*HEADER    UNKNOWN FUNCTION                        21-AUG-14   2MTM              
*TITLE     NMR STRUCTURE OF RCB-1 PEPTIDE                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN;                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 44-62;                                        
*COMPND   5 SYNONYM: STABLE PEPTIDE BIOMARKER RCB-1;                             
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: RICINUS COMMUNIS;                               
*SOURCE   4 ORGANISM_COMMON: CASTOR BEAN;                                        
*SOURCE   5 ORGANISM_TAXID: 3988                                                 
*KEYWDS    BIOMARKER, NATURAL PRODUCT, UNKNOWN FUNCTION                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    15                                                                    
*AUTHOR    D.BOLDBAATAR, H.R.ELSEEDI                                             
*REVDAT   1   02-SEP-15 2MTM    0                                                



#    2 R  -93.636  134.629   14.882   10.973    0.616 0.746 25 13 Strong
   2   ARG  PHI    -123.4   -63.9
   2   ARG  PSI     112.7   156.6

#    3 c  -68.199  128.596    6.700    4.926    0.551 0.819 25 14 Strong
   3   CYSS  PHI     -88.2   -48.2
   3   CYSS  PSI     108.6   148.6

#    5 L  -98.319  129.955   29.977   13.480    0.588 0.845 25 14 Strong
   5   LEU  PHI    -158.3   -38.4
   5   LEU  PSI     103.0   156.9

#    6 V -112.859  127.564    8.021   13.900    0.558 0.836 25 15 Strong
   6   VAL  PHI    -132.9   -92.9
   6   VAL  PSI      99.8   155.4

#    7 M  -74.884  132.684   14.701   12.057    0.683 0.826 25 13 Strong
   7   MET  PHI    -104.3   -45.5
   7   MET  PSI     108.6   156.8

#    8 P  -68.359  149.938    7.343   10.451    0.623 0.851 25 13 Strong
   #8   PRO  PHI     -88.4   -48.4
   #8   PRO  PSI     129.0   170.8

#    9 V -123.181  147.668   21.667   12.337    0.794 0.857 25 11 Strong
   9   VAL  PHI    -166.5   -79.8
   9   VAL  PSI     123.0   172.3

#   10 P  -59.214  142.243    7.784   11.222    0.955 0.813 25 11 Strong
  #10   PRO  PHI     -79.2   -39.2
  10   PRO  PSI     119.8   164.7

#   12 F  -69.195  -15.444    9.001   26.398    0.928 0.747 25 13 Strong
  12   PHE  PHI     -89.2   -49.2
  12   PHE  PSI     -68.2    37.4

#   14 c  -64.359  129.589    7.602    4.930    0.762 0.777 25 15 Strong
  14   CYSS  PHI     -84.4   -44.4
  14   CYSS  PSI     109.6   149.6

#   16 K -145.190  137.798   12.387   10.218    0.593 0.708 25 14 Strong
  16   LYS  PHI    -170.0  -120.4
  16   LYS  PSI     117.4   158.2

#   17 F  -91.424  125.053   21.986   10.092    0.583 0.670 25 13 Strong
  17   PHE  PHI    -135.4   -47.5
  17   PHE  PSI     104.9   145.2

#   18 c  -67.931  145.701    7.033   10.026    0.702 0.641 25 13 Strong
  18   CYSS  PHI     -87.9   -47.9
  18   CYSS  PSI     125.6   165.8

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           H        ALA   1   1.807  -0.001   0.855
    2    HA   ALA   1           HA       ALA   1   1.760   0.835  -1.839
    3    HB1  ALA   1           HB1      ALA   1   4.139  -0.593  -1.440
    4    HB2  ALA   1           HB2      ALA   1   3.894   1.150  -1.319
    5    HB3  ALA   1           HB3      ALA   1   3.740   0.135   0.116
    6    H    ARG   2           H        ARG   2   3.147  -0.693  -3.439
    7    HA   ARG   2           HA       ARG   2   1.754  -3.289  -3.503
    8    HB2  ARG   2           HB2      ARG   2   2.568  -1.740  -5.956
    9    HB3  ARG   2           HB3      ARG   2   1.485  -3.121  -5.855
   10    HG2  ARG   2           HG2      ARG   2  -0.186  -1.789  -4.744
   11    HG3  ARG   2           HG3      ARG   2   0.911  -0.408  -4.685
   12    HD2  ARG   2           HD2      ARG   2   0.749  -0.016  -6.961
   13    HD3  ARG   2           HD3      ARG   2   0.237  -1.667  -7.310
   14    HE   ARG   2           HE       ARG   2  -1.439   0.554  -6.598
   15   HH11  ARG   2          HH11      ARG   2  -1.142  -2.915  -6.601
   16   HH12  ARG   2          HH12      ARG   2  -2.852  -3.192  -6.571
   17   HH21  ARG   2          HH21      ARG   2  -3.692   0.202  -6.559
   18   HH22  ARG   2          HH22      ARG   2  -4.302  -1.418  -6.548
   19    H    CYS   3           H        CYS   3   2.916  -5.076  -4.125
   20    HA   CYS   3           HA       CYS   3   5.623  -5.194  -3.565
   21    HB2  CYS   3           HB2      CYS   3   4.172  -7.171  -3.622
   22    HB3  CYS   3           HB3      CYS   3   4.027  -7.023  -5.370
   23    H    CYS   4           H        CYS   4   7.466  -4.884  -4.679
   24    HA   CYS   4           HA       CYS   4   7.209  -3.922  -7.444
   25    HB2  CYS   4           HB2      CYS   4   8.349  -2.633  -5.389
   26    HB3  CYS   4           HB3      CYS   4   9.745  -3.557  -5.937
   27    H    LEU   5           H        LEU   5   9.024  -6.126  -5.373
   28    HA   LEU   5           HA       LEU   5   9.688  -7.730  -7.709
   29    HB2  LEU   5           HB2      LEU   5  11.545  -5.984  -6.965
   30    HB3  LEU   5           HB3      LEU   5  11.912  -7.254  -5.800
   31    HG   LEU   5           HG       LEU   5  11.997  -8.787  -7.905
   32   HD11  LEU   5          HD11      LEU   5  12.172  -6.029  -9.064
   33   HD12  LEU   5          HD12      LEU   5  11.229  -7.411  -9.620
   34   HD13  LEU   5          HD13      LEU   5  12.980  -7.398  -9.827
   35   HD21  LEU   5          HD21      LEU   5  14.074  -8.775  -7.104
   36   HD22  LEU   5          HD22      LEU   5  13.944  -7.095  -6.583
   37   HD23  LEU   5          HD23      LEU   5  14.409  -7.471  -8.243
   38    H    VAL   6           H        VAL   6   8.756  -9.590  -7.144
   39    HA   VAL   6           HA       VAL   6   8.925 -10.517  -4.374
   40    HB   VAL   6           HB       VAL   6   6.713 -10.558  -5.428
   41   HG11  VAL   6          HG11      VAL   6   6.424 -11.186  -7.536
   42   HG12  VAL   6          HG12      VAL   6   8.147 -11.550  -7.651
   43   HG13  VAL   6          HG13      VAL   6   7.010 -12.805  -7.159
   44   HG21  VAL   6          HG21      VAL   6   6.073 -12.572  -4.528
   45   HG22  VAL   6          HG22      VAL   6   7.461 -13.435  -5.189
   46   HG23  VAL   6          HG23      VAL   6   7.664 -12.378  -3.792
   47    H    MET   7           H        MET   7   9.754 -12.538  -3.808
   48    HA   MET   7           HA       MET   7  11.648 -13.648  -5.759
   49    HB2  MET   7           HB2      MET   7  12.807 -14.609  -3.802
   50    HB3  MET   7           HB3      MET   7  12.685 -12.857  -3.713
   51    HG2  MET   7           HG2      MET   7  10.643 -13.216  -2.259
   52    HG3  MET   7           HG3      MET   7  11.132 -14.907  -2.171
   53    HE1  MET   7           HE1      MET   7  12.180 -11.970   0.807
   54    HE2  MET   7           HE2      MET   7  11.033 -11.780  -0.520
   55    HE3  MET   7           HE3      MET   7  10.869 -13.132   0.601
   56    HA   PRO   8           HA       PRO   8   9.074 -17.234  -6.088
   57    HB2  PRO   8           HB2      PRO   8  10.860 -18.816  -7.384
   58    HB3  PRO   8           HB3      PRO   8   9.990 -17.499  -8.178
   59    HG2  PRO   8           HG2      PRO   8  12.780 -17.543  -7.095
   60    HG3  PRO   8           HG3      PRO   8  12.182 -16.860  -8.618
   61    HD2  PRO   8           HD2      PRO   8  12.690 -15.337  -6.438
   62    HD3  PRO   8           HD3      PRO   8  11.406 -14.943  -7.599
   63    H    VAL   9           H        VAL   9  11.957 -16.989  -4.293
   64    HA   VAL   9           HA       VAL   9  11.697 -19.717  -3.239
   65    HB   VAL   9           HB       VAL   9  13.887 -19.479  -2.305
   66   HG11  VAL   9          HG11      VAL   9  13.623 -19.906  -4.785
   67   HG12  VAL   9          HG12      VAL   9  14.058 -18.213  -5.029
   68   HG13  VAL   9          HG13      VAL   9  15.201 -19.317  -4.263
   69   HG21  VAL   9          HG21      VAL   9  14.552 -17.500  -1.545
   70   HG22  VAL   9          HG22      VAL   9  14.843 -17.006  -3.213
   71   HG23  VAL   9          HG23      VAL   9  13.286 -16.672  -2.453
   72    HA   PRO  10           HA       PRO  10   9.904 -18.363   0.536
   73    HB2  PRO  10           HB2      PRO  10  10.897 -20.217   2.253
   74    HB3  PRO  10           HB3      PRO  10   9.647 -20.586   1.060
   75    HG2  PRO  10           HG2      PRO  10  12.594 -21.092   0.933
   76    HG3  PRO  10           HG3      PRO  10  11.256 -22.153   0.459
   77    HD2  PRO  10           HD2      PRO  10  12.684 -20.719  -1.339
   78    HD3  PRO  10           HD3      PRO  10  10.963 -21.090  -1.565
   79    HA   PRO  11           HA       PRO  11   9.275 -17.391   2.176
   80    HB2  PRO  11           HB2      PRO  11   9.096 -14.710   2.564
   81    HB3  PRO  11           HB3      PRO  11   9.454 -15.847   3.868
   82    HG2  PRO  11           HG2      PRO  11  11.327 -14.133   2.283
   83    HG3  PRO  11           HG3      PRO  11  11.308 -14.452   4.027
   84    HD2  PRO  11           HD2      PRO  11  13.008 -15.708   2.336
   85    HD3  PRO  11           HD3      PRO  11  12.363 -16.488   3.795
   86    H    PHE  12           H        PHE  12   7.940 -17.240   0.485
   87    HA   PHE  12           HA       PHE  12   8.847 -16.255  -2.025
   88    HB2  PHE  12           HB2      PHE  12   6.024 -16.997  -1.234
   89    HB3  PHE  12           HB3      PHE  12   6.672 -16.909  -2.868
   90    HD1  PHE  12           HD2      PHE  12   8.144 -18.638  -3.719
   91    HD2  PHE  12           HD1      PHE  12   6.517 -18.861   0.208
   92    HE1  PHE  12           HE2      PHE  12   8.772 -21.014  -3.597
   93    HE2  PHE  12           HE1      PHE  12   7.143 -21.237   0.336
   94    HZ   PHE  12           HZ       PHE  12   8.271 -22.317  -1.568
   95    H    ALA  13           H        ALA  13   7.735 -14.645   0.634
   96    HA   ALA  13           HA       ALA  13   5.930 -12.757  -0.310
   97    HB1  ALA  13           HB1      ALA  13   6.749 -11.312   1.517
   98    HB2  ALA  13           HB2      ALA  13   6.429 -12.965   2.042
   99    HB3  ALA  13           HB3      ALA  13   8.088 -12.432   1.770
  100    H    CYS  14           H        CYS  14   6.721 -10.271  -0.225
  101    HA   CYS  14           HA       CYS  14   8.367  -9.988  -2.592
  102    HB2  CYS  14           HB2      CYS  14   6.177  -8.713  -2.053
  103    HB3  CYS  14           HB3      CYS  14   7.192  -7.706  -1.026
  104    H    VAL  15           H        VAL  15  10.240  -8.710  -2.735
  105    HA   VAL  15           HA       VAL  15  11.735  -8.541  -0.217
  106    HB   VAL  15           HB       VAL  15  12.763  -8.407  -3.056
  107   HG11  VAL  15          HG11      VAL  15  14.186  -8.525  -0.402
  108   HG12  VAL  15          HG12      VAL  15  14.972  -8.782  -1.961
  109   HG13  VAL  15          HG13      VAL  15  14.238  -7.221  -1.588
  110   HG21  VAL  15          HG21      VAL  15  13.467 -10.660  -2.813
  111   HG22  VAL  15          HG22      VAL  15  13.046 -10.680  -1.101
  112   HG23  VAL  15          HG23      VAL  15  11.774 -10.607  -2.321
  113    H    LYS  16           H        LYS  16  10.695  -6.628  -2.979
  114    HA   LYS  16           HA       LYS  16  11.467  -4.204  -1.502
  115    HB2  LYS  16           HB2      LYS  16  12.916  -4.878  -3.578
  116    HB3  LYS  16           HB3      LYS  16  11.552  -4.256  -4.497
  117    HG2  LYS  16           HG2      LYS  16  12.907  -2.409  -4.358
  118    HG3  LYS  16           HG3      LYS  16  11.828  -2.161  -2.984
  119    HD2  LYS  16           HD2      LYS  16  14.010  -1.721  -2.188
  120    HD3  LYS  16           HD3      LYS  16  13.581  -3.318  -1.570
  121    HE2  LYS  16           HE2      LYS  16  14.898  -4.391  -3.261
  122    HE3  LYS  16           HE3      LYS  16  15.187  -2.857  -4.078
  123    HZ1  LYS  16           HZ1      LYS  16  17.105  -3.489  -2.790
  124    HZ2  LYS  16           HZ2      LYS  16  16.175  -3.619  -1.384
  125    HZ3  LYS  16           HZ3      LYS  16  16.405  -2.107  -2.108
  126    H    PHE  17           H        PHE  17   9.779  -2.946  -1.103
  127    HA   PHE  17           HA       PHE  17   7.305  -3.364  -2.592
  128    HB2  PHE  17           HB2      PHE  17   7.971  -2.626   0.111
  129    HB3  PHE  17           HB3      PHE  17   6.908  -1.413  -0.595
  130    HD1  PHE  17           HD2      PHE  17   7.054  -5.106  -1.053
  131    HD2  PHE  17           HD1      PHE  17   4.806  -1.749   0.284
  132    HE1  PHE  17           HE2      PHE  17   5.119  -6.569  -0.644
  133    HE2  PHE  17           HE1      PHE  17   2.868  -3.206   0.697
  134    HZ   PHE  17           HZ       PHE  17   3.022  -5.620   0.232
  135    H    CYS  18           H        CYS  18   6.505  -1.961  -4.026
  136    HA   CYS  18           HA       CYS  18   8.062   0.409  -4.654
  137    HB2  CYS  18           HB2      CYS  18   6.282  -1.373  -6.089
  138    HB3  CYS  18           HB3      CYS  18   5.846   0.311  -6.360
  139    H    SER  19           H        SER  19   7.516   2.431  -4.145
  140    HA   SER  19           HA       SER  19   5.191   2.897  -2.511
  141    HB2  SER  19           HB2      SER  19   7.524   3.975  -2.256
  142    HB3  SER  19           HB3      SER  19   7.021   5.046  -3.564
  143    HG   SER  19           HG       SER  19   6.524   5.961  -1.554
  Start of MODEL    2
    1    H1   ALA   1           H        ALA   1   1.056   0.909   0.215
    2    HA   ALA   1           HA       ALA   1   2.716   1.041  -2.018
    3    HB1  ALA   1           HB1      ALA   1   4.070   0.858  -0.244
    4    HB2  ALA   1           HB2      ALA   1   2.887  -0.065   0.686
    5    HB3  ALA   1           HB3      ALA   1   3.912  -0.881  -0.496
    6    H    ARG   2           H        ARG   2   3.450  -0.459  -3.501
    7    HA   ARG   2           HA       ARG   2   1.948  -2.991  -3.628
    8    HB2  ARG   2           HB2      ARG   2   2.850  -1.349  -5.999
    9    HB3  ARG   2           HB3      ARG   2   1.874  -2.811  -6.037
   10    HG2  ARG   2           HG2      ARG   2   0.966  -0.314  -4.641
   11    HG3  ARG   2           HG3      ARG   2   0.665  -0.608  -6.355
   12    HD2  ARG   2           HD2      ARG   2  -0.191  -2.410  -4.092
   13    HD3  ARG   2           HD3      ARG   2  -1.236  -1.271  -4.941
   14    HE   ARG   2           HE       ARG   2   0.033  -3.110  -6.719
   15   HH11  ARG   2          HH11      ARG   2  -2.615  -2.723  -4.492
   16   HH12  ARG   2          HH12      ARG   2  -3.602  -3.925  -5.254
   17   HH21  ARG   2          HH21      ARG   2  -1.258  -4.695  -7.731
   18   HH22  ARG   2          HH22      ARG   2  -2.829  -5.047  -7.096
   19    H    CYS   3           H        CYS   3   3.039  -4.800  -4.460
   20    HA   CYS   3           HA       CYS   3   5.724  -5.057  -3.738
   21    HB2  CYS   3           HB2      CYS   3   4.114  -6.943  -3.961
   22    HB3  CYS   3           HB3      CYS   3   4.200  -6.771  -5.711
   23    H    CYS   4           H        CYS   4   7.608  -4.732  -4.762
   24    HA   CYS   4           HA       CYS   4   7.488  -3.716  -7.517
   25    HB2  CYS   4           HB2      CYS   4   8.557  -2.484  -5.388
   26    HB3  CYS   4           HB3      CYS   4   9.961  -3.417  -5.897
   27    H    LEU   5           H        LEU   5   9.038  -6.072  -5.432
   28    HA   LEU   5           HA       LEU   5   9.802  -7.632  -7.745
   29    HB2  LEU   5           HB2      LEU   5  11.682  -5.971  -7.159
   30    HB3  LEU   5           HB3      LEU   5  11.949  -6.998  -5.752
   31    HG   LEU   5           HG       LEU   5  12.053  -8.870  -7.655
   32   HD11  LEU   5          HD11      LEU   5  13.612  -7.528  -9.394
   33   HD12  LEU   5          HD12      LEU   5  12.403  -6.295  -9.038
   34   HD13  LEU   5          HD13      LEU   5  11.902  -7.866  -9.663
   35   HD21  LEU   5          HD21      LEU   5  14.574  -7.400  -7.511
   36   HD22  LEU   5          HD22      LEU   5  14.183  -9.040  -6.992
   37   HD23  LEU   5          HD23      LEU   5  13.817  -7.672  -5.941
   38    H    VAL   6           H        VAL   6   8.828  -9.477  -7.200
   39    HA   VAL   6           HA       VAL   6   8.932 -10.411  -4.429
   40    HB   VAL   6           HB       VAL   6   6.742 -10.408  -5.551
   41   HG11  VAL   6          HG11      VAL   6   6.486 -11.094  -7.646
   42   HG12  VAL   6          HG12      VAL   6   8.211 -11.463  -7.713
   43   HG13  VAL   6          HG13      VAL   6   7.060 -12.706  -7.220
   44   HG21  VAL   6          HG21      VAL   6   6.051 -12.592  -4.865
