  -3.227
  170    H    TYR  24           HN       TYR  24  40.052   4.238   4.153
  171    HA   TYR  24           HA       TYR  24  39.397   1.431   3.876
  172    HB2  TYR  24           HB2      TYR  24  40.944   2.275   5.602
  173    HB3  TYR  24           HB1      TYR  24  39.612   3.177   6.363
  174    HD1  TYR  24           HD1      TYR  24  40.695  -0.280   5.359
  175    HD2  TYR  24           HD2      TYR  24  38.166   2.100   7.925
  176    HE1  TYR  24           HE1      TYR  24  40.051  -2.327   6.624
  177    HE2  TYR  24           HE2      TYR  24  37.523   0.052   9.189
  178    HH   TYR  24           HH       TYR  24  38.330  -2.215   9.600
  179    H    LEU  25           HN       LEU  25  37.456   4.125   3.791
  180    HA   LEU  25           HA       LEU  25  35.250   3.181   5.452
  181    HB2  LEU  25           HB2      LEU  25  35.010   5.151   3.156
  182    HB3  LEU  25           HB1      LEU  25  34.079   5.084   4.672
  183    HG   LEU  25           HG       LEU  25  37.028   5.808   4.375
  184   HD11  LEU  25          HD11      LEU  25  35.312   7.540   3.721
  185   HD12  LEU  25          HD12      LEU  25  36.319   8.018   5.109
  186   HD13  LEU  25          HD13      LEU  25  34.655   7.445   5.372
  187   HD21  LEU  25          HD21      LEU  25  36.832   4.621   6.452
  188   HD22  LEU  25          HD22      LEU  25  35.257   5.367   6.816
  189   HD23  LEU  25          HD23      LEU  25  36.745   6.343   6.884
  Start of MODEL  100
    1    H1   GLY   1           HT1      GLY   1  62.550  22.197  -9.354
    2    H2   GLY   1           HT2      GLY   1  62.477  20.945  -8.207
    3    H3   GLY   1           HT3      GLY   1  62.871  20.600  -9.824
    4    HA2  GLY   1           HA1      GLY   1  64.913  21.687  -9.680
    5    HA3  GLY   1           HA2      GLY   1  64.480  22.345  -8.090
    6    H    TRP   2           HN       TRP   2  63.381  19.148  -8.647
    7    HA   TRP   2           HA       TRP   2  65.832  17.817  -7.713
    8    HB2  TRP   2           HB2      TRP   2  63.427  18.148  -5.873
    9    HB3  TRP   2           HB1      TRP   2  64.701  16.929  -5.632
   10    HD1  TRP   2           HD1      TRP   2  67.316  18.169  -5.812
   11    HE1  TRP   2           HE1      TRP   2  68.122  20.254  -4.485
   12    HE3  TRP   2           HE3      TRP   2  62.760  20.201  -4.657
   13    HZ2  TRP   2           HZ2      TRP   2  66.923  22.486  -3.116
   14    HZ3  TRP   2           HZ3      TRP   2  62.616  22.309  -3.339
   15    HH2  TRP   2           HH2      TRP   2  64.689  23.451  -2.569
   16    H    GLY   3           HN       GLY   3  62.624  16.765  -6.757
   17    HA2  GLY   3           HA1      GLY   3  61.938  15.337  -9.137
   18    HA3  GLY   3           HA2      GLY   3  62.841  14.257  -8.055
   19    H    SER   4           HN       SER   4  61.209  16.678  -6.339
   20    HA   SER   4           HA       SER   4  58.657  15.170  -6.114
   21    HB2  SER   4           HB2      SER   4  60.545  15.549  -3.755
   22    HB3  SER   4           HB1      SER   4  58.877  14.945  -3.656
   23    HG   SER   4           HG       SER   4  59.473  13.123  -4.682
   24    H    ILE   5           HN       ILE   5  57.878  17.150  -7.032
   25    HA   ILE   5           HA       ILE   5  58.296  19.707  -5.833
   26    HB   ILE   5           HB       ILE   5  56.160  20.355  -6.996
   27   HG12  ILE   5          HG12      ILE   5  56.107  17.359  -7.587
   28   HG13  ILE   5          HG11      ILE   5  54.882  18.297  -6.702
   29   HG21  ILE   5          HG21      ILE   5  57.915  18.609  -8.775
   30   HG22  ILE   5          HG22      ILE   5  58.461  20.176  -8.129
   31   HG23  ILE   5          HG23      ILE   5  57.056  20.105  -9.214
   32   HD11  ILE   5           HD1      ILE   5  54.665  19.702  -8.885