   45   HG22  VAL   6          HG22      VAL   6   7.685 -13.228  -5.053
   46   HG23  VAL   6          HG23      VAL   6   7.333 -12.065  -3.774
   47    H    MET   7           H        MET   7   9.699 -12.460  -3.857
   48    HA   MET   7           HA       MET   7  11.627 -13.586  -5.766
   49    HB2  MET   7           HB2      MET   7  12.722 -14.578  -3.792
   50    HB3  MET   7           HB3      MET   7  12.614 -12.826  -3.679
   51    HG2  MET   7           HG2      MET   7  10.523 -13.196  -2.290
   52    HG3  MET   7           HG3      MET   7  11.008 -14.888  -2.209
   53    HE1  MET   7           HE1      MET   7  10.638 -13.126   0.535
   54    HE2  MET   7           HE2      MET   7  11.972 -12.018   0.855
   55    HE3  MET   7           HE3      MET   7  10.907 -11.742  -0.524
   56    HA   PRO   8           HA       PRO   8   9.000 -17.122  -6.198
   57    HB2  PRO   8           HB2      PRO   8  10.792 -18.724  -7.461
   58    HB3  PRO   8           HB3      PRO   8   9.967 -17.384  -8.266
   59    HG2  PRO   8           HG2      PRO   8  12.726 -17.488  -7.108
   60    HG3  PRO   8           HG3      PRO   8  12.181 -16.780  -8.640
   61    HD2  PRO   8           HD2      PRO   8  12.657 -15.286  -6.432
   62    HD3  PRO   8           HD3      PRO   8  11.412 -14.859  -7.624
   63    H    VAL   9           H        VAL   9  11.867 -16.963  -4.351
   64    HA   VAL   9           HA       VAL   9  11.524 -19.690  -3.324
   65    HB   VAL   9           HB       VAL   9  13.691 -19.500  -2.334
   66   HG11  VAL   9          HG11      VAL   9  13.277 -19.516  -5.010
   67   HG12  VAL   9          HG12      VAL   9  14.373 -18.142  -4.849
   68   HG13  VAL   9          HG13      VAL   9  14.852 -19.729  -4.247
   69   HG21  VAL   9          HG21      VAL   9  14.713 -17.031  -3.162
   70   HG22  VAL   9          HG22      VAL   9  13.136 -16.679  -2.456
   71   HG23  VAL   9          HG23      VAL   9  14.351 -17.541  -1.513
   72    HA   PRO  10           HA       PRO  10   9.650 -18.356   0.419
   73    HB2  PRO  10           HB2      PRO  10  10.577 -20.239   2.141
   74    HB3  PRO  10           HB3      PRO  10   9.354 -20.581   0.912
   75    HG2  PRO  10           HG2      PRO  10  12.299 -21.119   0.857
   76    HG3  PRO  10           HG3      PRO  10  10.961 -22.161   0.337
   77    HD2  PRO  10           HD2      PRO  10  12.453 -20.725  -1.408
   78    HD3  PRO  10           HD3      PRO  10  10.734 -21.073  -1.683
   79    HA   PRO  11           HA       PRO  11   8.989 -17.396   2.054
   80    HB2  PRO  11           HB2      PRO  11   8.830 -14.718   2.467
   81    HB3  PRO  11           HB3      PRO  11   9.142 -15.873   3.768
   82    HG2  PRO  11           HG2      PRO  11  11.073 -14.162   2.250
   83    HG3  PRO  11           HG3      PRO  11  11.005 -14.500   3.990
   84    HD2  PRO  11           HD2      PRO  11  12.735 -15.756   2.328
   85    HD3  PRO  11           HD3      PRO  11  12.044 -16.545   3.761
   86    H    PHE  12           H        PHE  12   7.695 -17.205   0.335
   87    HA   PHE  12           HA       PHE  12   8.676 -16.209  -2.142
   88    HB2  PHE  12           HB2      PHE  12   5.781 -16.791  -1.553
   89    HB3  PHE  12           HB3      PHE  12   6.638 -16.948  -3.082
   90    HD1  PHE  12           HD2      PHE  12   8.575 -18.690  -3.117
   91    HD2  PHE  12           HD1      PHE  12   5.417 -18.664  -0.263
   92    HE1  PHE  12           HE2      PHE  12   8.987 -21.070  -2.644
   93    HE2  PHE  12           HE1      PHE  12   5.824 -21.043   0.215
   94    HZ   PHE  12           HZ       PHE  12   7.612 -22.249  -0.975
   95    H    ALA  13           H        ALA  13   7.526 -14.608   0.506
   96    HA   ALA  13           HA       ALA  13   5.773 -12.683  -0.461
   97    HB1  ALA  13           HB1      ALA  13   7.467 -13.014   1.868
   98    HB2  ALA  13           HB2      ALA  13   7.327 -11.324   1.381
   99    HB3  ALA  13           HB3      ALA  13   5.876 -12.267   1.724
  100    H    CYS  14           H        CYS  14   6.600 -10.210  -0.331
  101    HA   CYS  14           HA       CYS  14   8.304  -9.929  -2.657
  102    HB2  CYS  14           HB2      CYS  14   6.125  -8.624  -2.158
  103    HB3  CYS  14           HB3      CYS  14   7.127  -7.649  -1.089
  104    H    VAL  15           H        VAL  15  10.200  -8.679  -2.745
  105    HA   VAL  15           HA       VAL  15  11.644  -8.568  -0.194
  106    HB   VAL  15           HB       VAL  15  12.743  -8.388  -3.003
  107   HG11  VAL  15          HG11      VAL  15  14.100  -7.283  -1.244
  108   HG12  VAL  15          HG12      VAL  15  14.192  -8.828  -0.395
  109   HG13  VAL  15          HG13      VAL  15  14.911  -8.656  -1.996
  110   HG21  VAL  15          HG21      VAL  15  13.411 -10.668  -2.787
  111   HG22  VAL  15          HG22      VAL  15  12.877 -10.726  -1.107
  112   HG23  VAL  15          HG23      VAL  15  11.691 -10.582  -2.404
  113    H    LYS  16           H        LYS  16  10.766  -6.601  -2.987
  114    HA   LYS  16           HA       LYS  16  11.481  -4.208  -1.432
  115    HB2  LYS  16           HB2      LYS  16  13.178  -4.569  -3.170
  116    HB3  LYS  16           HB3      LYS  16  11.919  -4.609  -4.397
  117    HG2  LYS  16           HG2      LYS  16  12.699  -2.459  -4.593
  118    HG3  LYS  16           HG3      LYS  16  11.335  -2.242  -3.493
  119    HD2  LYS  16           HD2      LYS  16  12.953  -1.053  -2.385
  120    HD3  LYS  16           HD3      LYS  16  13.179  -2.646  -1.658
  121    HE2  LYS  16           HE2      LYS  16  15.344  -2.026  -2.191
  122    HE3  LYS  16           HE3      LYS  16  14.878  -3.009  -3.578
  123    HZ1  LYS  16           HZ1      LYS  16  14.209  -0.250  -3.924
  124    HZ2  LYS  16           HZ2      LYS  16  15.090  -1.279  -4.937
  125    HZ3  LYS  16           HZ3      LYS  16  15.867  -0.471  -3.670
  126    H    PHE  17           H        PHE  17   9.816  -2.888  -1.142
  127    HA   PHE  17           HA       PHE  17   7.446  -3.222  -2.834
  128    HB2  PHE  17           HB2      PHE  17   7.901  -2.260  -0.043
  129    HB3  PHE  17           HB3      PHE  17   6.497  -1.662  -0.921
  130    HD1  PHE  17           HD1      PHE  17   4.875  -3.361  -1.877
  131    HD2  PHE  17           HD2      PHE  17   7.874  -4.355   0.975
  132    HE1  PHE  17           HE1      PHE  17   3.640  -5.409  -1.298
  133    HE2  PHE  17           HE2      PHE  17   6.644  -6.405   1.559
  134    HZ   PHE  17           HZ       PHE  17   4.524  -6.934   0.423
  135    H    CYS  18           H        CYS  18   6.720  -1.658  -4.152
  136    HA   CYS  18           HA       CYS  18   8.364   0.714  -4.477
  137    HB2  CYS  18           HB2      CYS  18   6.485  -0.817  -6.134
  138    HB3  CYS  18           HB3      CYS  18   6.355   0.927  -6.336
  139    H    SER  19           H        SER  19   7.812   2.728  -3.904
  140    HA   SER  19           HA       SER  19   5.309   3.088  -2.452
  141    HB2  SER  19           HB2      SER  19   6.287   5.133  -1.602
  142    HB3  SER  19           HB3      SER  19   7.478   3.840  -1.463
  143    HG   SER  19           HG       SER  19   8.729   5.098  -2.574
  Start of MODEL    3
    1    H1   ALA   1           H        ALA   1   0.948   0.233   0.094
    2    HA   ALA   1           HA       ALA   1   2.794   1.053  -2.044
    3    HB1  ALA   1           HB1      ALA   1   3.881  -0.962  -0.311
    4    HB2  ALA   1           HB2      ALA   1   4.453   0.679  -0.617
    5    HB3  ALA   1           HB3      ALA   1   3.249   0.384   0.638
    6    H    ARG   2           H        ARG   2   3.640  -0.485  -3.481
    7    HA   ARG   2           HA       ARG   2   2.162  -3.031  -3.593
    8    HB2  ARG   2           HB2      ARG   2   3.107  -1.480  -6.002
    9    HB3  ARG   2           HB3      ARG   2   2.049  -2.884  -5.977
   10    HG2  ARG   2           HG2      ARG   2   1.335  -0.226  -4.762
   11    HG3  ARG   2           HG3      ARG   2   0.899  -0.716  -6.401
   12    HD2  ARG   2           HD2      ARG   2   0.219  -2.559  -4.175
   13    HD3  ARG   2           HD3      ARG   2  -0.726  -1.079  -4.331
   14    HE   ARG   2           HE       ARG   2  -0.543  -2.364  -6.833
   15   HH11  ARG   2          HH11      ARG   2  -2.071  -2.685  -3.722
   16   HH12  ARG   2          HH12      ARG   2  -3.442  -3.547  -4.338
   17   HH21  ARG   2          HH21      ARG   2  -2.342  -3.499  -7.657
   18   HH22  ARG   2          HH22      ARG   2  -3.594  -4.011  -6.577
   19    H    CYS   3           H        CYS   3   3.276  -4.816  -4.548
   20    HA   CYS   3           HA       CYS   3   5.979  -5.020  -3.753
   21    HB2  CYS   3           HB2      CYS   3   4.513  -6.968  -3.805
   22    HB3  CYS   3           HB3      CYS   3   4.335  -6.815  -5.550
   23    H    CYS   4           H        CYS   4   7.863  -4.870  -4.859
   24    HA   CYS   4           HA       CYS   4   7.681  -3.924  -7.642
   25    HB2  CYS   4           HB2      CYS   4   8.814  -2.633  -5.538
   26    HB3  CYS   4           HB3      CYS   4  10.205  -3.515  -6.160
   27    H    LEU   5           H        LEU   5   9.356  -6.115  -5.459
   28    HA   LEU   5           HA       LEU   5  10.136  -7.748  -7.740
   29    HB2  LEU   5           HB2      LEU   5  11.984  -6.061  -6.974
   30    HB3  LEU   5           HB3      LEU   5  12.212  -7.216  -5.662
   31    HG   LEU   5           HG       LEU   5  12.401  -8.931  -7.656
   32   HD11  LEU   5          HD11      LEU   5  12.113  -7.808  -9.600
   33   HD12  LEU   5          HD12      LEU   5  13.839  -7.510  -9.398
   34   HD13  LEU   5          HD13      LEU   5  12.671  -6.275  -8.928
   35   HD21  LEU   5          HD21      LEU   5  14.813  -7.236  -7.383
   36   HD22  LEU   5          HD22      LEU   5  14.625  -8.981  -7.209
   37   HD23  LEU   5          HD23      LEU   5  14.128  -7.904  -5.902
   38    H    VAL   6           H        VAL   6   9.044  -9.540  -7.206
   39    HA   VAL   6           HA       VAL   6   9.057 -10.478  -4.438
   40    HB   VAL   6           HB       VAL   6   6.899 -10.436  -5.594
   41   HG11  VAL   6          HG11      VAL   6   6.697 -11.034  -7.721
   42   HG12  VAL   6          HG12      VAL   6   8.402 -11.486  -7.749
   43   HG13  VAL   6          HG13      VAL   6   7.178 -12.683  -7.321
   44   HG21  VAL   6          HG21      VAL   6   6.163 -12.346  -4.624
   45   HG22  VAL   6          HG22      VAL   6   7.397 -13.344  -5.394
   46   HG23  VAL   6          HG23      VAL   6   7.805 -12.373  -3.979
   47    H    MET   7           H        MET   7   9.776 -12.530  -3.832
   48    HA   MET   7           HA       MET   7  11.720 -13.716  -5.688
   49    HB2  MET   7           HB2      MET   7  12.740 -14.721  -3.675
   50    HB3  MET   7           HB3      MET   7  12.684 -12.965  -3.591
   51    HG2  MET   7           HG2      MET   7  10.558 -13.241  -2.242
   52    HG3  MET   7           HG3      MET   7  10.973 -14.950  -2.132
   53    HE1  MET   7           HE1      MET   7  10.654 -13.152   0.637
   54    HE2  MET   7           HE2      MET   7  11.995 -12.033   0.881
   55    HE3  MET   7           HE3      MET   7  10.910 -11.823  -0.495
   56    HA   PRO   8           HA       PRO   8   9.028 -17.198  -6.151
   57    HB2  PRO   8           HB2      PRO   8  10.814 -18.850  -7.357
   58    HB3  PRO   8           HB3      PRO   8  10.038 -17.500  -8.193
   59    HG2  PRO   8           HG2      PRO   8  12.765 -17.653  -6.968
   60    HG3  PRO   8           HG3      PRO   8  12.273 -16.948  -8.519
   61    HD2  PRO   8           HD2      PRO   8  12.729 -15.444  -6.314
   62    HD3  PRO   8           HD3      PRO   8  11.523 -15.001  -7.538
   63    H    VAL   9           H        VAL   9  11.823 -17.065  -4.212
   64    HA   VAL   9           HA       VAL   9  11.401 -19.780  -3.175
   65    HB   VAL   9           HB       VAL   9  13.549 -19.631  -2.134
   66   HG11  VAL   9          HG11      VAL   9  14.074 -18.325  -4.771
   67   HG12  VAL   9          HG12      VAL   9  14.898 -19.687  -4.008
   68   HG13  VAL   9          HG13      VAL   9  13.295 -19.906  -4.710
   69   HG21  VAL   9          HG21      VAL   9  14.935 -17.594  -2.278
   70   HG22  VAL   9          HG22      VAL   9  13.568 -16.738  -2.992
   71   HG23  VAL   9          HG23      VAL   9  13.462 -17.346  -1.340
   72    HA   PRO  10           HA       PRO  10   9.474 -18.353   0.505
   73    HB2  PRO  10           HB2      PRO  10  10.304 -20.243   2.268
   74    HB3  PRO  10           HB3      PRO  10   9.102 -20.562   1.012
   75    HG2  PRO  10           HG2      PRO  10  12.030 -21.186   1.035
   76    HG3  PRO  10           HG3      PRO  10  10.676 -22.194   0.492
   77    HD2  PRO  10           HD2      PRO  10  12.250 -20.819  -1.229
   78    HD3  PRO  10           HD3      PRO  10  10.529 -21.121  -1.542
   79    HA   PRO  11           HA       PRO  11   8.801 -17.355   2.113
   80    HB2  PRO  11           HB2      PRO  11   8.710 -14.669   2.494
   81    HB3  PRO  11           HB3      PRO  11   8.956 -15.819   3.814
   82    HG2  PRO  11           HG2      PRO  11  10.974 -14.181   2.328
   83    HG3  PRO  11           HG3      PRO  11  10.853 -14.498   4.068
   84    HD2  PRO  11           HD2      PRO  11  12.586 -15.822   2.464
   85    HD3  PRO  11           HD3      PRO  11  11.837 -16.574   3.887
   86    H    PHE  12           H        PHE  12   7.561 -17.152   0.356
   87    HA   PHE  12           HA       PHE  12   8.632 -16.205  -2.103
   88    HB2  PHE  12           HB2      PHE  12   5.746 -16.836  -1.458
   89    HB3  PHE  12           HB3      PHE  12   6.480 -16.774  -3.057
   90    HD1  PHE  12           HD2      PHE  12   7.924 -18.559  -3.835
   91    HD2  PHE  12           HD1      PHE  12   6.094 -18.718   0.004
   92    HE1  PHE  12           HE2      PHE  12   8.451 -20.958  -3.687
   93    HE2  PHE  12           HE1      PHE  12   6.619 -21.116   0.160
   94    HZ   PHE  12           HZ       PHE  12   7.800 -22.239  -1.687
   95    H    ALA  13           H        ALA  13   7.452 -14.551   0.498
   96    HA   ALA  13           HA       ALA  13   5.771 -12.595  -0.532
   97    HB1  ALA  13           HB1      ALA  13   6.639 -11.161   1.326
   98    HB2  ALA  13           HB2      ALA  13   6.084 -12.759   1.825
   99    HB3  ALA  13           HB3      ALA  13   7.810 -12.433   1.678
  100    H    CYS  14           H        CYS  14   6.649 -10.142  -0.411
  101    HA   CYS  14           HA       CYS  14   8.425  -9.927  -2.689
  102    HB2  CYS  14           HB2      CYS  14   6.262  -8.572  -2.285
  103    HB3  CYS  14           HB3      CYS  14   7.239  -7.608  -1.182
  104    H    VAL  15           H        VAL  15  10.347  -8.716  -2.737
  105    HA   VAL  15           HA       VAL  15  11.712  -8.590  -0.142
  106    HB   VAL  15           HB       VAL  15  12.892  -8.525  -2.924
  107   HG11  VAL  15          HG11      VAL  15  14.776  -9.306  -0.975
  108   HG12  VAL  15          HG12      VAL  15  14.768  -7.839  -1.956
  109   HG13  VAL  15          HG13      VAL  15  13.986  -7.848  -0.375
  110   HG21  VAL  15          HG21      VAL  15  13.001 -10.779  -0.933
  111   HG22  VAL  15          HG22      VAL  15  11.785 -10.679  -2.206
  112   HG23  VAL  15          HG23      VAL  15  13.494 -10.799  -2.626
  113    H    LYS  16           H        LYS  16  10.871  -6.659  -2.954
  114    HA   LYS  16           HA       LYS  16  11.650  -4.254  -1.453
  115    HB2  LYS  16           HB2      LYS  16  13.188  -5.025  -3.455
  116    HB3  LYS  16           HB3      LYS  16  11.925  -4.284  -4.429
  117    HG2  LYS  16           HG2      LYS  16  12.747  -2.573  -2.242
  118    HG3  LYS  16           HG3      LYS  16  14.096  -3.010  -3.293
  119    HD2  LYS  16           HD2      LYS  16  13.356  -1.689  -4.934
  120    HD3  LYS  16           HD3      LYS  16  11.718  -2.334  -4.809
  121    HE2  LYS  16           HE2      LYS  16  11.073  -0.741  -3.257
  122    HE3  LYS  16           HE3      LYS  16  12.730  -0.414  -2.753
  123    HZ1  LYS  16           HZ1      LYS  16  11.484   1.277  -4.237
  124    HZ2  LYS  16           HZ2      LYS  16  11.890   0.226  -5.499
  125    HZ3  LYS  16           HZ3      LYS  16  13.108   0.931  -4.561
  126    H    PHE  17           H        PHE  17   9.921  -3.041  -1.106
  127    HA   PHE  17           HA       PHE  17   7.618  -3.282  -2.896
  128    HB2  PHE  17           HB2      PHE  17   7.984  -2.339  -0.074
  129    HB3  PHE  17           HB3      PHE  17   6.573  -1.821  -0.990
  130    HD1  PHE  17           HD1      PHE  17   4.993  -3.540  -1.875
  131    HD2  PHE  17           HD2      PHE  17   8.118  -4.497   0.852
  132    HE1  PHE  17           HE1      PHE  17   3.855  -5.649  -1.316
  133    HE2  PHE  17           HE2      PHE  17   6.985  -6.607   1.415
  134    HZ   PHE  17           HZ       PHE  17   4.850  -7.185   0.332
  135    H    CYS  18           H        CYS  18   7.029  -1.716  -4.256
  136    HA   CYS  18           HA       CYS  18   8.644   0.695  -4.385
  137    HB2  CYS  18           HB2      CYS  18   6.886  -0.798  -6.226
  138    HB3  CYS  18           HB3      CYS  18   6.849   0.952  -6.413
  139    H    SER  19           H        SER  19   8.013   2.668  -3.769
  140    HA   SER  19           HA       SER  19   5.577   2.982  -2.308
  141    HB2  SER  19           HB2      SER  19   7.560   5.098  -3.179
  142    HB3  SER  19           HB3      SER  19   6.327   5.274  -1.930
  143    HG   SER  19           HG       SER  19   7.526   4.169  -0.577
  Start of MODEL    4
    1    H1   ALA   1           H        ALA   1   0.159  -0.433  -0.141
    2    HA   ALA   1           HA       ALA   1   2.432   0.467  -1.718
    3    HB1  ALA   1           HB1      ALA   1   2.698  -1.039   0.861
    4    HB2  ALA   1           HB2      ALA   1   3.914  -1.172  -0.410
    5    HB3  ALA   1           HB3      ALA   1   3.567   0.396   0.318
    6    H    ARG   2           H        ARG   2   3.022  -0.962  -3.293
    7    HA   ARG   2           HA       ARG   2   1.614  -3.550  -3.331
    8    HB2  ARG   2           HB2      ARG   2   1.202  -3.341  -5.656
    9    HB3  ARG   2           HB3      ARG   2   0.727  -1.806  -4.941
   10    HG2  ARG   2           HG2      ARG   2   3.268  -1.233  -5.568
   11    HG3  ARG   2           HG3      ARG   2   2.915  -2.430  -6.815
   12    HD2  ARG   2           HD2      ARG   2   2.416  -0.183  -7.607
   13    HD3  ARG   2           HD3      ARG   2   0.944  -1.147  -7.487
   14    HE   ARG   2           HE       ARG   2   1.305   0.288  -5.099
   15   HH11  ARG   2          HH11      ARG   2   0.512   0.802  -8.449
   16   HH12  ARG   2          HH12      ARG   2  -0.435   2.220  -8.143
   17   HH21  ARG   2          HH21      ARG   2   0.061   2.154  -4.682
   18   HH22  ARG   2          HH22      ARG   2  -0.690   2.989  -6.000
   19    H    CYS   3           H        CYS   3   2.767  -5.327  -3.916
   20    HA   CYS   3           HA       CYS   3   5.504  -5.415  -3.574
   21    HB2  CYS   3           HB2      CYS   3   4.101  -7.410  -3.473
   22    HB3  CYS   3           HB3      CYS   3   3.769  -7.287  -5.198
   23    H    CYS   4           H        CYS   4   7.263  -5.150  -4.835
   24    HA   CYS   4           HA       CYS   4   6.794  -4.276  -7.605
   25    HB2  CYS   4           HB2      CYS   4   8.067  -2.920  -5.619
   26    HB3  CYS   4           HB3      CYS   4   9.425  -3.740  -6.382
   27    H    LEU   5           H        LEU   5   8.737  -6.374  -5.560
   28    HA   LEU   5           HA       LEU   5   9.362  -8.020  -7.874
   29    HB2  LEU   5           HB2      LEU   5  11.243  -6.212  -6.776
   30    HB3  LEU   5           HB3      LEU   5  11.748  -7.839  -6.323
   31    HG   LEU   5           HG       LEU   5  11.036  -7.593  -9.145
   32   HD11  LEU   5          HD11      LEU   5  12.556  -6.074  -9.878
   33   HD12  LEU   5          HD12      LEU   5  13.627  -6.309  -8.497
   34   HD13  LEU   5          HD13      LEU   5  12.168  -5.335  -8.324
   35   HD21  LEU   5          HD21      LEU   5  13.125  -8.823  -7.433
   36   HD22  LEU   5          HD22      LEU   5  13.523  -8.516  -9.124
   37   HD23  LEU   5          HD23      LEU   5  12.143  -9.535  -8.713
   38    H    VAL   6           H        VAL   6   8.436  -9.850  -7.184
   39    HA   VAL   6           HA       VAL   6   8.772 -10.698  -4.409
   40    HB   VAL   6           HB       VAL   6   6.519 -10.822  -5.355
   41   HG11  VAL   6          HG11      VAL   6   6.776 -13.101  -7.044
   42   HG12  VAL   6          HG12      VAL   6   6.157 -11.496  -7.438
   43   HG13  VAL   6          HG13      VAL   6   7.877 -11.848  -7.615
   44   HG21  VAL   6          HG21      VAL   6   7.585 -13.610  -4.955
   45   HG22  VAL   6          HG22      VAL   6   7.346 -12.463  -3.637
   46   HG23  VAL   6          HG23      VAL   6   5.968 -13.007  -4.593
   47    H    MET   7           H        MET   7   9.669 -12.683  -3.817
   48    HA   MET   7           HA       MET   7  11.504 -13.813  -5.813
   49    HB2  MET   7           HB2      MET   7  12.764 -14.689  -3.878
   50    HB3  MET   7           HB3      MET   7  12.606 -12.938  -3.835
   51    HG2  MET   7           HG2      MET   7  10.635 -13.296  -2.287
   52    HG3  MET   7           HG3      MET   7  11.163 -14.973  -2.171
   53    HE1  MET   7           HE1      MET   7  12.274 -11.941   0.687
   54    HE2  MET   7           HE2      MET   7  11.106 -11.759  -0.622
   55    HE3  MET   7           HE3      MET   7  10.949 -13.093   0.521
   56    HA   PRO   8           HA       PRO   8   9.000 -17.460  -5.928
   57    HB2  PRO   8           HB2      PRO   8  10.765 -19.043  -7.250
   58    HB3  PRO   8           HB3      PRO   8   9.834 -17.769  -8.046
   59    HG2  PRO   8           HG2      PRO   8  12.667 -17.722  -7.079
   60    HG3  PRO   8           HG3      PRO   8  11.992 -17.097  -8.595
   61    HD2  PRO   8           HD2      PRO   8  12.555 -15.499  -6.483
   62    HD3  PRO   8           HD3      PRO   8  11.217 -15.168  -7.602
   63    H    VAL   9           H        VAL   9  11.945 -17.099  -4.261
   64    HA   VAL   9           HA       VAL   9  11.789 -19.799  -3.118
   65    HB   VAL   9           HB       VAL   9  14.009 -19.489  -2.285
   66   HG11  VAL   9          HG11      VAL   9  15.126 -19.646  -4.263
   67   HG12  VAL   9          HG12      VAL   9  13.473 -19.764  -4.870
   68   HG13  VAL   9          HG13      VAL   9  14.335 -18.227  -4.950
   69   HG21  VAL   9          HG21      VAL   9  15.248 -17.380  -2.612
   70   HG22  VAL   9          HG22      VAL   9  13.773 -16.631  -3.223
   71   HG23  VAL   9          HG23      VAL   9  13.853 -17.186  -1.551
   72    HA   PRO  10           HA       PRO  10  10.122 -18.370   0.687
   73    HB2  PRO  10           HB2      PRO  10  11.227 -20.148   2.416
   74    HB3  PRO  10           HB3      PRO  10   9.937 -20.580   1.287
   75    HG2  PRO  10           HG2      PRO  10  12.888 -21.026   1.053
   76    HG3  PRO  10           HG3      PRO  10  11.556 -22.130   0.667
   77    HD2  PRO  10           HD2      PRO  10  12.877 -20.721  -1.231
   78    HD3  PRO  10           HD3      PRO  10  11.156 -21.136  -1.374
   79    HA   PRO  11           HA       PRO  11   9.538 -17.361   2.321
   80    HB2  PRO  11           HB2      PRO  11   9.315 -14.673   2.635
   81    HB3  PRO  11           HB3      PRO  11   9.751 -15.762   3.958
   82    HG2  PRO  11           HG2      PRO  11  11.520 -14.058   2.246
   83    HG3  PRO  11           HG3      PRO  11  11.578 -14.323   3.998
   84    HD2  PRO  11           HD2      PRO  11  13.236 -15.594   2.276
   85    HD3  PRO  11           HD3      PRO  11  12.668 -16.342   3.783
   86    H    PHE  12           H        PHE  12   8.135 -17.293   0.682
   87    HA   PHE  12           HA       PHE  12   8.916 -16.367  -1.892
   88    HB2  PHE  12           HB2      PHE  12   6.145 -17.144  -0.962
   89    HB3  PHE  12           HB3      PHE  12   6.723 -17.092  -2.624
   90    HD1  PHE  12           HD2      PHE  12   8.197 -18.813  -3.485
   91    HD2  PHE  12           HD1      PHE  12   6.740 -18.953   0.512
   92    HE1  PHE  12           HE2      PHE  12   8.883 -21.170  -3.322
   93    HE2  PHE  12           HE1      PHE  12   7.424 -21.310   0.682
   94    HZ   PHE  12           HZ       PHE  12   8.498 -22.422  -1.236
   95    H    ALA  13           H        ALA  13   7.871 -14.701   0.762
   96    HA   ALA  13           HA       ALA  13   5.990 -12.880  -0.168
   97    HB1  ALA  13           HB1      ALA  13   8.217 -12.444   1.818
   98    HB2  ALA  13           HB2      ALA  13   6.839 -11.367   1.587
   99    HB3  ALA  13           HB3      ALA  13   6.585 -13.012   2.170
  100    H    CYS  14           H        CYS  14   6.726 -10.377  -0.187
  101    HA   CYS  14           HA       CYS  14   8.280 -10.131  -2.619
  102    HB2  CYS  14           HB2      CYS  14   6.080  -8.890  -2.038
  103    HB3  CYS  14           HB3      CYS  14   7.109  -7.827  -1.083
  104    H    VAL  15           H        VAL  15  10.129  -8.847  -2.868
  105    HA   VAL  15           HA       VAL  15  11.710  -8.571  -0.417
  106    HB   VAL  15           HB       VAL  15  12.604  -8.470  -3.302
  107   HG11  VAL  15          HG11      VAL  15  13.885  -7.577  -0.951
  108   HG12  VAL  15          HG12      VAL  15  14.690  -9.068  -1.447
  109   HG13  VAL  15          HG13      VAL  15  14.561  -7.717  -2.574
  110   HG21  VAL  15          HG21      VAL  15  13.385 -10.687  -3.047
  111   HG22  VAL  15          HG22      VAL  15  13.098 -10.669  -1.307
  112   HG23  VAL  15          HG23      VAL  15  11.735 -10.681  -2.426
  113    H    LYS  16           H        LYS  16  10.562  -6.732  -3.196
  114    HA   LYS  16           HA       LYS  16  11.257  -4.263  -1.758
  115    HB2  LYS  16           HB2      LYS  16  12.279  -5.150  -4.296
  116    HB3  LYS  16           HB3      LYS  16  11.334  -3.684  -4.520
  117    HG2  LYS  16           HG2      LYS  16  13.383  -3.819  -2.352
  118    HG3  LYS  16           HG3      LYS  16  13.872  -3.522  -4.022
  119    HD2  LYS  16           HD2      LYS  16  13.045  -1.430  -4.018
  120    HD3  LYS  16           HD3      LYS  16  11.607  -1.896  -3.106
  121    HE2  LYS  16           HE2      LYS  16  12.969  -1.953  -1.050
  122    HE3  LYS  16           HE3      LYS  16  14.364  -1.411  -1.982
  123    HZ1  LYS  16           HZ1      LYS  16  11.835   0.095  -1.589
  124    HZ2  LYS  16           HZ2      LYS  16  13.137   0.612  -2.537
  125    HZ3  LYS  16           HZ3      LYS  16  13.325   0.441  -0.865
  126    H    PHE  17           H        PHE  17   9.517  -3.072  -1.381
  127    HA   PHE  17           HA       PHE  17   7.109  -3.532  -2.982
  128    HB2  PHE  17           HB2      PHE  17   7.626  -2.513  -0.222
  129    HB3  PHE  17           HB3      PHE  17   6.159  -1.997  -1.048
  130    HD1  PHE  17           HD1      PHE  17   4.543  -3.742  -1.851
  131    HD2  PHE  17           HD2      PHE  17   7.790  -4.639   0.751
  132    HE1  PHE  17           HE1      PHE  17   3.436  -5.841  -1.200
  133    HE2  PHE  17           HE2      PHE  17   6.689  -6.740   1.405
  134    HZ   PHE  17           HZ       PHE  17   4.510  -7.344   0.429
  135    H    CYS  18           H        CYS  18   6.182  -1.992  -4.220
  136    HA   CYS  18           HA       CYS  18   7.721   0.424  -4.705
  137    HB2  CYS  18           HB2      CYS  18   5.744  -1.175  -6.179
  138    HB3  CYS  18           HB3      CYS  18   5.560   0.564  -6.387
  139    H    SER  19           H        SER  19   7.155   2.431  -4.116
  140    HA   SER  19           HA       SER  19   4.703   2.732  -2.540
  141    HB2  SER  19           HB2      SER  19   5.723   4.640  -1.524
  142    HB3  SER  19           HB3      SER  19   6.961   3.385  -1.590
  143    HG   SER  19           HG       SER  19   7.876   5.270  -2.325
  Start of MODEL    5
    1    H1   ALA   1           H        ALA   1   1.088   0.068   1.328
    2    HA   ALA   1           HA       ALA   1   2.304   0.372  -1.028
    3    HB1  ALA   1           HB1      ALA   1   4.045  -0.089   0.264
    4    HB2  ALA   1           HB2      ALA   1   3.004  -0.899   1.435
    5    HB3  ALA   1           HB3      ALA   1   3.689  -1.808   0.088
    6    H    ARG   2           H        ARG   2   3.021  -0.912  -2.768
    7    HA   ARG   2           HA       ARG   2   1.489  -3.398  -3.166
    8    HB2  ARG   2           HB2      ARG   2   1.523  -2.831  -5.609
    9    HB3  ARG   2           HB3      ARG   2   0.558  -1.744  -4.620
   10    HG2  ARG   2           HG2      ARG   2   1.850   0.028  -5.079
   11    HG3  ARG   2           HG3      ARG   2   3.343  -0.909  -4.993
   12    HD2  ARG   2           HD2      ARG   2   3.331  -0.457  -7.224
   13    HD3  ARG   2           HD3      ARG   2   2.379  -1.941  -7.236
   14    HE   ARG   2           HE       ARG   2   0.546   0.069  -6.938
   15   HH11  ARG   2          HH11      ARG   2   3.020  -0.713  -9.259
   16   HH12  ARG   2          HH12      ARG   2   2.187   0.020 -10.589
   17   HH21  ARG   2          HH21      ARG   2  -0.561   1.038  -8.681
   18   HH22  ARG   2          HH22      ARG   2   0.150   1.017 -10.259
   19    H    CYS   3           H        CYS   3   2.624  -5.167  -3.666
   20    HA   CYS   3           HA       CYS   3   5.367  -5.337  -3.423
   21    HB2  CYS   3           HB2      CYS   3   3.827  -7.269  -3.313
   22    HB3  CYS   3           HB3      CYS   3   3.589  -7.162  -5.054
   23    H    CYS   4           H        CYS   4   7.072  -4.989  -4.710
   24    HA   CYS   4           HA       CYS   4   6.536  -4.126  -7.468
   25    HB2  CYS   4           HB2      CYS   4   7.994  -2.907  -5.454
   26    HB3  CYS   4           HB3      CYS   4   9.235  -3.649  -6.459
   27    H    LEU   5           H        LEU   5   8.529  -6.272  -5.514
   28    HA   LEU   5           HA       LEU   5   8.997  -7.937  -7.848
   29    HB2  LEU   5           HB2      LEU   5  10.882  -6.224  -7.601
   30    HB3  LEU   5           HB3      LEU   5  11.342  -7.125  -6.158
   31    HG   LEU   5           HG       LEU   5  11.209  -9.102  -8.042
   32   HD11  LEU   5          HD11      LEU   5  12.789  -7.903  -9.817
   33   HD12  LEU   5          HD12      LEU   5  11.776  -6.526  -9.386
   34   HD13  LEU   5          HD13      LEU   5  11.039  -8.000 -10.016
   35   HD21  LEU   5          HD21      LEU   5  13.803  -8.537  -8.150
   36   HD22  LEU   5          HD22      LEU   5  13.046  -9.210  -6.706
   37   HD23  LEU   5          HD23      LEU   5  13.363  -7.477  -6.810
   38    H    VAL   6           H        VAL   6   8.178  -9.796  -7.131
   39    HA   VAL   6           HA       VAL   6   8.641 -10.611  -4.358
   40    HB   VAL   6           HB       VAL   6   6.335 -10.728  -5.166
   41   HG11  VAL   6          HG11      VAL   6   6.477 -13.014  -6.859
   42   HG12  VAL   6          HG12      VAL   6   5.845 -11.407  -7.221
   43   HG13  VAL   6          HG13      VAL   6   7.549 -11.770  -7.500
   44   HG21  VAL   6          HG21      VAL   6   7.579 -12.551  -3.657
   45   HG22  VAL   6          HG22      VAL   6   5.864 -12.649  -4.054
   46   HG23  VAL   6          HG23      VAL   6   7.036 -13.596  -4.969
   47    H    MET   7           H        MET   7   9.562 -12.596  -3.807
   48    HA   MET   7           HA       MET   7  11.272 -13.747  -5.899
   49    HB2  MET   7           HB2      MET   7  12.633 -14.624  -4.035
   50    HB3  MET   7           HB3      MET   7  12.488 -12.872  -3.989
   51    HG2  MET   7           HG2      MET   7  10.602 -13.217  -2.332
   52    HG3  MET   7           HG3      MET   7  11.132 -14.895  -2.240
   53    HE1  MET   7           HE1      MET   7  12.414 -11.866   0.550
   54    HE2  MET   7           HE2      MET   7  11.213 -11.634  -0.721
   55    HE3  MET   7           HE3      MET   7  11.046 -12.972   0.417
   56    HA   PRO   8           HA       PRO   8   8.740 -17.378  -5.859
   57    HB2  PRO   8           HB2      PRO   8  10.416 -18.975  -7.276
   58    HB3  PRO   8           HB3      PRO   8   9.449 -17.698  -8.021
   59    HG2  PRO   8           HG2      PRO   8  12.333 -17.666  -7.220
   60    HG3  PRO   8           HG3      PRO   8  11.575 -17.041  -8.696
   61    HD2  PRO   8           HD2      PRO   8  12.270 -15.441  -6.625
   62    HD3  PRO   8           HD3      PRO   8  10.870 -15.104  -7.665
   63    H    VAL   9           H        VAL   9  11.780 -17.031  -4.367
   64    HA   VAL   9           HA       VAL   9  11.675 -19.727  -3.209
   65    HB   VAL   9           HB       VAL   9  13.941 -19.428  -2.505
   66   HG11  VAL   9          HG11      VAL   9  13.789 -18.255  -5.274
   67   HG12  VAL   9          HG12      VAL   9  15.060 -19.274  -4.594
   68   HG13  VAL   9          HG13      VAL   9  13.464 -19.952  -4.921
   69   HG21  VAL   9          HG21      VAL   9  13.842 -17.125  -1.770