   33   HD12  ILE   5           HD2      ILE   5  53.964  18.066  -8.877
   34   HD13  ILE   5           HD3      ILE   5  55.531  18.357  -9.667
   35    H    PHE   6           HN       PHE   6  55.943  17.122  -5.176
   36    HA   PHE   6           HA       PHE   6  55.473  18.214  -2.497
   37    HB2  PHE   6           HB2      PHE   6  53.308  18.352  -4.630
   38    HB3  PHE   6           HB1      PHE   6  52.934  18.324  -2.891
   39    HD1  PHE   6           HD1      PHE   6  53.980  20.104  -1.381
   40    HD2  PHE   6           HD2      PHE   6  54.013  20.381  -5.690
   41    HE1  PHE   6           HE1      PHE   6  54.443  22.547  -1.221
   42    HE2  PHE   6           HE2      PHE   6  54.474  22.824  -5.528
   43    HZ   PHE   6           HZ       PHE   6  54.677  23.909  -3.294
   44    H    LYS   7           HN       LYS   7  55.864  15.741  -4.606
   45    HA   LYS   7           HA       LYS   7  53.951  13.788  -4.037
   46    HB2  LYS   7           HB2      LYS   7  55.866  13.481  -5.584
   47    HB3  LYS   7           HB1      LYS   7  56.963  13.377  -4.187
   48    HG2  LYS   7           HG2      LYS   7  55.967  11.344  -3.416
   49    HG3  LYS   7           HG1      LYS   7  54.557  11.536  -4.486
   50    HD2  LYS   7           HD2      LYS   7  56.182   9.833  -5.338
   51    HD3  LYS   7           HD1      LYS   7  55.962  11.191  -6.465
   52    HE2  LYS   7           HE2      LYS   7  58.060  12.157  -5.891
   53    HE3  LYS   7           HE1      LYS   7  58.204  11.177  -4.410
   54    HZ1  LYS   7           HZ1      LYS   7  58.652   9.268  -5.639
   55    HZ2  LYS   7           HZ2      LYS   7  59.540  10.469  -6.448
   56    HZ3  LYS   7           HZ3      LYS   7  58.065   9.922  -7.089
   57    H    HIS   8           HN       HIS   8  56.992  14.338  -2.191
   58    HA   HIS   8           HA       HIS   8  56.022  12.621   0.002
   59    HB2  HIS   8           HB2      HIS   8  58.509  14.332  -0.384
   60    HB3  HIS   8           HB1      HIS   8  58.186  13.381   1.086
   61    HD1  HIS   8           HD1      HIS   8  58.335  10.804   0.944
   62    HD2  HIS   8           HD2      HIS   8  59.021  12.737  -2.729
   63    HE1  HIS   8           HE1      HIS   8  59.306   9.069  -0.661
   64    H    GLY   9           HN       GLY   9  54.053  14.297  -0.081
   65    HA2  GLY   9           HA1      GLY   9  54.272  15.767   2.408
   66    HA3  GLY   9           HA2      GLY   9  54.230  16.857   1.008
   67    H    ARG  10           HN       ARG  10  52.580  14.423  -0.217
   68    HA   ARG  10           HA       ARG  10  50.059  14.608   1.248
   69    HB2  ARG  10           HB2      ARG  10  48.833  15.710  -0.692
   70    HB3  ARG  10           HB1      ARG  10  49.884  16.789   0.260
   71    HG2  ARG  10           HG2      ARG  10  51.669  16.587  -1.406
   72    HG3  ARG  10           HG1      ARG  10  50.701  15.420  -2.339
   73    HD2  ARG  10           HD2      ARG  10  50.626  17.821  -3.199
   74    HD3  ARG  10           HD1      ARG  10  49.039  17.085  -2.863
   75    HE   ARG  10           HE       ARG  10  49.963  18.459  -0.517
   76   HH11  ARG  10          HH11      ARG  10  48.142  19.898  -0.062
   77   HH12  ARG  10          HH12      ARG  10  47.728  21.033  -1.304
   78   HH21  ARG  10          HH21      ARG  10  49.720  19.529  -3.710
   79   HH22  ARG  10          HH22      ARG  10  48.621  20.824  -3.369
   80    H    HIS  11           HN       HIS  11  51.954  12.640   0.098
   81    HA   HIS  11           HA       HIS  11  49.902  10.993  -1.257
   82    HB2  HIS  11           HB2      HIS  11  51.197  12.255  -3.086
   83    HB3  HIS  11           HB1      HIS  11  52.630  11.344  -2.556
   84    HD1  HIS  11           HD1      HIS  11  49.165  10.863  -4.069
   85    HD2  HIS  11           HD2      HIS  11  52.697   8.674  -3.420
   86    HE1  HIS  11           HE1      HIS  11  48.918   8.637  -5.298
   87    H    ALA  12           HN       ALA  12  50.129   8.941  -1.128
   88    HA   ALA  12           HA       ALA  12  50.765   6.893  -0.316
   89    HB1  ALA  12           HB1      ALA  12  53.066   7.759  -0.957
   90    HB2  ALA  12           HB2      ALA  12  52.981   6.537   0.339
   91    HB3  ALA  12           HB3      ALA  12  53.119   8.253   0.727
   92    H    ALA  13           HN       ALA  13  51.416   9.862   1.469
   93    HA   ALA  13           HA       ALA  13  50.950   8.637   4.088
   94    HB1  ALA  13           HB1      ALA  13  51.718  10.922   4.254
   95    HB2  ALA  13           HB2      ALA  13  49.955  11.062   4.457
   96    HB3  ALA  13           HB3      ALA  13  50.703  11.441   2.887
   97    H    LYS  14           HN       LYS  14  50.136   8.599   1.018
   98    HA   LYS  14           HA       LYS  14  47.056   8.302   1.476
   99    HB2  LYS  14           HB2      LYS  14  48.165  10.011  -0.173
  100    HB3  LYS  14           HB1      LYS  14  48.681   8.544  -1.082
  101    HG2  LYS  14           HG2      LYS  14  46.536   8.194  -1.917
  102    HG3  LYS  14           HG1      LYS  14  45.736   8.667  -0.401
  103    HD2  LYS  14           HD2      LYS  14  46.112  11.051  -0.934
  104    HD3  LYS  14           HD1      LYS  14  46.960  10.591  -2.430
  105    HE2  LYS  14           HE2      LYS  14  44.089   9.789  -1.803
  106    HE3  LYS  14           HE1      LYS  14  44.526  11.224  -2.759
  107    HZ1  LYS  14           HZ1      LYS  14  45.707   8.639  -3.498
  108    HZ2  LYS  14           HZ2      LYS  14  45.288   9.961  -4.479
  109    HZ3  LYS  14           HZ3      LYS  14  44.081   8.916  -3.895
  110    H    HIS  15           HN       HIS  15  46.391   6.976  -0.692
  111    HA   HIS  15           HA       HIS  15  46.008   4.719  -1.214
  112    HB2  HIS  15           HB2      HIS  15  48.870   5.296  -2.063
  113    HB3  HIS  15           HB1      HIS  15  47.966   3.852  -2.580
  114    HD1  HIS  15           HD1      HIS  15  45.175   5.633  -2.625
  115    HD2  HIS  15           HD2      HIS  15  48.707   6.209  -4.829
  116    HE1  HIS  15           HE1      HIS  15  44.571   7.026  -4.680
  117    H    ILE  16           HN       ILE  16  47.261   5.229   1.528
  118    HA   ILE  16           HA       ILE  16  47.298   2.717   2.460
  119    HB   ILE  16           HB       ILE  16  49.233   1.988   1.286
  120   HG12  ILE  16          HG12      ILE  16  50.487   2.866   3.913
  121   HG13  ILE  16          HG11      ILE  16  49.162   1.683   3.909
  122   HG21  ILE  16          HG21      ILE  16  51.402   3.371   1.442
  123   HG22  ILE  16          HG22      ILE  16  50.416   4.670   2.116
  124   HG23  ILE  16          HG23      ILE  16  50.124   4.115   0.459
  125   HD11  ILE  16           HD1      ILE  16  51.193   0.410   3.875
  126   HD12  ILE  16           HD2      ILE  16  51.898   1.416   2.592
  127   HD13  ILE  16           HD3      ILE  16  50.544   0.323   2.223
  128    H    GLY  17           HN       GLY  17  48.837   5.647   2.599
  129    HA2  GLY  17           HA1      GLY  17  48.802   5.713   5.544
  130    HA3  GLY  17           HA2      GLY  17  49.216   7.059   4.463
  131    H    HIS  18           HN       HIS  18  46.758   5.967   2.824
  132    HA   HIS  18           HA       HIS  18  44.761   7.696   4.287
  133    HB2  HIS  18           HB2      HIS  18  45.210   6.841   1.447
  134    HB3  HIS  18           HB1      HIS  18  43.509   6.945   1.944
  135    HD1  HIS  18           HD1      HIS  18  46.053   9.258   3.503
  136    HD2  HIS  18           HD2      HIS  18  43.149   9.364   0.461
  137    HE1  HIS  18           HE1      HIS  18  45.720  11.707   2.854