   70   HG22  VAL   9          HG22      VAL   9  15.171 -17.325  -2.913
   71   HG23  VAL   9          HG23      VAL   9  13.664 -16.571  -3.435
   72    HA   PRO  10           HA       PRO  10  10.238 -18.281   0.682
   73    HB2  PRO  10           HB2      PRO  10  11.430 -20.061   2.349
   74    HB3  PRO  10           HB3      PRO  10  10.076 -20.488   1.297
   75    HG2  PRO  10           HG2      PRO  10  13.006 -20.951   0.895
   76    HG3  PRO  10           HG3      PRO  10  11.647 -22.049   0.589
   77    HD2  PRO  10           HD2      PRO  10  12.864 -20.652  -1.386
   78    HD3  PRO  10           HD3      PRO  10  11.137 -21.057  -1.428
   79    HA   PRO  11           HA       PRO  11   9.754 -17.264   2.345
   80    HB2  PRO  11           HB2      PRO  11   9.564 -14.575   2.663
   81    HB3  PRO  11           HB3      PRO  11  10.070 -15.663   3.962
   82    HG2  PRO  11           HG2      PRO  11  11.746 -13.973   2.146
   83    HG3  PRO  11           HG3      PRO  11  11.903 -14.234   3.893
   84    HD2  PRO  11           HD2      PRO  11  13.453 -15.519   2.082
   85    HD3  PRO  11           HD3      PRO  11  12.969 -16.260   3.621
   86    H    PHE  12           H        PHE  12   8.258 -17.191   0.789
   87    HA   PHE  12           HA       PHE  12   8.895 -16.277  -1.828
   88    HB2  PHE  12           HB2      PHE  12   6.178 -17.034  -0.738
   89    HB3  PHE  12           HB3      PHE  12   6.660 -16.990  -2.430
   90    HD1  PHE  12           HD2      PHE  12   8.073 -18.722  -3.369
   91    HD2  PHE  12           HD1      PHE  12   6.843 -18.844   0.704
   92    HE1  PHE  12           HE2      PHE  12   8.753 -21.083  -3.237
   93    HE2  PHE  12           HE1      PHE  12   7.522 -21.204   0.842
   94    HZ   PHE  12           HZ       PHE  12   8.479 -22.327  -1.130
   95    H    ALA  13           H        ALA  13   8.017 -14.597   0.876
   96    HA   ALA  13           HA       ALA  13   6.095 -12.768   0.056
   97    HB1  ALA  13           HB1      ALA  13   8.074 -12.944   2.169
   98    HB2  ALA  13           HB2      ALA  13   7.808 -11.283   1.638
   99    HB3  ALA  13           HB3      ALA  13   6.449 -12.258   2.195
  100    H    CYS  14           H        CYS  14   6.835 -10.271  -0.025
  101    HA   CYS  14           HA       CYS  14   8.246 -10.044  -2.545
  102    HB2  CYS  14           HB2      CYS  14   6.084  -8.792  -1.827
  103    HB3  CYS  14           HB3      CYS  14   7.184  -7.718  -0.967
  104    H    VAL  15           H        VAL  15  10.086  -8.784  -2.910
  105    HA   VAL  15           HA       VAL  15  11.806  -8.491  -0.557
  106    HB   VAL  15           HB       VAL  15  12.539  -8.401  -3.487
  107   HG11  VAL  15          HG11      VAL  15  14.250  -8.458  -1.004
  108   HG12  VAL  15          HG12      VAL  15  14.854  -8.647  -2.651
  109   HG13  VAL  15          HG13      VAL  15  14.102  -7.131  -2.155
  110   HG21  VAL  15          HG21      VAL  15  13.328 -10.627  -3.265
  111   HG22  VAL  15          HG22      VAL  15  13.086 -10.613  -1.518
  112   HG23  VAL  15          HG23      VAL  15  11.694 -10.606  -2.601
  113    H    LYS  16           H        LYS  16  10.445  -6.664  -3.235
  114    HA   LYS  16           HA       LYS  16  11.268  -4.190  -1.877
  115    HB2  LYS  16           HB2      LYS  16  12.492  -4.965  -4.141
  116    HB3  LYS  16           HB3      LYS  16  11.108  -4.134  -4.840
  117    HG2  LYS  16           HG2      LYS  16  12.794  -2.519  -4.713
  118    HG3  LYS  16           HG3      LYS  16  11.726  -2.171  -3.351
  119    HD2  LYS  16           HD2      LYS  16  13.490  -3.898  -2.214
  120    HD3  LYS  16           HD3      LYS  16  14.524  -3.073  -3.383
  121    HE2  LYS  16           HE2      LYS  16  12.713  -1.411  -1.716
  122    HE3  LYS  16           HE3      LYS  16  14.119  -2.131  -0.932
  123    HZ1  LYS  16           HZ1      LYS  16  14.390   0.167  -1.944
  124    HZ2  LYS  16           HZ2      LYS  16  14.365  -0.602  -3.450
  125    HZ3  LYS  16           HZ3      LYS  16  15.572  -0.982  -2.327
  126    H    PHE  17           H        PHE  17   9.563  -3.000  -1.366
  127    HA   PHE  17           HA       PHE  17   7.049  -3.433  -2.812
  128    HB2  PHE  17           HB2      PHE  17   7.748  -2.603  -0.044
  129    HB3  PHE  17           HB3      PHE  17   6.282  -1.920  -0.738
  130    HD1  PHE  17           HD1      PHE  17   4.544  -3.532  -1.663
  131    HD2  PHE  17           HD2      PHE  17   7.753  -4.748   0.853
  132    HE1  PHE  17           HE1      PHE  17   3.319  -5.590  -1.102
  133    HE2  PHE  17           HE2      PHE  17   6.534  -6.809   1.418
  134    HZ   PHE  17           HZ       PHE  17   4.313  -7.232   0.441
  135    H    CYS  18           H        CYS  18   6.021  -1.837  -3.901
  136    HA   CYS  18           HA       CYS  18   7.536   0.587  -4.417
  137    HB2  CYS  18           HB2      CYS  18   5.378  -0.911  -5.766
  138    HB3  CYS  18           HB3      CYS  18   5.301   0.839  -5.940
  139    H    SER  19           H        SER  19   7.030   2.577  -3.718
  140    HA   SER  19           HA       SER  19   4.938   2.840  -1.741
  141    HB2  SER  19           HB2      SER  19   7.331   3.899  -1.726
  142    HB3  SER  19           HB3      SER  19   6.589   5.144  -2.730
  143    HG   SER  19           HG       SER  19   5.635   5.908  -1.026
  Start of MODEL    6
    1    H1   ALA   1           H        ALA   1   0.806   0.474  -0.146
    2    HA   ALA   1           HA       ALA   1   2.898   1.129  -2.113
    3    HB1  ALA   1           HB1      ALA   1   4.345   0.798  -0.466
    4    HB2  ALA   1           HB2      ALA   1   3.038   0.346   0.629
    5    HB3  ALA   1           HB3      ALA   1   3.821  -0.883  -0.365
    6    H    ARG   2           H        ARG   2   3.581  -0.397  -3.576
    7    HA   ARG   2           HA       ARG   2   2.055  -2.917  -3.644
    8    HB2  ARG   2           HB2      ARG   2   2.964  -1.347  -6.060
    9    HB3  ARG   2           HB3      ARG   2   1.951  -2.784  -6.049
   10    HG2  ARG   2           HG2      ARG   2   1.133  -0.210  -4.735
   11    HG3  ARG   2           HG3      ARG   2   0.774  -0.588  -6.421
   12    HD2  ARG   2           HD2      ARG   2   0.044  -2.507  -4.243
   13    HD3  ARG   2           HD3      ARG   2  -0.986  -1.119  -4.591
   14    HE   ARG   2           HE       ARG   2  -0.509  -2.371  -7.010
   15   HH11  ARG   2          HH11      ARG   2  -1.995  -3.159  -3.963
   16   HH12  ARG   2          HH12      ARG   2  -3.123  -4.278  -4.653
   17   HH21  ARG   2          HH21      ARG   2  -1.989  -3.842  -7.932
   18   HH22  ARG   2          HH22      ARG   2  -3.118  -4.666  -6.911
   19    H    CYS   3           H        CYS   3   3.123  -4.746  -4.497
   20    HA   CYS   3           HA       CYS   3   5.832  -4.984  -3.789
   21    HB2  CYS   3           HB2      CYS   3   4.300  -6.896  -3.813
   22    HB3  CYS   3           HB3      CYS   3   4.155  -6.771  -5.563
   23    H    CYS   4           H        CYS   4   7.668  -4.631  -4.867
   24    HA   CYS   4           HA       CYS   4   7.472  -3.749  -7.656
   25    HB2  CYS   4           HB2      CYS   4   8.708  -2.553  -5.562
   26    HB3  CYS   4           HB3      CYS   4  10.045  -3.488  -6.223
   27    H    LEU   5           H        LEU   5   9.069  -6.086  -5.578
   28    HA   LEU   5           HA       LEU   5   9.670  -7.731  -7.885
   29    HB2  LEU   5           HB2      LEU   5  11.635  -6.229  -7.615
   30    HB3  LEU   5           HB3      LEU   5  11.871  -6.899  -6.002
   31    HG   LEU   5           HG       LEU   5  11.814  -9.111  -7.705
   32   HD11  LEU   5          HD11      LEU   5  13.821  -7.233  -8.854
   33   HD12  LEU   5          HD12      LEU   5  12.167  -7.209  -9.465
   34   HD13  LEU   5          HD13      LEU   5  13.116  -8.693  -9.547
   35   HD21  LEU   5          HD21      LEU   5  13.823  -9.565  -6.741
   36   HD22  LEU   5          HD22      LEU   5  13.270  -8.305  -5.637
   37   HD23  LEU   5          HD23      LEU   5  14.412  -7.912  -6.923
   38    H    VAL   6           H        VAL   6   8.741  -9.575  -7.288
   39    HA   VAL   6           HA       VAL   6   8.881 -10.429  -4.491
   40    HB   VAL   6           HB       VAL   6   6.665 -10.433  -5.539
   41   HG11  VAL   6          HG11      VAL   6   6.875 -12.729  -7.208
   42   HG12  VAL   6          HG12      VAL   6   6.365 -11.095  -7.636
   43   HG13  VAL   6          HG13      VAL   6   8.069 -11.542  -7.732
   44   HG21  VAL   6          HG21      VAL   6   5.990 -12.654  -4.875
   45   HG22  VAL   6          HG22      VAL   6   7.647 -13.238  -5.019
   46   HG23  VAL   6          HG23      VAL   6   7.231 -12.067  -3.768
   47    H    MET   7           H        MET   7   9.639 -12.469  -3.881
   48    HA   MET   7           HA       MET   7  11.505 -13.673  -5.803
   49    HB2  MET   7           HB2      MET   7  12.623 -14.635  -3.819
   50    HB3  MET   7           HB3      MET   7  12.565 -12.878  -3.773
   51    HG2  MET   7           HG2      MET   7  10.463 -13.179  -2.342
   52    HG3  MET   7           HG3      MET   7  10.995 -14.849  -2.159
   53    HE1  MET   7           HE1      MET   7  13.993 -14.595  -2.310
   54    HE2  MET   7           HE2      MET   7  14.660 -14.136  -0.743
   55    HE3  MET   7           HE3      MET   7  13.497 -15.458  -0.853
   56    HA   PRO   8           HA       PRO   8   8.823 -17.184  -6.074
   57    HB2  PRO   8           HB2      PRO   8  10.561 -18.841  -7.340
   58    HB3  PRO   8           HB3      PRO   8   9.732 -17.512  -8.158
   59    HG2  PRO   8           HG2      PRO   8  12.518 -17.622  -7.070
   60    HG3  PRO   8           HG3      PRO   8  11.942 -16.947  -8.606
   61    HD2  PRO   8           HD2      PRO   8  12.495 -15.402  -6.452
   62    HD3  PRO   8           HD3      PRO   8  11.224 -14.990  -7.621
   63    H    VAL   9           H        VAL   9  11.720 -17.000  -4.289
   64    HA   VAL   9           HA       VAL   9  11.369 -19.697  -3.182
   65    HB   VAL   9           HB       VAL   9  13.568 -19.517  -2.259
   66   HG11  VAL   9          HG11      VAL   9  14.894 -19.390  -4.229
   67   HG12  VAL   9          HG12      VAL   9  13.312 -20.005  -4.711
   68   HG13  VAL   9          HG13      VAL   9  13.734 -18.320  -5.016
   69   HG21  VAL   9          HG21      VAL   9  13.063 -16.695  -2.458
   70   HG22  VAL   9          HG22      VAL   9  14.298 -17.546  -1.531
   71   HG23  VAL   9          HG23      VAL   9  14.608 -17.096  -3.208
   72    HA   PRO  10           HA       PRO  10   9.635 -18.215   0.572
   73    HB2  PRO  10           HB2      PRO  10  10.576 -20.065   2.323
   74    HB3  PRO  10           HB3      PRO  10   9.310 -20.417   1.140
   75    HG2  PRO  10           HG2      PRO  10  12.240 -21.019   1.015
   76    HG3  PRO  10           HG3      PRO  10  10.867 -22.047   0.566
   77    HD2  PRO  10           HD2      PRO  10  12.333 -20.694  -1.265
   78    HD3  PRO  10           HD3      PRO  10  10.600 -21.014  -1.478
   79    HA   PRO  11           HA       PRO  11   9.043 -17.196   2.199
   80    HB2  PRO  11           HB2      PRO  11   8.948 -14.504   2.539
   81    HB3  PRO  11           HB3      PRO  11   9.277 -15.629   3.863
   82    HG2  PRO  11           HG2      PRO  11  11.194 -14.000   2.239
   83    HG3  PRO  11           HG3      PRO  11  11.173 -14.287   3.988
   84    HD2  PRO  11           HD2      PRO  11  12.827 -15.625   2.312
   85    HD3  PRO  11           HD3      PRO  11  12.165 -16.358   3.788
   86    H    PHE  12           H        PHE  12   7.704 -17.033   0.513
   87    HA   PHE  12           HA       PHE  12   8.629 -16.120  -2.019
   88    HB2  PHE  12           HB2      PHE  12   5.789 -16.766  -1.206
   89    HB3  PHE  12           HB3      PHE  12   6.435 -16.728  -2.843
   90    HD1  PHE  12           HD2      PHE  12   7.856 -18.515  -3.662
   91    HD2  PHE  12           HD1      PHE  12   6.230 -18.616   0.270
   92    HE1  PHE  12           HE2      PHE  12   8.414 -20.905  -3.497
   93    HE2  PHE  12           HE1      PHE  12   6.787 -21.007   0.442
   94    HZ   PHE  12           HZ       PHE  12   7.879 -22.154  -1.443
   95    H    ALA  13           H        ALA  13   7.587 -14.430   0.614
   96    HA   ALA  13           HA       ALA  13   5.824 -12.510  -0.343
   97    HB1  ALA  13           HB1      ALA  13   6.136 -12.417   1.938
   98    HB2  ALA  13           HB2      ALA  13   7.893 -12.510   1.810
   99    HB3  ALA  13           HB3      ALA  13   7.057 -11.013   1.398
  100    H    CYS  14           H        CYS  14   6.679 -10.047  -0.329
  101    HA   CYS  14           HA       CYS  14   8.299  -9.860  -2.722
  102    HB2  CYS  14           HB2      CYS  14   6.160  -8.519  -2.229
  103    HB3  CYS  14           HB3      CYS  14   7.169  -7.538  -1.172
  104    H    VAL  15           H        VAL  15  10.242  -8.754  -2.917
  105    HA   VAL  15           HA       VAL  15  11.784  -8.575  -0.442
  106    HB   VAL  15           HB       VAL  15  12.788  -8.313  -3.277
  107   HG11  VAL  15          HG11      VAL  15  14.953  -8.600  -2.394
  108   HG12  VAL  15          HG12      VAL  15  14.169  -7.420  -1.342
  109   HG13  VAL  15          HG13      VAL  15  14.332  -9.098  -0.820
  110   HG21  VAL  15          HG21      VAL  15  13.602 -10.769  -2.275
  111   HG22  VAL  15          HG22      VAL  15  11.907 -10.645  -1.804
  112   HG23  VAL  15          HG23      VAL  15  12.364 -10.490  -3.500
  113    H    LYS  16           H        LYS  16  10.955  -6.599  -3.269
  114    HA   LYS  16           HA       LYS  16  11.672  -4.211  -1.698
  115    HB2  LYS  16           HB2      LYS  16  13.312  -4.559  -3.480
  116    HB3  LYS  16           HB3      LYS  16  12.022  -4.628  -4.673
  117    HG2  LYS  16           HG2      LYS  16  12.879  -2.475  -4.876
  118    HG3  LYS  16           HG3      LYS  16  11.424  -2.268  -3.899
  119    HD2  LYS  16           HD2      LYS  16  13.930  -2.770  -2.418
  120    HD3  LYS  16           HD3      LYS  16  13.815  -1.218  -3.250
  121    HE2  LYS  16           HE2      LYS  16  11.419  -1.217  -2.116
  122    HE3  LYS  16           HE3      LYS  16  12.231  -2.286  -0.973
  123    HZ1  LYS  16           HZ1      LYS  16  13.450  -0.613  -0.150
  124    HZ2  LYS  16           HZ2      LYS  16  12.255   0.383  -0.813
  125    HZ3  LYS  16           HZ3      LYS  16  13.696   0.114  -1.657
  126    H    PHE  17           H        PHE  17  10.033  -2.871  -1.356
  127    HA   PHE  17           HA       PHE  17   7.596  -3.195  -2.950
  128    HB2  PHE  17           HB2      PHE  17   8.182  -2.239  -0.189
  129    HB3  PHE  17           HB3      PHE  17   6.778  -1.565  -1.010
  130    HD1  PHE  17           HD1      PHE  17   5.069  -3.209  -1.961
  131    HD2  PHE  17           HD2      PHE  17   8.054  -4.300   0.869
  132    HE1  PHE  17           HE1      PHE  17   3.754  -5.195  -1.345
  133    HE2  PHE  17           HE2      PHE  17   6.744  -6.288   1.490
  134    HZ   PHE  17           HZ       PHE  17   4.592  -6.739   0.382
  135    H    CYS  18           H        CYS  18   6.858  -1.659  -4.286
  136    HA   CYS  18           HA       CYS  18   8.501   0.701  -4.695
  137    HB2  CYS  18           HB2      CYS  18   6.580  -0.856  -6.278
  138    HB3  CYS  18           HB3      CYS  18   6.444   0.885  -6.506
  139    H    SER  19           H        SER  19   7.947   2.744  -4.203
  140    HA   SER  19           HA       SER  19   5.438   3.134  -2.742
  141    HB2  SER  19           HB2      SER  19   8.056   4.610  -2.807
  142    HB3  SER  19           HB3      SER  19   6.603   5.387  -2.178
  143    HG   SER  19           HG       SER  19   7.711   4.369  -0.501
  Start of MODEL    7
    1    H1   ALA   1           H        ALA   1   1.198  -1.116   1.193
    2    HA   ALA   1           HA       ALA   1   2.010   0.676  -0.974
    3    HB1  ALA   1           HB1      ALA   1   4.200   0.581  -0.580
    4    HB2  ALA   1           HB2      ALA   1   3.785  -0.034   1.021
    5    HB3  ALA   1           HB3      ALA   1   4.151  -1.158  -0.288
    6    H    ARG   2           H        ARG   2   3.186  -0.722  -2.725
    7    HA   ARG   2           HA       ARG   2   1.650  -3.217  -3.038
    8    HB2  ARG   2           HB2      ARG   2   1.848  -2.792  -5.508
    9    HB3  ARG   2           HB3      ARG   2   0.846  -1.638  -4.637