  138    H    ALA  19           HN       ALA  19  45.137   4.375   2.885
  139    HA   ALA  19           HA       ALA  19  43.823   3.025   4.963
  140    HB1  ALA  19           HB1      ALA  19  41.725   4.048   4.751
  141    HB2  ALA  19           HB2      ALA  19  41.521   2.650   3.676
  142    HB3  ALA  19           HB3      ALA  19  41.889   4.252   2.991
  143    H    ALA  20           HN       ALA  20  45.488   3.135   2.220
  144    HA   ALA  20           HA       ALA  20  46.224   1.521   0.718
  145    HB1  ALA  20           HB1      ALA  20  44.852  -0.567   2.440
  146    HB2  ALA  20           HB2      ALA  20  46.369   0.219   2.939
  147    HB3  ALA  20           HB3      ALA  20  46.313  -0.738   1.439
  148    H    VAL  21           HN       VAL  21  43.255   2.517   1.109
  149    HA   VAL  21           HA       VAL  21  42.230   1.126  -1.315
  150    HB   VAL  21           HB       VAL  21  40.620   1.399   1.265
  151   HG11  VAL  21          HG11      VAL  21  39.031  -0.132  -0.150
  152   HG12  VAL  21          HG12      VAL  21  39.973   0.437  -1.548
  153   HG13  VAL  21          HG13      VAL  21  39.086   1.601  -0.536
  154   HG21  VAL  21          HG21      VAL  21  42.243  -0.409   1.503
  155   HG22  VAL  21          HG22      VAL  21  41.838  -1.041  -0.110
  156   HG23  VAL  21          HG23      VAL  21  40.648  -1.132   1.211
  157    H    ASN  22           HN       ASN  22  42.840   3.761   0.633
  158    HA   ASN  22           HA       ASN  22  42.646   6.029  -0.051
  159    HB2  ASN  22           HB2      ASN  22  40.026   5.404  -1.455
  160    HB3  ASN  22           HB1      ASN  22  41.033   6.859  -1.590
  161   HD21  ASN  22          HD21      ASN  22  43.598   5.264  -1.646
  162   HD22  ASN  22          HD22      ASN  22  43.653   4.562  -3.267
  163    H    HIS  23           HN       HIS  23  39.925   4.024   0.922
  164    HA   HIS  23           HA       HIS  23  39.542   5.541   3.349
  165    HB2  HIS  23           HB2      HIS  23  37.167   6.287   2.778
  166    HB3  HIS  23           HB1      HIS  23  38.478   7.215   2.010
  167    HD1  HIS  23           HD1      HIS  23  38.027   3.835   0.579
  168    HD2  HIS  23           HD2      HIS  23  36.534   7.699  -0.147
  169    HE1  HIS  23           HE1      HIS  23  36.921   3.805  -1.723
  170    H    TYR  24           HN       TYR  24  36.506   4.655   2.191
  171    HA   TYR  24           HA       TYR  24  35.126   2.850   2.585
  172    HB2  TYR  24           HB2      TYR  24  36.941   1.671   1.204
  173    HB3  TYR  24           HB1      TYR  24  37.597   1.086   2.750
  174    HD1  TYR  24           HD1      TYR  24  34.776   0.886   0.368
  175    HD2  TYR  24           HD2      TYR  24  36.327  -0.488   4.156
  176    HE1  TYR  24           HE1      TYR  24  33.073  -0.934   0.406
  177    HE2  TYR  24           HE2      TYR  24  34.626  -2.308   4.192
  178    HH   TYR  24           HH       TYR  24  33.019  -3.322   1.507
  179    H    LEU  25           HN       LEU  25  37.443   3.922   4.764
  180    HA   LEU  25           HA       LEU  25  35.857   3.101   7.024
  181    HB2  LEU  25           HB2      LEU  25  37.831   1.747   8.093
  182    HB3  LEU  25           HB1      LEU  25  36.753   0.928   6.943
  183    HG   LEU  25           HG       LEU  25  38.374   1.308   5.117
  184   HD11  LEU  25          HD11      LEU  25  39.883   2.786   7.306
  185   HD12  LEU  25          HD12      LEU  25  39.490   3.334   5.659
  186   HD13  LEU  25          HD13      LEU  25  40.736   2.092   5.906
  187   HD21  LEU  25          HD21      LEU  25  40.147  -0.211   5.958
  188   HD22  LEU  25          HD22      LEU  25  38.536  -0.740   6.499
  189   HD23  LEU  25          HD23      LEU  25  39.620   0.104   7.630