   10    HG2  ARG   2           HG2      ARG   2   2.257   0.087  -5.019
   11    HG3  ARG   2           HG3      ARG   2   3.696  -0.933  -4.965
   12    HD2  ARG   2           HD2      ARG   2   3.230   0.007  -7.213
   13    HD3  ARG   2           HD3      ARG   2   3.264  -1.755  -7.179
   14    HE   ARG   2           HE       ARG   2   0.621  -0.938  -6.819
   15   HH11  ARG   2          HH11      ARG   2   3.091  -0.859  -9.271
   16   HH12  ARG   2          HH12      ARG   2   1.968  -0.886 -10.589
   17   HH21  ARG   2          HH21      ARG   2  -0.869  -0.975  -8.547
   18   HH22  ARG   2          HH22      ARG   2  -0.285  -0.951 -10.176
   19    H    CYS   3           H        CYS   3   2.670  -4.919  -4.269
   20    HA   CYS   3           HA       CYS   3   5.413  -5.266  -3.544
   21    HB2  CYS   3           HB2      CYS   3   3.683  -7.100  -3.642
   22    HB3  CYS   3           HB3      CYS   3   3.775  -7.001  -5.398
   23    H    CYS   4           H        CYS   4   7.161  -4.723  -4.661
   24    HA   CYS   4           HA       CYS   4   6.845  -3.825  -7.427
   25    HB2  CYS   4           HB2      CYS   4   8.167  -2.679  -5.352
   26    HB3  CYS   4           HB3      CYS   4   9.479  -3.575  -6.111
   27    H    LEU   5           H        LEU   5   8.511  -6.225  -5.489
   28    HA   LEU   5           HA       LEU   5   8.989  -7.838  -7.826
   29    HB2  LEU   5           HB2      LEU   5  10.929  -6.208  -7.663
   30    HB3  LEU   5           HB3      LEU   5  11.380  -7.050  -6.182
   31    HG   LEU   5           HG       LEU   5  11.167  -9.100  -7.999
   32   HD11  LEU   5          HD11      LEU   5  11.072  -8.042 -10.004
   33   HD12  LEU   5          HD12      LEU   5  12.821  -8.030  -9.784
   34   HD13  LEU   5          HD13      LEU   5  11.876  -6.590  -9.405
   35   HD21  LEU   5          HD21      LEU   5  13.242  -7.669  -6.561
   36   HD22  LEU   5          HD22      LEU   5  13.832  -8.370  -8.069
   37   HD23  LEU   5          HD23      LEU   5  13.059  -9.398  -6.861
   38    H    VAL   6           H        VAL   6   8.260  -9.739  -7.156
   39    HA   VAL   6           HA       VAL   6   8.681 -10.543  -4.368
   40    HB   VAL   6           HB       VAL   6   6.371 -10.629  -5.212
   41   HG11  VAL   6          HG11      VAL   6   6.536 -12.980  -6.824
   42   HG12  VAL   6          HG12      VAL   6   5.886 -11.392  -7.239
   43   HG13  VAL   6          HG13      VAL   6   7.596 -11.742  -7.497
   44   HG21  VAL   6          HG21      VAL   6   7.162 -12.183  -3.453
   45   HG22  VAL   6          HG22      VAL   6   5.834 -12.839  -4.411
   46   HG23  VAL   6          HG23      VAL   6   7.485 -13.385  -4.703
   47    H    MET   7           H        MET   7   9.557 -12.559  -3.825
   48    HA   MET   7           HA       MET   7  11.273 -13.710  -5.913
   49    HB2  MET   7           HB2      MET   7  12.616 -14.612  -4.054
   50    HB3  MET   7           HB3      MET   7  12.479 -12.860  -3.981
   51    HG2  MET   7           HG2      MET   7  10.555 -13.253  -2.354
   52    HG3  MET   7           HG3      MET   7  11.139 -14.913  -2.260
   53    HE1  MET   7           HE1      MET   7  12.273 -11.827   0.523
   54    HE2  MET   7           HE2      MET   7  10.978 -11.790  -0.673
   55    HE3  MET   7           HE3      MET   7  11.053 -13.101   0.506
   56    HA   PRO   8           HA       PRO   8   8.695 -17.309  -5.921
   57    HB2  PRO   8           HB2      PRO   8  10.359 -18.912  -7.347
   58    HB3  PRO   8           HB3      PRO   8   9.410 -17.616  -8.083
   59    HG2  PRO   8           HG2      PRO   8  12.291 -17.627  -7.268
   60    HG3  PRO   8           HG3      PRO   8  11.548 -16.978  -8.742
   61    HD2  PRO   8           HD2      PRO   8  12.251 -15.406  -6.652
   62    HD3  PRO   8           HD3      PRO   8  10.861 -15.043  -7.695
   63    H    VAL   9           H        VAL   9  11.770 -17.040  -4.454
   64    HA   VAL   9           HA       VAL   9  11.617 -19.737  -3.312
   65    HB   VAL   9           HB       VAL   9  13.882 -19.476  -2.604
   66   HG11  VAL   9          HG11      VAL   9  14.190 -18.160  -5.221
   67   HG12  VAL   9          HG12      VAL   9  14.827 -19.700  -4.640
   68   HG13  VAL   9          HG13      VAL   9  13.158 -19.590  -5.200
   69   HG21  VAL   9          HG21      VAL   9  13.631 -16.595  -3.459
   70   HG22  VAL   9          HG22      VAL   9  13.808 -17.193  -1.810
   71   HG23  VAL   9          HG23      VAL   9  15.133 -17.374  -2.960
   72    HA   PRO  10           HA       PRO  10  10.176 -18.328   0.592
   73    HB2  PRO  10           HB2      PRO  10  11.347 -20.140   2.240
   74    HB3  PRO  10           HB3      PRO  10   9.994 -20.542   1.178
   75    HG2  PRO  10           HG2      PRO  10  12.921 -21.025   0.781
   76    HG3  PRO  10           HG3      PRO  10  11.555 -22.107   0.456
   77    HD2  PRO  10           HD2      PRO  10  12.792 -20.695  -1.496
   78    HD3  PRO  10           HD3      PRO  10  11.061 -21.085  -1.550
   79    HA   PRO  11           HA       PRO  11   9.696 -17.337   2.272
   80    HB2  PRO  11           HB2      PRO  11   9.523 -14.651   2.632
   81    HB3  PRO  11           HB3      PRO  11  10.019 -15.763   3.914
   82    HG2  PRO  11           HG2      PRO  11  11.710 -14.056   2.128
   83    HG3  PRO  11           HG3      PRO  11  11.862 -14.345   3.871
   84    HD2  PRO  11           HD2      PRO  11  13.407 -15.612   2.043
   85    HD3  PRO  11           HD3      PRO  11  12.915 -16.373   3.570
   86    H    PHE  12           H        PHE  12   8.193 -17.214   0.725
   87    HA   PHE  12           HA       PHE  12   8.842 -16.273  -1.881
   88    HB2  PHE  12           HB2      PHE  12   6.053 -16.892  -0.928
   89    HB3  PHE  12           HB3      PHE  12   6.724 -17.081  -2.545
   90    HD1  PHE  12           HD2      PHE  12   8.685 -18.787  -2.759
   91    HD2  PHE  12           HD1      PHE  12   5.885 -18.730   0.447
   92    HE1  PHE  12           HE2      PHE  12   9.202 -21.142  -2.270
   93    HE2  PHE  12           HE1      PHE  12   6.399 -21.085   0.941
   94    HZ   PHE  12           HZ       PHE  12   8.058 -22.294  -0.418
   95    H    ALA  13           H        ALA  13   8.006 -14.613   0.841
   96    HA   ALA  13           HA       ALA  13   6.095 -12.755   0.066
   97    HB1  ALA  13           HB1      ALA  13   8.062 -11.421   1.631
   98    HB2  ALA  13           HB2      ALA  13   6.484 -12.036   2.127
   99    HB3  ALA  13           HB3      ALA  13   7.905 -13.078   2.218
  100    H    CYS  14           H        CYS  14   6.857 -10.267  -0.011
  101    HA   CYS  14           HA       CYS  14   8.226 -10.034  -2.553
  102    HB2  CYS  14           HB2      CYS  14   6.095  -8.763  -1.797
  103    HB3  CYS  14           HB3      CYS  14   7.213  -7.717  -0.927
  104    H    VAL  15           H        VAL  15  10.098  -8.856  -2.941
  105    HA   VAL  15           HA       VAL  15  11.870  -8.613  -0.632
  106    HB   VAL  15           HB       VAL  15  12.534  -8.388  -3.570
  107   HG11  VAL  15          HG11      VAL  15  14.366  -8.799  -1.211
  108   HG12  VAL  15          HG12      VAL  15  14.834  -8.586  -2.899
  109   HG13  VAL  15          HG13      VAL  15  14.099  -7.251  -2.011
  110   HG21  VAL  15          HG21      VAL  15  11.841 -10.666  -2.075
  111   HG22  VAL  15          HG22      VAL  15  12.532 -10.607  -3.696
  112   HG23  VAL  15          HG23      VAL  15  13.591 -10.723  -2.290
  113    H    LYS  16           H        LYS  16  10.631  -6.680  -3.326
  114    HA   LYS  16           HA       LYS  16  11.430  -4.262  -1.848
  115    HB2  LYS  16           HB2      LYS  16  12.902  -4.576  -3.790
  116    HB3  LYS  16           HB3      LYS  16  11.498  -4.651  -4.846
  117    HG2  LYS  16           HG2      LYS  16  12.123  -2.480  -5.144
  118    HG3  LYS  16           HG3      LYS  16  10.987  -2.296  -3.806
  119    HD2  LYS  16           HD2      LYS  16  13.787  -2.838  -3.052
  120    HD3  LYS  16           HD3      LYS  16  13.485  -1.274  -3.812
  121    HE2  LYS  16           HE2      LYS  16  11.661  -2.171  -1.639
  122    HE3  LYS  16           HE3      LYS  16  13.274  -1.613  -1.199
  123    HZ1  LYS  16           HZ1      LYS  16  12.600   0.466  -1.436
  124    HZ2  LYS  16           HZ2      LYS  16  11.036  -0.069  -1.793
  125    HZ3  LYS  16           HZ3      LYS  16  12.149   0.186  -3.042
  126    H    PHE  17           H        PHE  17   9.805  -2.925  -1.405
  127    HA   PHE  17           HA       PHE  17   7.241  -3.357  -2.765
  128    HB2  PHE  17           HB2      PHE  17   8.007  -2.349  -0.054
  129    HB3  PHE  17           HB3      PHE  17   6.475  -1.837  -0.754
  130    HD1  PHE  17           HD1      PHE  17   4.743  -3.517  -1.294
  131    HD2  PHE  17           HD2      PHE  17   8.309  -4.539   0.794
  132    HE1  PHE  17           HE1      PHE  17   3.698  -5.614  -0.543
  133    HE2  PHE  17           HE2      PHE  17   7.270  -6.638   1.547
  134    HZ   PHE  17           HZ       PHE  17   4.963  -7.179   0.879
  135    H    CYS  18           H        CYS  18   6.310  -1.817  -3.977
  136    HA   CYS  18           HA       CYS  18   7.836   0.598  -4.506
  137    HB2  CYS  18           HB2      CYS  18   5.723  -0.941  -5.890
  138    HB3  CYS  18           HB3      CYS  18   5.677   0.802  -6.131
  139    H    SER  19           H        SER  19   7.301   2.602  -3.878
  140    HA   SER  19           HA       SER  19   4.780   2.927  -2.390
  141    HB2  SER  19           HB2      SER  19   7.394   4.424  -2.081
  142    HB3  SER  19           HB3      SER  19   5.921   4.756  -1.169
  143    HG   SER  19           HG       SER  19   6.099   2.796  -0.171
  Start of MODEL    8
    1    H1   ALA   1           H        ALA   1   1.064   0.611   0.283
    2    HA   ALA   1           HA       ALA   1   2.505   0.992  -2.100
    3    HB1  ALA   1           HB1      ALA   1   4.291   0.547  -0.834
    4    HB2  ALA   1           HB2      ALA   1   3.154   0.475   0.513
    5    HB3  ALA   1           HB3      ALA   1   3.644  -1.007  -0.308
    6    H    ARG   2           H        ARG   2   3.460  -0.551  -3.515
    7    HA   ARG   2           HA       ARG   2   2.007  -3.111  -3.656
    8    HB2  ARG   2           HB2      ARG   2   2.985  -1.538  -6.039
    9    HB3  ARG   2           HB3      ARG   2   1.956  -2.964  -6.047
   10    HG2  ARG   2           HG2      ARG   2   1.151  -0.338  -4.823
   11    HG3  ARG   2           HG3      ARG   2   0.782  -0.805  -6.485
   12    HD2  ARG   2           HD2      ARG   2  -0.476  -2.720  -5.701
   13    HD3  ARG   2           HD3      ARG   2  -0.037  -2.357  -4.032
   14    HE   ARG   2           HE       ARG   2  -1.689  -0.776  -3.982
   15   HH11  ARG   2          HH11      ARG   2  -1.015  -1.610  -7.294
   16   HH12  ARG   2          HH12      ARG   2  -2.346  -0.701  -7.931
   17   HH21  ARG   2          HH21      ARG   2  -3.445   0.423  -4.808
   18   HH22  ARG   2          HH22      ARG   2  -3.727   0.455  -6.515
   19    H    CYS   3           H        CYS   3   3.155  -4.891  -4.566
   20    HA   CYS   3           HA       CYS   3   5.844  -5.067  -3.725
   21    HB2  CYS   3           HB2      CYS   3   4.373  -7.022  -3.805
   22    HB3  CYS   3           HB3      CYS   3   4.270  -6.889  -5.558
   23    H    CYS   4           H        CYS   4   7.715  -4.706  -4.749
   24    HA   CYS   4           HA       CYS   4   7.586  -3.810  -7.540
   25    HB2  CYS   4           HB2      CYS   4   8.662  -2.509  -5.465
   26    HB3  CYS   4           HB3      CYS   4  10.063  -3.471  -5.927
   27    H    LEU   5           H        LEU   5   9.159  -6.103  -5.401
   28    HA   LEU   5           HA       LEU   5   9.927  -7.708  -7.691
   29    HB2  LEU   5           HB2      LEU   5  11.803  -6.033  -7.009
   30    HB3  LEU   5           HB3      LEU   5  12.056  -7.148  -5.668
   31    HG   LEU   5           HG       LEU   5  12.058  -8.182  -8.473
   32   HD11  LEU   5          HD11      LEU   5  14.691  -7.823  -8.002
   33   HD12  LEU   5          HD12      LEU   5  14.030  -6.362  -7.268
   34   HD13  LEU   5          HD13      LEU   5  13.699  -6.724  -8.962
   35   HD21  LEU   5          HD21      LEU   5  13.421  -9.896  -7.564
   36   HD22  LEU   5          HD22      LEU   5  12.088  -9.658  -6.433
   37   HD23  LEU   5          HD23      LEU   5  13.681  -8.993  -6.071
   38    H    VAL   6           H        VAL   6   9.010  -9.582  -7.178
   39    HA   VAL   6           HA       VAL   6   9.024 -10.481  -4.388
   40    HB   VAL   6           HB       VAL   6   6.850 -10.478  -5.523
   41   HG11  VAL   6          HG11      VAL   6   7.138 -12.739  -7.225
   42   HG12  VAL   6          HG12      VAL   6   6.641 -11.099  -7.643
   43   HG13  VAL   6          HG13      VAL   6   8.349 -11.540  -7.678
   44   HG21  VAL   6          HG21      VAL   6   7.451 -13.373  -5.271
   45   HG22  VAL   6          HG22      VAL   6   7.761 -12.347  -3.870
   46   HG23  VAL   6          HG23      VAL   6   6.143 -12.422  -4.567
   47    H    MET   7           H        MET   7   9.770 -12.530  -3.790
   48    HA   MET   7           HA       MET   7  11.721 -13.681  -5.661
   49    HB2  MET   7           HB2      MET   7  12.765 -14.678  -3.653
   50    HB3  MET   7           HB3      MET   7  12.693 -12.923  -3.574
   51    HG2  MET   7           HG2      MET   7  10.527 -13.279  -2.240
   52    HG3  MET   7           HG3      MET   7  11.088 -14.940  -2.057
   53    HE1  MET   7           HE1      MET   7  12.607 -15.752  -0.458
   54    HE2  MET   7           HE2      MET   7  14.039 -15.127  -1.274
   55    HE3  MET   7           HE3      MET   7  13.821 -14.856   0.455
   56    HA   PRO   8           HA       PRO   8   9.074 -17.201  -6.111
   57    HB2  PRO   8           HB2      PRO   8  10.872 -18.819  -7.344
   58    HB3  PRO   8           HB3      PRO   8  10.065 -17.478  -8.165
   59    HG2  PRO   8           HG2      PRO   8  12.808 -17.594  -6.973
   60    HG3  PRO   8           HG3      PRO   8  12.287 -16.889  -8.515
   61    HD2  PRO   8           HD2      PRO   8  12.745 -15.388  -6.308
   62    HD3  PRO   8           HD3      PRO   8  11.517 -14.959  -7.517
   63    H    VAL   9           H        VAL   9  11.896 -17.036  -4.209
   64    HA   VAL   9           HA       VAL   9  11.525 -19.760  -3.177
   65    HB   VAL   9           HB       VAL   9  13.684 -19.582  -2.161
   66   HG11  VAL   9          HG11      VAL   9  13.371 -19.822  -4.756
   67   HG12  VAL   9          HG12      VAL   9  14.209 -18.269  -4.784
   68   HG13  VAL   9          HG13      VAL   9  14.981 -19.675  -4.051
   69   HG21  VAL   9          HG21      VAL   9  13.164 -16.759  -2.332
   70   HG22  VAL   9          HG22      VAL   9  14.364 -17.619  -1.367
   71   HG23  VAL   9          HG23      VAL   9  14.743 -17.137  -3.020
   72    HA   PRO  10           HA       PRO  10   9.631 -18.374   0.537
   73    HB2  PRO  10           HB2      PRO  10  10.517 -20.256   2.283
   74    HB3  PRO  10           HB3      PRO  10   9.302 -20.591   1.043
   75    HG2  PRO  10           HG2      PRO  10  12.240 -21.168   1.021
   76    HG3  PRO  10           HG3      PRO  10  10.894 -22.196   0.496
   77    HD2  PRO  10           HD2      PRO  10  12.421 -20.792  -1.245
   78    HD3  PRO  10           HD3      PRO  10  10.700 -21.120  -1.534
   79    HA   PRO  11           HA       PRO  11   8.967 -17.395   2.160
   80    HB2  PRO  11           HB2      PRO  11   8.837 -14.712   2.553
   81    HB3  PRO  11           HB3      PRO  11   9.122 -15.862   3.865
   82    HG2  PRO  11           HG2      PRO  11  11.089 -14.186   2.354
   83    HG3  PRO  11           HG3      PRO  11  11.000 -14.511   4.095
   84    HD2  PRO  11           HD2      PRO  11  12.730 -15.800   2.459
   85    HD3  PRO  11           HD3      PRO  11  12.016 -16.569   3.890
   86    H    PHE  12           H        PHE  12   7.695 -17.205   0.425
   87    HA   PHE  12           HA       PHE  12   8.713 -16.230  -2.047
   88    HB2  PHE  12           HB2      PHE  12   5.848 -16.915  -1.363
   89    HB3  PHE  12           HB3      PHE  12   6.560 -16.837  -2.972
   90    HD1  PHE  12           HD2      PHE  12   8.023 -18.595  -3.773
   91    HD2  PHE  12           HD1      PHE  12   6.248 -18.793   0.090
   92    HE1  PHE  12           HE2      PHE  12   8.594 -20.984  -3.637
   93    HE2  PHE  12           HE1      PHE  12   6.817 -21.182   0.233
   94    HZ   PHE  12           HZ       PHE  12   7.993 -22.281  -1.632
   95    H    ALA  13           H        ALA  13   7.557 -14.604   0.577
   96    HA   ALA  13           HA       ALA  13   5.815 -12.678  -0.406
   97    HB1  ALA  13           HB1      ALA  13   7.464 -13.024   1.934
   98    HB2  ALA  13           HB2      ALA  13   7.430 -11.335   1.426
   99    HB3  ALA  13           HB3      ALA  13   5.921 -12.187   1.759
  100    H    CYS  14           H        CYS  14   6.646 -10.210  -0.310
  101    HA   CYS  14           HA       CYS  14   8.355  -9.960  -2.636
  102    HB2  CYS  14           HB2      CYS  14   6.188  -8.647  -2.199
  103    HB3  CYS  14           HB3      CYS  14   7.146  -7.681  -1.082
  104    H    VAL  15           H        VAL  15  10.264  -8.746  -2.737
  105    HA   VAL  15           HA       VAL  15  11.712  -8.617  -0.194
  106    HB   VAL  15           HB       VAL  15  12.849  -8.336  -2.976
  107   HG11  VAL  15          HG11      VAL  15  14.151  -7.461  -1.000
  108   HG12  VAL  15          HG12      VAL  15  14.246  -9.128  -0.430
  109   HG13  VAL  15          HG13      VAL  15  14.969  -8.681  -1.975
  110   HG21  VAL  15          HG21      VAL  15  13.641 -10.790  -2.120
  111   HG22  VAL  15          HG22      VAL  15  12.004 -10.710  -1.469
  112   HG23  VAL  15          HG23      VAL  15  12.277 -10.499  -3.199
  113    H    LYS  16           H        LYS  16  10.917  -6.639  -3.019
  114    HA   LYS  16           HA       LYS  16  11.597  -4.251  -1.434
  115    HB2  LYS  16           HB2      LYS  16  12.805  -5.096  -3.839
  116    HB3  LYS  16           HB3      LYS  16  11.775  -3.733  -4.259
  117    HG2  LYS  16           HG2      LYS  16  13.599  -3.518  -1.911
  118    HG3  LYS  16           HG3      LYS  16  14.251  -3.352  -3.543
  119    HD2  LYS  16           HD2      LYS  16  11.826  -1.795  -2.746
  120    HD3  LYS  16           HD3      LYS  16  13.426  -1.243  -2.244
  121    HE2  LYS  16           HE2      LYS  16  14.039  -1.549  -4.744
  122    HE3  LYS  16           HE3      LYS  16  12.295  -1.521  -5.004
  123    HZ1  LYS  16           HZ1      LYS  16  13.881   0.657  -4.885
  124    HZ2  LYS  16           HZ2      LYS  16  13.255   0.604  -3.315
  125    HZ3  LYS  16           HZ3      LYS  16  12.207   0.666  -4.642
  126    H    PHE  17           H        PHE  17   9.892  -3.008  -1.071
  127    HA   PHE  17           HA       PHE  17   7.523  -3.310  -2.759
  128    HB2  PHE  17           HB2      PHE  17   8.011  -2.379   0.033
  129    HB3  PHE  17           HB3      PHE  17   6.610  -1.741  -0.821
  130    HD1  PHE  17           HD1      PHE  17   4.981  -3.430  -1.836
  131    HD2  PHE  17           HD2      PHE  17   7.919  -4.453   1.069
  132    HE1  PHE  17           HE1      PHE  17   3.714  -5.462  -1.275
  133    HE2  PHE  17           HE2      PHE  17   6.656  -6.487   1.635
  134    HZ   PHE  17           HZ       PHE  17   4.550  -6.994   0.463
  135    H    CYS  18           H        CYS  18   6.835  -1.774  -4.114
  136    HA   CYS  18           HA       CYS  18   8.439   0.631  -4.401
  137    HB2  CYS  18           HB2      CYS  18   6.553  -0.894  -6.092
  138    HB3  CYS  18           HB3      CYS  18   6.549   0.850  -6.333
  139    H    SER  19           H        SER  19   7.848   2.614  -3.784
  140    HA   SER  19           HA       SER  19   6.683   4.268  -2.736
  141    HB2  SER  19           HB2      SER  19   4.598   3.030  -4.520
  142    HB3  SER  19           HB3      SER  19   4.208   4.400  -3.481
  143    HG   SER  19           HG       SER  19   4.890   5.015  -5.605
  Start of MODEL    9
    1    H1   ALA   1           H        ALA   1   0.470   0.062   0.843
    2    HA   ALA   1           HA       ALA   1   1.798   0.522  -1.565
    3    HB1  ALA   1           HB1      ALA   1   3.054  -1.555   0.032
    4    HB2  ALA   1           HB2      ALA   1   3.622   0.068  -0.366
    5    HB3  ALA   1           HB3      ALA   1   2.534  -0.176   1.001
    6    H    ARG   2           H        ARG   2   2.734  -0.941  -3.085
    7    HA   ARG   2           HA       ARG   2   1.291  -3.499  -3.324
    8    HB2  ARG   2           HB2      ARG   2   1.276  -3.219  -5.745
    9    HB3  ARG   2           HB3      ARG   2   0.473  -1.861  -4.966
   10    HG2  ARG   2           HG2      ARG   2   3.359  -1.577  -5.579
   11    HG3  ARG   2           HG3      ARG   2   2.221  -1.541  -6.928
   12    HD2  ARG   2           HD2      ARG   2   1.613   0.111  -4.533
   13    HD3  ARG   2           HD3      ARG   2   2.902   0.652  -5.608
   14    HE   ARG   2           HE       ARG   2   0.079   0.670  -6.139
   15   HH11  ARG   2          HH11      ARG   2   3.257   0.602  -7.558
   16   HH12  ARG   2          HH12      ARG   2   2.742   1.287  -9.064
   17   HH21  ARG   2          HH21      ARG   2  -0.612   1.574  -8.117
   18   HH22  ARG   2          HH22      ARG   2   0.542   1.841  -9.380
   19    H    CYS   3           H        CYS   3   2.422  -5.189  -4.472
   20    HA   CYS   3           HA       CYS   3   5.160  -5.363  -3.708
   21    HB2  CYS   3           HB2      CYS   3   3.559  -7.298  -3.820
   22    HB3  CYS   3           HB3      CYS   3   3.651  -7.199  -5.576
   23    H    CYS   4           H        CYS   4   6.938  -4.848  -4.806
   24    HA   CYS   4           HA       CYS   4   6.639  -3.976  -7.591
   25    HB2  CYS   4           HB2      CYS   4   7.791  -2.675  -5.518
   26    HB3  CYS   4           HB3      CYS   4   9.195  -3.512  -6.172
   27    H    LEU   5           H        LEU   5   8.362  -6.229  -5.540
   28    HA   LEU   5           HA       LEU   5   9.070  -7.825  -7.834
   29    HB2  LEU   5           HB2      LEU   5  10.897  -6.014  -7.375
   30    HB3  LEU   5           HB3      LEU   5  11.350  -7.085  -6.051
   31    HG   LEU   5           HG       LEU   5  11.261  -7.884  -8.960
   32   HD11  LEU   5          HD11      LEU   5  13.179  -6.769  -9.136
   33   HD12  LEU   5          HD12      LEU   5  13.874  -7.998  -8.079
   34   HD13  LEU   5          HD13      LEU   5  13.269  -6.488  -7.397
   35   HD21  LEU   5          HD21      LEU   5  10.976  -9.846  -7.756
   36   HD22  LEU   5          HD22      LEU   5  11.990  -9.296  -6.422
   37   HD23  LEU   5          HD23      LEU   5  12.726  -9.762  -7.957
   38    H    VAL   6           H        VAL   6   8.352  -9.741  -7.186
   39    HA   VAL   6           HA       VAL   6   8.675 -10.529  -4.380
   40    HB   VAL   6           HB       VAL   6   6.409 -10.694  -5.329
   41   HG11  VAL   6          HG11      VAL   6   6.734 -13.045  -6.920
   42   HG12  VAL   6          HG12      VAL   6   6.040 -11.486  -7.369
   43   HG13  VAL   6          HG13      VAL   6   7.772 -11.766  -7.551
   44   HG21  VAL   6          HG21      VAL   6   7.102 -13.537  -4.993
   45   HG22  VAL   6          HG22      VAL   6   7.644 -12.461  -3.706
   46   HG23  VAL   6          HG23      VAL   6   5.933 -12.543  -4.125
   47    H    MET   7           H        MET   7   9.590 -12.518  -3.796
   48    HA   MET   7           HA       MET   7  11.440 -13.606  -5.803
   49    HB2  MET   7           HB2      MET   7  12.722 -14.468  -3.880
   50    HB3  MET   7           HB3      MET   7  12.527 -12.721  -3.818
   51    HG2  MET   7           HG2      MET   7  10.524 -13.200  -2.292
   52    HG3  MET   7           HG3      MET   7  11.205 -14.818  -2.144
   53    HE1  MET   7           HE1      MET   7  14.057 -14.501  -2.380
   54    HE2  MET   7           HE2      MET   7  14.866 -13.792  -0.982
   55    HE3  MET   7           HE3      MET   7  13.813 -15.192  -0.775
   56    HA   PRO   8           HA       PRO   8   8.991 -17.291  -5.932
   57    HB2  PRO   8           HB2      PRO   8  10.775 -18.835  -7.275
   58    HB3  PRO   8           HB3      PRO   8   9.819 -17.571  -8.057
   59    HG2  PRO   8           HG2      PRO   8  12.655 -17.485  -7.104
   60    HG3  PRO   8           HG3      PRO   8  11.963 -16.861  -8.612
   61    HD2  PRO   8           HD2      PRO   8  12.511 -15.268  -6.492
   62    HD3  PRO   8           HD3      PRO   8  11.162 -14.951  -7.601
   63    H    VAL   9           H        VAL   9  11.988 -16.925  -4.328
   64    HA   VAL   9           HA       VAL   9  11.866 -19.625  -3.188
   65    HB   VAL   9           HB       VAL   9  14.087 -19.294  -2.378
   66   HG11  VAL   9          HG11      VAL   9  15.245 -19.271  -4.376
   67   HG12  VAL   9          HG12      VAL   9  13.602 -19.625  -4.914
   68   HG13  VAL   9          HG13      VAL   9  14.246 -17.989  -5.062
   69   HG21  VAL   9          HG21      VAL   9  15.287 -17.155  -2.680
   70   HG22  VAL   9          HG22      VAL   9  13.788 -16.420  -3.248
   71   HG23  VAL   9          HG23      VAL   9  13.907 -17.014  -1.592
   72    HA   PRO  10           HA       PRO  10  10.211 -18.263   0.647
   73    HB2  PRO  10           HB2      PRO  10  11.372 -20.029   2.351
   74    HB3  PRO  10           HB3      PRO  10  10.081 -20.481   1.231
   75    HG2  PRO  10           HG2      PRO  10  13.039 -20.860   0.965
   76    HG3  PRO  10           HG3      PRO  10  11.727 -21.991   0.584
   77    HD2  PRO  10           HD2      PRO  10  12.998 -20.539  -1.316
   78    HD3  PRO  10           HD3      PRO  10  11.285 -20.990  -1.445
   79    HA   PRO  11           HA       PRO  11   9.623 -17.288   2.303
   80    HB2  PRO  11           HB2      PRO  11   9.338 -14.611   2.649
   81    HB3  PRO  11           HB3      PRO  11   9.818 -15.702   3.954
   82    HG2  PRO  11           HG2      PRO  11  11.522 -13.937   2.238
   83    HG3  PRO  11           HG3      PRO  11  11.609 -14.219   3.987
   84    HD2  PRO  11           HD2      PRO  11  13.276 -15.431   2.231
   85    HD3  PRO  11           HD3      PRO  11  12.746 -16.208   3.736
   86    H    PHE  12           H        PHE  12   8.187 -17.225   0.690
   87    HA   PHE  12           HA       PHE  12   8.914 -16.262  -1.887
   88    HB2  PHE  12           HB2      PHE  12   6.110 -16.980  -1.056
   89    HB3  PHE  12           HB3      PHE  12   6.859 -17.149  -2.640
   90    HD1  PHE  12           HD2      PHE  12   8.884 -18.786  -2.760
   91    HD2  PHE  12           HD1      PHE  12   5.947 -18.818   0.321
   92    HE1  PHE  12           HE2      PHE  12   9.462 -21.120  -2.238
   93    HE2  PHE  12           HE1      PHE  12   6.522 -21.151   0.849
   94    HZ   PHE  12           HZ       PHE  12   8.282 -22.305  -0.431
   95    H    ALA  13           H        ALA  13   7.886 -14.637   0.795
   96    HA   ALA  13           HA       ALA  13   5.951 -12.848  -0.075
   97    HB1  ALA  13           HB1      ALA  13   6.444 -12.821   2.211
   98    HB2  ALA  13           HB2      ALA  13   8.169 -12.587   1.928
   99    HB3  ALA  13           HB3      ALA  13   7.038 -11.270   1.617
  100    H    CYS  14           H        CYS  14   6.620 -10.335  -0.117
  101    HA   CYS  14           HA       CYS  14   8.112 -10.048  -2.584
  102    HB2  CYS  14           HB2      CYS  14   5.897  -8.862  -1.955
  103    HB3  CYS  14           HB3      CYS  14   6.917  -7.779  -1.014
  104    H    VAL  15           H        VAL  15   9.910  -8.692  -2.875
  105    HA   VAL  15           HA       VAL  15  11.550  -8.393  -0.464
  106    HB   VAL  15           HB       VAL  15  12.424  -8.162  -3.345
  107   HG11  VAL  15          HG11      VAL  15  13.798  -7.089  -1.487
  108   HG12  VAL  15          HG12      VAL  15  14.133  -8.734  -0.941
  109   HG13  VAL  15          HG13      VAL  15  14.634  -8.219  -2.552
  110   HG21  VAL  15          HG21      VAL  15  11.803 -10.491  -1.735
  111   HG22  VAL  15          HG22      VAL  15  12.150 -10.373  -3.460
  112   HG23  VAL  15          HG23      VAL  15  13.473 -10.503  -2.301
  113    H    LYS  16           H        LYS  16  10.416  -6.572  -3.281
  114    HA   LYS  16           HA       LYS  16  11.054  -4.091  -1.828
  115    HB2  LYS  16           HB2      LYS  16  12.388  -4.808  -4.037
  116    HB3  LYS  16           HB3      LYS  16  11.001  -4.041  -4.800
  117    HG2  LYS  16           HG2      LYS  16  12.674  -2.387  -4.600
  118    HG3  LYS  16           HG3      LYS  16  11.459  -2.026  -3.372
  119    HD2  LYS  16           HD2      LYS  16  13.379  -1.802  -2.137
  120    HD3  LYS  16           HD3      LYS  16  13.019  -3.508  -1.859
  121    HE2  LYS  16           HE2      LYS  16  14.739  -4.227  -3.193
  122    HE3  LYS  16           HE3      LYS  16  14.714  -2.775  -4.193
  123    HZ1  LYS  16           HZ1      LYS  16  15.986  -1.615  -2.703
  124    HZ2  LYS  16           HZ2      LYS  16  16.630  -3.166  -2.506
  125    HZ3  LYS  16           HZ3      LYS  16  15.524  -2.560  -1.378
  126    H    PHE  17           H        PHE  17   9.341  -2.863  -1.429
  127    HA   PHE  17           HA       PHE  17   6.864  -3.387  -2.910
  128    HB2  PHE  17           HB2      PHE  17   7.471  -2.358  -0.169
  129    HB3  PHE  17           HB3      PHE  17   5.958  -1.886  -0.936
  130    HD1  PHE  17           HD1      PHE  17   4.319  -3.633  -1.596
  131    HD2  PHE  17           HD2      PHE  17   7.777  -4.521   0.723
  132    HE1  PHE  17           HE1      PHE  17   3.301  -5.762  -0.898
  133    HE2  PHE  17           HE2      PHE  17   6.764  -6.651   1.424
  134    HZ   PHE  17           HZ       PHE  17   4.524  -7.274   0.613
  135    H    CYS  18           H        CYS  18   5.920  -1.883  -4.160
  136    HA   CYS  18           HA       CYS  18   7.375   0.586  -4.636
  137    HB2  CYS  18           HB2      CYS  18   5.375  -1.033  -6.096
  138    HB3  CYS  18           HB3      CYS  18   5.275   0.707  -6.345
  139    H    SER  19           H        SER  19   6.738   2.572  -4.045
  140    HA   SER  19           HA       SER  19   4.161   2.801  -2.637
  141    HB2  SER  19           HB2      SER  19   5.114   4.280  -1.131
  142    HB3  SER  19           HB3      SER  19   6.489   3.230  -1.474
  143    HG   SER  19           HG       SER  19   7.285   5.230  -1.756
  Start of MODEL   10
    1    H1   ALA   1           H        ALA   1   0.484   0.142   0.468
    2    HA   ALA   1           HA       ALA   1   2.164   0.401  -1.728
    3    HB1  ALA   1           HB1      ALA   1   3.771  -0.293  -0.330
    4    HB2  ALA   1           HB2      ALA   1   2.505  -0.249   0.897
    5    HB3  ALA   1           HB3      ALA   1   2.903  -1.768   0.094
    6    H    ARG   2           H        ARG   2   2.876  -0.959  -3.328
    7    HA   ARG   2           HA       ARG   2   1.469  -3.535  -3.585
    8    HB2  ARG   2           HB2      ARG   2   1.199  -3.205  -5.917
    9    HB3  ARG   2           HB3      ARG   2   0.681  -1.708  -5.153
   10    HG2  ARG   2           HG2      ARG   2   3.254  -1.109  -5.595
   11    HG3  ARG   2           HG3      ARG   2   2.978  -2.240  -6.921
   12    HD2  ARG   2           HD2      ARG   2   2.527   0.050  -7.620
   13    HD3  ARG   2           HD3      ARG   2   1.056  -0.921  -7.651
   14    HE   ARG   2           HE       ARG   2   1.125   0.303  -5.176
   15   HH11  ARG   2          HH11      ARG   2   1.021   1.292  -8.512
   16   HH12  ARG   2          HH12      ARG   2   0.160   2.760  -8.186
   17   HH21  ARG   2          HH21      ARG   2  -0.008   2.232  -4.733
   18   HH22  ARG   2          HH22      ARG   2  -0.424   3.294  -6.036
   19    H    CYS   3           H        CYS   3   2.678  -5.283  -4.059
   20    HA   CYS   3           HA       CYS   3   5.404  -5.342  -3.631
   21    HB2  CYS   3           HB2      CYS   3   3.983  -7.343  -3.574
   22    HB3  CYS   3           HB3      CYS   3   3.767  -7.247  -5.319
   23    H    CYS   4           H        CYS   4   7.179  -4.959  -4.810
   24    HA   CYS   4           HA       CYS   4   6.796  -4.131  -7.603
   25    HB2  CYS   4           HB2      CYS   4   7.957  -2.725  -5.631
   26    HB3  CYS   4           HB3      CYS   4   9.367  -3.605  -6.213
   27    H    LEU   5           H        LEU   5   8.614  -6.284  -5.521
   28    HA   LEU   5           HA       LEU   5   9.319  -7.910  -7.814
   29    HB2  LEU   5           HB2      LEU   5  11.148  -6.146  -7.369
   30    HB3  LEU   5           HB3      LEU   5  11.528  -7.119  -5.949
   31    HG   LEU   5           HG       LEU   5  11.623  -9.040  -7.802
   32   HD11  LEU   5          HD11      LEU   5  13.057  -7.573  -9.616
   33   HD12  LEU   5          HD12      LEU   5  11.673  -6.531  -9.286
   34   HD13  LEU   5          HD13      LEU   5  11.418  -8.182  -9.852
   35   HD21  LEU   5          HD21      LEU   5  14.126  -8.334  -8.013
   36   HD22  LEU   5          HD22      LEU   5  13.473  -8.825  -6.449
   37   HD23  LEU   5          HD23      LEU   5  13.680  -7.113  -6.821
   38    H    VAL   6           H        VAL   6   8.482  -9.787  -7.170
   39    HA   VAL   6           HA       VAL   6   8.749 -10.608  -4.372
   40    HB   VAL   6           HB       VAL   6   6.508 -10.745  -5.354
   41   HG11  VAL   6          HG11      VAL   6   6.184 -11.440  -7.436
   42   HG12  VAL   6          HG12      VAL   6   7.908 -11.789  -7.582
   43   HG13  VAL   6          HG13      VAL   6   6.798 -13.038  -7.015
   44   HG21  VAL   6          HG21      VAL   6   7.662 -13.485  -4.847
   45   HG22  VAL   6          HG22      VAL   6   7.216 -12.331  -3.591
   46   HG23  VAL   6          HG23      VAL   6   5.978 -12.996  -4.657
   47    H    MET   7           H        MET   7   9.635 -12.599  -3.769
   48    HA   MET   7           HA       MET   7  11.513 -13.712  -5.735
   49    HB2  MET   7           HB2      MET   7  12.735 -14.596  -3.775
   50    HB3  MET   7           HB3      MET   7  12.580 -12.845  -3.738
   51    HG2  MET   7           HG2      MET   7  10.534 -13.256  -2.251
   52    HG3  MET   7           HG3      MET   7  11.172 -14.889  -2.068
   53    HE1  MET   7           HE1      MET   7  13.745 -15.303  -0.630
   54    HE2  MET   7           HE2      MET   7  14.029 -14.649  -2.243
   55    HE3  MET   7           HE3      MET   7  14.832 -13.930  -0.846
   56    HA   PRO   8           HA       PRO   8   9.024 -17.367  -5.912
   57    HB2  PRO   8           HB2      PRO   8  10.816 -18.934  -7.216
   58    HB3  PRO   8           HB3      PRO   8   9.892 -17.660  -8.019
   59    HG2  PRO   8           HG2      PRO   8  12.709 -17.606  -7.008
   60    HG3  PRO   8           HG3      PRO   8  12.055 -16.975  -8.530
   61    HD2  PRO   8           HD2      PRO   8  12.579 -15.387  -6.401
   62    HD3  PRO   8           HD3      PRO   8  11.256 -15.055  -7.537
   63    H    VAL   9           H        VAL   9  11.954 -17.011  -4.209
   64    HA   VAL   9           HA       VAL   9  11.783 -19.715  -3.078
   65    HB   VAL   9           HB       VAL   9  13.994 -19.409  -2.219
   66   HG11  VAL   9          HG11      VAL   9  15.273 -19.046  -4.264
   67   HG12  VAL   9          HG12      VAL   9  13.830 -20.010  -4.585
   68   HG13  VAL   9          HG13      VAL   9  13.866 -18.302  -5.022
   69   HG21  VAL   9          HG21      VAL   9  13.829 -17.113  -1.473
   70   HG22  VAL   9          HG22      VAL   9  15.236 -17.297  -2.521
   71   HG23  VAL   9          HG23      VAL   9  13.767 -16.546  -3.142
   72    HA   PRO  10           HA       PRO  10  10.074 -18.304   0.715
   73    HB2  PRO  10           HB2      PRO  10  11.165 -20.086   2.449
   74    HB3  PRO  10           HB3      PRO  10   9.888 -20.517   1.305
   75    HG2  PRO  10           HG2      PRO  10  12.843 -20.955   1.101
   76    HG3  PRO  10           HG3      PRO  10  11.517 -22.062   0.697
   77    HD2  PRO  10           HD2      PRO  10  12.855 -20.643  -1.182
   78    HD3  PRO  10           HD3      PRO  10  11.137 -21.061  -1.345
   79    HA   PRO  11           HA       PRO  11   9.471 -17.309   2.353
   80    HB2  PRO  11           HB2      PRO  11   9.235 -14.624   2.680
   81    HB3  PRO  11           HB3      PRO  11   9.663 -15.718   4.000
   82    HG2  PRO  11           HG2      PRO  11  11.440 -13.997   2.313
   83    HG3  PRO  11           HG3      PRO  11  11.483 -14.272   4.065
   84    HD2  PRO  11           HD2      PRO  11  13.162 -15.527   2.351
   85    HD3  PRO  11           HD3      PRO  11  12.584 -16.286   3.848
   86    H    PHE  12           H        PHE  12   8.080 -17.234   0.703
   87    HA   PHE  12           HA       PHE  12   8.881 -16.288  -1.858
   88    HB2  PHE  12           HB2      PHE  12   6.105 -17.087  -0.962
   89    HB3  PHE  12           HB3      PHE  12   6.703 -17.025  -2.617
   90    HD1  PHE  12           HD2      PHE  12   8.198 -18.733  -3.467
   91    HD2  PHE  12           HD1      PHE  12   6.691 -18.900   0.510
   92    HE1  PHE  12           HE2      PHE  12   8.895 -21.088  -3.305
   93    HE2  PHE  12           HE1      PHE  12   7.386 -21.254   0.678
   94    HZ   PHE  12           HZ       PHE  12   8.490 -22.351  -1.230
   95    H    ALA  13           H        ALA  13   7.820 -14.640   0.793
   96    HA   ALA  13           HA       ALA  13   5.925 -12.829  -0.124
   97    HB1  ALA  13           HB1      ALA  13   6.409 -11.542   1.741
   98    HB2  ALA  13           HB2      ALA  13   6.938 -13.151   2.234
   99    HB3  ALA  13           HB3      ALA  13   8.123 -11.955   1.708
  100    H    CYS  14           H        CYS  14   6.635 -10.324  -0.154
  101    HA   CYS  14           HA       CYS  14   8.177 -10.064  -2.592
  102    HB2  CYS  14           HB2      CYS  14   5.977  -8.845  -2.048
  103    HB3  CYS  14           HB3      CYS  14   6.958  -7.797  -1.029
  104    H    VAL  15           H        VAL  15  10.033  -8.814  -2.850
  105    HA   VAL  15           HA       VAL  15  11.627  -8.526  -0.415
  106    HB   VAL  15           HB       VAL  15  12.556  -8.258  -3.275
  107   HG11  VAL  15          HG11      VAL  15  13.921  -7.278  -1.361
  108   HG12  VAL  15          HG12      VAL  15  14.196  -8.945  -0.853
  109   HG13  VAL  15          HG13      VAL  15  14.747  -8.404  -2.439
  110   HG21  VAL  15          HG21      VAL  15  13.498 -10.662  -2.205
  111   HG22  VAL  15          HG22      VAL  15  11.783 -10.606  -1.797
  112   HG23  VAL  15          HG23      VAL  15  12.294 -10.458  -3.478
  113    H    LYS  16           H        LYS  16  10.558  -6.655  -3.224
  114    HA   LYS  16           HA       LYS  16  11.190  -4.201  -1.725
  115    HB2  LYS  16           HB2      LYS  16  12.828  -4.428  -3.498
  116    HB3  LYS  16           HB3      LYS  16  11.558  -4.698  -4.684
  117    HG2  LYS  16           HG2      LYS  16  12.296  -2.467  -4.949
  118    HG3  LYS  16           HG3      LYS  16  10.714  -2.395  -4.169
  119    HD2  LYS  16           HD2      LYS  16  12.129  -0.836  -3.052
  120    HD3  LYS  16           HD3      LYS  16  11.911  -2.215  -1.971
  121    HE2  LYS  16           HE2      LYS  16  14.073  -3.049  -2.450
  122    HE3  LYS  16           HE3      LYS  16  14.267  -1.960  -3.823
  123    HZ1  LYS  16           HZ1      LYS  16  14.212  -1.219  -0.951
  124    HZ2  LYS  16           HZ2      LYS  16  14.197  -0.094  -2.213
  125    HZ3  LYS  16           HZ3      LYS  16  15.530  -1.115  -2.007
  126    H    PHE  17           H        PHE  17   9.436  -3.046  -1.312
  127    HA   PHE  17           HA       PHE  17   7.018  -3.507  -2.891
  128    HB2  PHE  17           HB2      PHE  17   7.574  -2.472  -0.146
  129    HB3  PHE  17           HB3      PHE  17   6.102  -1.944  -0.954
  130    HD1  PHE  17           HD1      PHE  17   4.638  -3.852  -1.976
  131    HD2  PHE  17           HD2      PHE  17   7.549  -4.420   1.076
  132    HE1  PHE  17           HE1      PHE  17   3.520  -5.938  -1.304
  133    HE2  PHE  17           HE2      PHE  17   6.437  -6.508   1.753
  134    HZ   PHE  17           HZ       PHE  17   4.419  -7.269   0.563
  135    H    CYS  18           H        CYS  18   6.087  -1.993  -4.151
  136    HA   CYS  18           HA       CYS  18   7.600   0.433  -4.664
  137    HB2  CYS  18           HB2      CYS  18   5.537  -1.143  -6.095
  138    HB3  CYS  18           HB3      CYS  18   5.531   0.593  -6.387
  139    H    SER  19           H        SER  19   7.005   2.446  -4.114
  140    HA   SER  19           HA       SER  19   4.684   2.746  -2.389
  141    HB2  SER  19           HB2      SER  19   6.886   4.691  -3.121
  142    HB3  SER  19           HB3      SER  19   5.607   5.009  -1.949
  143    HG   SER  19           HG       SER  19   6.590   3.783  -0.537
  Start of MODEL   11
    1    H1   ALA   1           H        ALA   1  -0.146  -1.009  -0.058
    2    HA   ALA   1           HA       ALA   1   1.834   0.338  -1.758
    3    HB1  ALA   1           HB1      ALA   1   2.392  -0.575   0.811
    4    HB2  ALA   1           HB2      ALA   1   3.047  -1.811  -0.263
    5    HB3  ALA   1           HB3      ALA   1   3.558  -0.132  -0.436
    6    H    ARG   2           H        ARG   2   2.897  -1.050  -3.281
    7    HA   ARG   2           HA       ARG   2   1.445  -3.564  -3.789
    8    HB2  ARG   2           HB2      ARG   2   2.621  -1.818  -5.946
    9    HB3  ARG   2           HB3      ARG   2   1.488  -3.152  -6.125
   10    HG2  ARG   2           HG2      ARG   2  -0.128  -1.638  -6.175
   11    HG3  ARG   2           HG3      ARG   2   0.181  -1.361  -4.459
   12    HD2  ARG   2           HD2      ARG   2   1.454   0.524  -4.858
   13    HD3  ARG   2           HD3      ARG   2   1.848   0.035  -6.505
   14    HE   ARG   2           HE       ARG   2  -0.925   0.510  -6.275
   15   HH11  ARG   2          HH11      ARG   2   2.125   2.186  -6.376
   16   HH12  ARG   2          HH12      ARG   2   1.455   3.636  -7.044
   17   HH21  ARG   2          HH21      ARG   2  -1.819   2.415  -7.156
   18   HH22  ARG   2          HH22      ARG   2  -0.789   3.766  -7.486
   19    H    CYS   3           H        CYS   3   2.646  -5.217  -4.918
   20    HA   CYS   3           HA       CYS   3   5.329  -5.442  -3.940
   21    HB2  CYS   3           HB2      CYS   3   3.739  -7.363  -4.106
   22    HB3  CYS   3           HB3      CYS   3   3.869  -7.267  -5.859
   23    H    CYS   4           H        CYS   4   7.170  -4.950  -4.940
   24    HA   CYS   4           HA       CYS   4   7.039  -4.100  -7.744
   25    HB2  CYS   4           HB2      CYS   4   8.144  -2.859  -5.564
   26    HB3  CYS   4           HB3      CYS   4   9.547  -3.646  -6.280
   27    H    LEU   5           H        LEU   5   8.699  -6.304  -5.568
   28    HA   LEU   5           HA       LEU   5   9.491  -7.941  -7.820
   29    HB2  LEU   5           HB2      LEU   5  11.315  -6.111  -6.708
   30    HB3  LEU   5           HB3      LEU   5  11.787  -7.703  -6.117
   31    HG   LEU   5           HG       LEU   5  11.468  -8.225  -8.754
   32   HD11  LEU   5          HD11      LEU   5  11.462  -5.407  -8.591
   33   HD12  LEU   5          HD12      LEU   5  11.521  -6.419 -10.034
   34   HD13  LEU   5          HD13      LEU   5  13.018  -5.890  -9.267
   35   HD21  LEU   5          HD21      LEU   5  13.963  -7.938  -8.883
   36   HD22  LEU   5          HD22      LEU   5  13.384  -8.919  -7.536
   37   HD23  LEU   5          HD23      LEU   5  13.893  -7.253  -7.259
   38    H    VAL   6           H        VAL   6   8.711  -9.848  -7.218
   39    HA   VAL   6           HA       VAL   6   8.834 -10.633  -4.396
   40    HB   VAL   6           HB       VAL   6   6.639 -10.794  -5.474
   41   HG11  VAL   6          HG11      VAL   6   8.141 -11.844  -7.629
   42   HG12  VAL   6          HG12      VAL   6   7.018 -13.099  -7.102
   43   HG13  VAL   6          HG13      VAL   6   6.412 -11.507  -7.562
   44   HG21  VAL   6          HG21      VAL   6   7.269 -12.356  -3.668
   45   HG22  VAL   6          HG22      VAL   6   6.097 -13.050  -4.789
   46   HG23  VAL   6          HG23      VAL   6   7.795 -13.518  -4.886
   47    H    MET   7           H        MET   7   9.707 -12.613  -3.739
   48    HA   MET   7           HA       MET   7  11.677 -13.727  -5.612
   49    HB2  MET   7           HB2      MET   7  12.819 -14.587  -3.595
   50    HB3  MET   7           HB3      MET   7  12.647 -12.837  -3.575
   51    HG2  MET   7           HG2      MET   7  10.544 -13.254  -2.175
   52    HG3  MET   7           HG3      MET   7  11.178 -14.884  -1.961
   53    HE1  MET   7           HE1      MET   7  14.159 -14.437  -2.065
   54    HE2  MET   7           HE2      MET   7  14.765 -13.922  -0.491
   55    HE3  MET   7           HE3      MET   7  13.690 -15.316  -0.609
   56    HA   PRO   8           HA       PRO   8   9.220 -17.400  -5.871
   57    HB2  PRO   8           HB2      PRO   8  11.076 -18.963  -7.089
   58    HB3  PRO   8           HB3      PRO   8  10.178 -17.699  -7.938
   59    HG2  PRO   8           HG2      PRO   8  12.950 -17.620  -6.810
   60    HG3  PRO   8           HG3      PRO   8  12.356 -17.003  -8.362
   61    HD2  PRO   8           HD2      PRO   8  12.779 -15.398  -6.223
   62    HD3  PRO   8           HD3      PRO   8  11.503 -15.082  -7.416
   63    H    VAL   9           H        VAL   9  12.070 -17.011  -4.047
   64    HA   VAL   9           HA       VAL   9  11.874 -19.710  -2.908
   65    HB   VAL   9           HB       VAL   9  14.041 -19.375  -1.950
   66   HG11  VAL   9          HG11      VAL   9  15.392 -19.178  -3.906
   67   HG12  VAL   9          HG12      VAL   9  13.872 -19.935  -4.385
   68   HG13  VAL   9          HG13      VAL   9  14.157 -18.230  -4.734
   69   HG21  VAL   9          HG21      VAL   9  14.930 -16.905  -2.939
   70   HG22  VAL   9          HG22      VAL   9  13.359 -16.596  -2.199
   71   HG23  VAL   9          HG23      VAL   9  14.645 -17.351  -1.256
   72    HA   PRO  10           HA       PRO  10   9.989 -18.294   0.798
   73    HB2  PRO  10           HB2      PRO  10  11.017 -20.058   2.588
   74    HB3  PRO  10           HB3      PRO  10   9.795 -20.506   1.392
   75    HG2  PRO  10           HG2      PRO  10  12.759 -20.920   1.319
   76    HG3  PRO  10           HG3      PRO  10  11.461 -22.039   0.863
   77    HD2  PRO  10           HD2      PRO  10  12.868 -20.619  -0.963
   78    HD3  PRO  10           HD3      PRO  10  11.163 -21.052  -1.198
   79    HA   PRO  11           HA       PRO  11   9.307 -17.293   2.401
   80    HB2  PRO  11           HB2      PRO  11   9.036 -14.609   2.701
   81    HB3  PRO  11           HB3      PRO  11   9.414 -15.692   4.045
   82    HG2  PRO  11           HG2      PRO  11  11.250 -13.967   2.428
   83    HG3  PRO  11           HG3      PRO  11  11.218 -14.232   4.181
   84    HD2  PRO  11           HD2      PRO  11  12.981 -15.484   2.551
   85    HD3  PRO  11           HD3      PRO  11  12.343 -16.238   4.026
   86    H    PHE  12           H        PHE  12   7.989 -17.239   0.691
   87    HA   PHE  12           HA       PHE  12   8.895 -16.303  -1.839
   88    HB2  PHE  12           HB2      PHE  12   6.089 -17.115  -1.060
   89    HB3  PHE  12           HB3      PHE  12   6.757 -17.059  -2.688
   90    HD1  PHE  12           HD2      PHE  12   8.300 -18.762  -3.460
   91    HD2  PHE  12           HD1      PHE  12   6.621 -18.915   0.448
   92    HE1  PHE  12           HE2      PHE  12   9.005 -21.110  -3.253
   93    HE2  PHE  12           HE1      PHE  12   7.323 -21.263   0.661
   94    HZ   PHE  12           HZ       PHE  12   8.518 -22.364  -1.190
   95    H    ALA  13           H        ALA  13   7.704 -14.647   0.754
   96    HA   ALA  13           HA       ALA  13   5.840 -12.855  -0.256
   97    HB1  ALA  13           HB1      ALA  13   5.975 -12.352   1.910
   98    HB2  ALA  13           HB2      ALA  13   7.619 -12.980   2.036
   99    HB3  ALA  13           HB3      ALA  13   7.346 -11.329   1.480
  100    H    CYS  14           H        CYS  14   6.524 -10.347  -0.283
  101    HA   CYS  14           HA       CYS  14   8.178 -10.095  -2.648
  102    HB2  CYS  14           HB2      CYS  14   5.928  -8.894  -2.171
  103    HB3  CYS  14           HB3      CYS  14   6.898  -7.796  -1.195
  104    H    VAL  15           H        VAL  15  10.030  -8.828  -2.829
  105    HA   VAL  15           HA       VAL  15  11.495  -8.483  -0.321
  106    HB   VAL  15           HB       VAL  15  12.570  -8.255  -3.132
  107   HG11  VAL  15          HG11      VAL  15  14.046  -8.835  -0.574
  108   HG12  VAL  15          HG12      VAL  15  14.725  -8.438  -2.153
  109   HG13  VAL  15          HG13      VAL  15  13.852  -7.211  -1.233
  110   HG21  VAL  15          HG21      VAL  15  11.762 -10.588  -1.633
  111   HG22  VAL  15          HG22      VAL  15  12.305 -10.460  -3.306
  112   HG23  VAL  15          HG23      VAL  15  13.485 -10.631  -2.006
  113    H    LYS  16           H        LYS  16  10.524  -6.674  -3.201
  114    HA   LYS  16           HA       LYS  16  11.117  -4.187  -1.738
  115    HB2  LYS  16           HB2      LYS  16  12.628  -4.809  -3.760
  116    HB3  LYS  16           HB3      LYS  16  11.238  -4.350  -4.735
  117    HG2  LYS  16           HG2      LYS  16  12.523  -2.419  -4.654
  118    HG3  LYS  16           HG3      LYS  16  11.288  -2.149  -3.421
  119    HD2  LYS  16           HD2      LYS  16  13.300  -1.487  -2.410
  120    HD3  LYS  16           HD3      LYS  16  12.982  -3.098  -1.763
  121    HE2  LYS  16           HE2      LYS  16  15.270  -3.080  -2.323
  122    HE3  LYS  16           HE3      LYS  16  14.474  -3.979  -3.614
  123    HZ1  LYS  16           HZ1      LYS  16  16.012  -1.607  -3.782
  124    HZ2  LYS  16           HZ2      LYS  16  14.464  -1.336  -4.407
  125    HZ3  LYS  16           HZ3      LYS  16  15.421  -2.584  -5.030
  126    H    PHE  17           H        PHE  17   9.381  -2.984  -1.381
  127    HA   PHE  17           HA       PHE  17   6.971  -3.476  -2.980
  128    HB2  PHE  17           HB2      PHE  17   7.445  -2.441  -0.207
  129    HB3  PHE  17           HB3      PHE  17   5.947  -2.044  -1.042
  130    HD1  PHE  17           HD1      PHE  17   4.421  -3.871  -1.759
  131    HD2  PHE  17           HD2      PHE  17   7.806  -4.578   0.722
  132    HE1  PHE  17           HE1      PHE  17   3.470  -6.038  -1.085
  133    HE2  PHE  17           HE2      PHE  17   6.862  -6.747   1.399
  134    HZ   PHE  17           HZ       PHE  17   4.692  -7.480   0.495
  135    H    CYS  18           H        CYS  18   6.088  -1.950  -4.247
  136    HA   CYS  18           HA       CYS  18   7.567   0.523  -4.616
  137    HB2  CYS  18           HB2      CYS  18   5.614  -1.055  -6.188
  138    HB3  CYS  18           HB3      CYS  18   5.566   0.689  -6.423
  139    H    SER  19           H        SER  19   6.923   2.487  -3.978
  140    HA   SER  19           HA       SER  19   4.164   2.805  -3.002
  141    HB2  SER  19           HB2      SER  19   4.931   4.077  -1.105
  142    HB3  SER  19           HB3      SER  19   5.811   2.549  -1.122
  143    HG   SER  19           HG       SER  19   7.090   4.517  -0.774
  Start of MODEL   12
    1    H1   ALA   1           H        ALA   1   0.318  -0.630   0.343
    2    HA   ALA   1           HA       ALA   1   2.077   0.777  -1.463
    3    HB1  ALA   1           HB1      ALA   1   3.339   0.458   0.738
    4    HB2  ALA   1           HB2      ALA   1   3.372  -1.257   0.324
    5    HB3  ALA   1           HB3      ALA   1   4.133  -0.077  -0.744
    6    H    ARG   2           H        ARG   2   3.074  -0.676  -3.050
    7    HA   ARG   2           HA       ARG   2   1.603  -3.216  -3.313
    8    HB2  ARG   2           HB2      ARG   2   1.342  -2.873  -5.645
    9    HB3  ARG   2           HB3      ARG   2   0.861  -1.366  -4.877
   10    HG2  ARG   2           HG2      ARG   2   3.196  -0.528  -5.342
   11    HG3  ARG   2           HG3      ARG   2   3.407  -1.960  -6.352
   12    HD2  ARG   2           HD2      ARG   2   1.386   0.248  -6.699
   13    HD3  ARG   2           HD3      ARG   2   2.746  -0.132  -7.755
   14    HE   ARG   2           HE       ARG   2   1.266  -2.415  -7.738
   15   HH11  ARG   2          HH11      ARG   2   0.587   0.927  -8.438
   16   HH12  ARG   2          HH12      ARG   2  -0.659   0.569  -9.587
   17   HH21  ARG   2          HH21      ARG   2  -0.373  -2.899  -9.248
   18   HH22  ARG   2          HH22      ARG   2  -1.205  -1.608 -10.046
   19    H    CYS   3           H        CYS   3   2.757  -4.993  -3.844
   20    HA   CYS   3           HA       CYS   3   5.474  -5.144  -3.386
   21    HB2  CYS   3           HB2      CYS   3   3.942  -7.089  -3.424
   22    HB3  CYS   3           HB3      CYS   3   3.851  -6.964  -5.178
   23    H    CYS   4           H        CYS   4   7.266  -4.735  -4.523
   24    HA   CYS   4           HA       CYS   4   6.944  -3.831  -7.297
   25    HB2  CYS   4           HB2      CYS   4   8.141  -2.540  -5.262
   26    HB3  CYS   4           HB3      CYS   4   9.522  -3.440  -5.880
   27    H    LEU   5           H        LEU   5   8.671  -6.110  -5.270
   28    HA   LEU   5           HA       LEU   5   9.323  -7.701  -7.599
   29    HB2  LEU   5           HB2      LEU   5  11.205  -6.002  -7.149
   30    HB3  LEU   5           HB3      LEU   5  11.568  -6.998  -5.740
   31    HG   LEU   5           HG       LEU   5  11.537  -8.872  -7.705
   32   HD11  LEU   5          HD11      LEU   5  12.132  -6.245  -8.945
   33   HD12  LEU   5          HD12      LEU   5  11.393  -7.688  -9.639
   34   HD13  LEU   5          HD13      LEU   5  13.140  -7.618  -9.406
   35   HD21  LEU   5          HD21      LEU   5  13.478  -7.478  -6.102
   36   HD22  LEU   5          HD22      LEU   5  14.160  -7.907  -7.671
   37   HD23  LEU   5          HD23      LEU   5  13.464  -9.157  -6.639
   38    H    VAL   6           H        VAL   6   8.514  -9.601  -7.013
   39    HA   VAL   6           HA       VAL   6   8.767 -10.475  -4.224
   40    HB   VAL   6           HB       VAL   6   6.506 -10.520  -5.179
   41   HG11  VAL   6          HG11      VAL   6   7.841 -11.574  -7.439
   42   HG12  VAL   6          HG12      VAL   6   6.706 -12.801  -6.873
   43   HG13  VAL   6          HG13      VAL   6   6.132 -11.180  -7.264
   44   HG21  VAL   6          HG21      VAL   6   7.196 -12.151  -3.447
   45   HG22  VAL   6          HG22      VAL   6   5.914 -12.758  -4.496
   46   HG23  VAL   6          HG23      VAL   6   7.574 -13.305  -4.727
   47    H    MET   7           H        MET   7   9.598 -12.510  -3.684
   48    HA   MET   7           HA       MET   7  11.411 -13.630  -5.705
   49    HB2  MET   7           HB2      MET   7  12.633 -14.601  -3.786
   50    HB3  MET   7           HB3      MET   7  12.537 -12.847  -3.708
   51    HG2  MET   7           HG2      MET   7  10.498 -13.227  -2.199
   52    HG3  MET   7           HG3      MET   7  11.091 -14.881  -2.060
   53    HE1  MET   7           HE1      MET   7  14.047 -14.753   0.193
   54    HE2  MET   7           HE2      MET   7  12.773 -15.672  -0.609
   55    HE3  MET   7           HE3      MET   7  14.111 -15.011  -1.551
   56    HA   PRO   8           HA       PRO   8   8.805 -17.201  -5.932
   57    HB2  PRO   8           HB2      PRO   8  10.525 -18.786  -7.310
   58    HB3  PRO   8           HB3      PRO   8   9.626 -17.463  -8.062
   59    HG2  PRO   8           HG2      PRO   8  12.461 -17.522  -7.103
   60    HG3  PRO   8           HG3      PRO   8  11.799 -16.831  -8.596
   61    HD2  PRO   8           HD2      PRO   8  12.410 -15.317  -6.436
   62    HD3  PRO   8           HD3      PRO   8  11.077 -14.915  -7.538
   63    H    VAL   9           H        VAL   9  11.769 -16.974  -4.270
   64    HA   VAL   9           HA       VAL   9  11.538 -19.703  -3.208
   65    HB   VAL   9           HB       VAL   9  13.772 -19.481  -2.376
   66   HG11  VAL   9          HG11      VAL   9  13.360 -19.886  -4.855
   67   HG12  VAL   9          HG12      VAL   9  13.861 -18.211  -5.098
   68   HG13  VAL   9          HG13      VAL   9  14.982 -19.374  -4.388
   69   HG21  VAL   9          HG21      VAL   9  14.713 -17.025  -3.328
   70   HG22  VAL   9          HG22      VAL   9  13.188 -16.665  -2.518
   71   HG23  VAL   9          HG23      VAL   9  14.474 -17.500  -1.646
   72    HA   PRO  10           HA       PRO  10   9.942 -18.344   0.652
   73    HB2  PRO  10           HB2      PRO  10  11.014 -20.199   2.320
   74    HB3  PRO  10           HB3      PRO  10   9.705 -20.566   1.190
   75    HG2  PRO  10           HG2      PRO  10  12.642 -21.079   0.919
   76    HG3  PRO  10           HG3      PRO  10  11.279 -22.138   0.512
   77    HD2  PRO  10           HD2      PRO  10  12.621 -20.708  -1.356
   78    HD3  PRO  10           HD3      PRO  10  10.890 -21.075  -1.496
   79    HA   PRO  11           HA       PRO  11   9.396 -17.372   2.322
   80    HB2  PRO  11           HB2      PRO  11   9.242 -14.690   2.718
   81    HB3  PRO  11           HB3      PRO  11   9.663 -15.828   4.003
   82    HG2  PRO  11           HG2      PRO  11  11.458 -14.117   2.326
   83    HG3  PRO  11           HG3      PRO  11  11.524 -14.436   4.069
   84    HD2  PRO  11           HD2      PRO  11  13.136 -15.695   2.296
   85    HD3  PRO  11           HD3      PRO  11  12.563 -16.474   3.785
   86    H    PHE  12           H        PHE  12   7.981 -17.220   0.699
   87    HA   PHE  12           HA       PHE  12   8.763 -16.233  -1.852
   88    HB2  PHE  12           HB2      PHE  12   5.983 -16.979  -0.926
   89    HB3  PHE  12           HB3      PHE  12   6.552 -16.890  -2.590
   90    HD1  PHE  12           HD2      PHE  12   7.982 -18.617  -3.512
   91    HD2  PHE  12           HD1      PHE  12   6.551 -18.842   0.491
   92    HE1  PHE  12           HE2      PHE  12   8.617 -20.992  -3.421
   93    HE2  PHE  12           HE1      PHE  12   7.185 -21.218   0.588
   94    HZ   PHE  12           HZ       PHE  12   8.219 -22.296  -1.370
   95    H    ALA  13           H        ALA  13   7.798 -14.621   0.856
   96    HA   ALA  13           HA       ALA  13   5.935 -12.739   0.022
   97    HB1  ALA  13           HB1      ALA  13   8.226 -12.392   1.952
   98    HB2  ALA  13           HB2      ALA  13   6.860 -11.287   1.788
   99    HB3  ALA  13           HB3      ALA  13   6.595 -12.941   2.338
  100    H    CYS  14           H        CYS  14   6.714 -10.253   0.035
  101    HA   CYS  14           HA       CYS  14   8.203  -9.976  -2.433
  102    HB2  CYS  14           HB2      CYS  14   6.055  -8.706  -1.795
  103    HB3  CYS  14           HB3      CYS  14   7.099  -7.711  -0.785
  104    H    VAL  15           H        VAL  15  10.063  -8.704  -2.707
  105    HA   VAL  15           HA       VAL  15  11.742  -8.561  -0.313
  106    HB   VAL  15           HB       VAL  15  12.523  -8.300  -3.221
  107   HG11  VAL  15          HG11      VAL  15  14.252  -8.628  -0.771
  108   HG12  VAL  15          HG12      VAL  15  14.809  -8.505  -2.441
  109   HG13  VAL  15          HG13      VAL  15  14.029  -7.125  -1.666
  110   HG21  VAL  15          HG21      VAL  15  13.260 -10.541  -3.145
  111   HG22  VAL  15          HG22      VAL  15  13.061 -10.630  -1.395
  112   HG23  VAL  15          HG23      VAL  15  11.643 -10.549  -2.441
  113    H    LYS  16           H        LYS  16  10.574  -6.563  -2.984
  114    HA   LYS  16           HA       LYS  16  11.289  -4.182  -1.414
  115    HB2  LYS  16           HB2      LYS  16  12.744  -4.791  -3.544
  116    HB3  LYS  16           HB3      LYS  16  11.396  -4.045  -4.394
  117    HG2  LYS  16           HG2      LYS  16  12.015  -2.287  -2.319
  118    HG3  LYS  16           HG3      LYS  16  13.569  -2.817  -2.967
  119    HD2  LYS  16           HD2      LYS  16  11.503  -2.125  -4.959
  120    HD3  LYS  16           HD3      LYS  16  12.132  -0.784  -3.999
  121    HE2  LYS  16           HE2      LYS  16  14.023  -2.729  -5.251
  122    HE3  LYS  16           HE3      LYS  16  13.295  -1.463  -6.238
  123    HZ1  LYS  16           HZ1      LYS  16  14.356  -0.498  -3.749
  124    HZ2  LYS  16           HZ2      LYS  16  14.590   0.083  -5.321
  125    HZ3  LYS  16           HZ3      LYS  16  15.536  -1.195  -4.742
  126    H    PHE  17           H        PHE  17   9.590  -2.935  -1.020
  127    HA   PHE  17           HA       PHE  17   7.154  -3.334  -2.593
  128    HB2  PHE  17           HB2      PHE  17   7.730  -2.308   0.157
  129    HB3  PHE  17           HB3      PHE  17   6.250  -1.797  -0.649
  130    HD1  PHE  17           HD1      PHE  17   4.943  -3.844  -1.796
  131    HD2  PHE  17           HD2      PHE  17   7.584  -4.129   1.530
  132    HE1  PHE  17           HE1      PHE  17   3.847  -5.937  -1.109
  133    HE2  PHE  17           HE2      PHE  17   6.493  -6.222   2.222
  134    HZ   PHE  17           HZ       PHE  17   4.621  -7.129   0.903
  135    H    CYS  18           H        CYS  18   6.249  -1.778  -3.825
  136    HA   CYS  18           HA       CYS  18   7.824   0.612  -4.321
  137    HB2  CYS  18           HB2      CYS  18   5.769  -0.929  -5.769
  138    HB3  CYS  18           HB3      CYS  18   5.689   0.814  -6.000
  139    H    SER  19           H        SER  19   7.320   2.610  -3.671
  140    HA   SER  19           HA       SER  19   4.640   3.072  -2.540
  141    HB2  SER  19           HB2      SER  19   7.334   3.747  -1.392
  142    HB3  SER  19           HB3      SER  19   5.918   4.708  -0.968
  143    HG   SER  19           HG       SER  19   6.115   3.065   0.525
  Start of MODEL   13
    1    H1   ALA   1           H        ALA   1   0.205   0.461  -0.332
    2    HA   ALA   1           HA       ALA   1   2.984   0.618  -1.089
    3    HB1  ALA   1           HB1      ALA   1   2.659  -1.359   1.049
    4    HB2  ALA   1           HB2      ALA   1   3.986  -0.242   0.724
    5    HB3  ALA   1           HB3      ALA   1   2.550   0.319   1.580
    6    H    ARG   2           H        ARG   2   3.159  -0.683  -2.782
    7    HA   ARG   2           HA       ARG   2   1.585  -3.174  -2.813
    8    HB2  ARG   2           HB2      ARG   2   1.182  -2.939  -5.134
    9    HB3  ARG   2           HB3      ARG   2   0.831  -1.367  -4.427
   10    HG2  ARG   2           HG2      ARG   2   3.343  -0.897  -5.057
   11    HG3  ARG   2           HG3      ARG   2   3.050  -2.190  -6.221
   12    HD2  ARG   2           HD2      ARG   2   0.817  -0.493  -6.353
   13    HD3  ARG   2           HD3      ARG   2   2.229   0.560  -6.306
   14    HE   ARG   2           HE       ARG   2   2.704  -0.089  -8.437
   15   HH11  ARG   2          HH11      ARG   2   0.656  -2.497  -6.978
   16   HH12  ARG   2          HH12      ARG   2   0.495  -3.428  -8.431
   17   HH21  ARG   2          HH21      ARG   2   2.501  -1.307 -10.355
   18   HH22  ARG   2          HH22      ARG   2   1.546  -2.751 -10.350
   19    H    CYS   3           H        CYS   3   2.521  -4.949  -4.007
   20    HA   CYS   3           HA       CYS   3   5.246  -5.352  -3.419
   21    HB2  CYS   3           HB2      CYS   3   3.590  -7.180  -3.605
   22    HB3  CYS   3           HB3      CYS   3   3.492  -6.897  -5.340
   23    H    CYS   4           H        CYS   4   7.028  -4.807  -4.485
   24    HA   CYS   4           HA       CYS   4   6.760  -3.735  -7.200
   25    HB2  CYS   4           HB2      CYS   4   8.078  -2.752  -4.991
   26    HB3  CYS   4           HB3      CYS   4   9.381  -3.496  -5.912
   27    H    LEU   5           H        LEU   5   8.422  -6.196  -5.331
   28    HA   LEU   5           HA       LEU   5   8.958  -7.708  -7.721
   29    HB2  LEU   5           HB2      LEU   5  10.883  -5.966  -7.214
   30    HB3  LEU   5           HB3      LEU   5  11.377  -7.207  -6.064
   31    HG   LEU   5           HG       LEU   5  10.880  -7.999  -8.895
   32   HD11  LEU   5          HD11      LEU   5  13.538  -6.900  -8.050
   33   HD12  LEU   5          HD12      LEU   5  12.313  -5.876  -8.798
   34   HD13  LEU   5          HD13      LEU   5  12.952  -7.268  -9.673
   35   HD21  LEU   5          HD21      LEU   5  12.328  -9.745  -8.414
   36   HD22  LEU   5          HD22      LEU   5  11.475  -9.518  -6.887
   37   HD23  LEU   5          HD23      LEU   5  13.104  -8.873  -7.092
   38    H    VAL   6           H        VAL   6   8.167  -9.606  -7.095
   39    HA   VAL   6           HA       VAL   6   8.509 -10.505  -4.341
   40    HB   VAL   6           HB       VAL   6   6.286 -10.741  -5.271
   41   HG11  VAL   6          HG11      VAL   6   7.693 -11.524  -7.610
   42   HG12  VAL   6          HG12      VAL   6   6.620 -12.845  -7.145
   43   HG13  VAL   6          HG13      VAL   6   5.966 -11.228  -7.412
   44   HG21  VAL   6          HG21      VAL   6   7.099 -13.574  -5.305
   45   HG22  VAL   6          HG22      VAL   6   7.603 -12.648  -3.892
   46   HG23  VAL   6          HG23      VAL   6   5.894 -12.750  -4.316
   47    H    MET   7           H        MET   7   9.553 -12.393  -3.750
   48    HA   MET   7           HA       MET   7  11.473 -13.402  -5.723
   49    HB2  MET   7           HB2      MET   7  12.712 -14.271  -3.775
   50    HB3  MET   7           HB3      MET   7  12.456 -12.534  -3.678
   51    HG2  MET   7           HG2      MET   7  10.464 -13.044  -2.209
   52    HG3  MET   7           HG3      MET   7  11.060 -14.701  -2.143
   53    HE1  MET   7           HE1      MET   7  11.959 -11.765   0.889
   54    HE2  MET   7           HE2      MET   7  10.945 -11.428  -0.514
   55    HE3  MET   7           HE3      MET   7  10.607 -12.830   0.502
   56    HA   PRO   8           HA       PRO   8   9.163 -17.164  -6.038
   57    HB2  PRO   8           HB2      PRO   8  11.051 -18.613  -7.344
   58    HB3  PRO   8           HB3      PRO   8  10.084 -17.363  -8.134
   59    HG2  PRO   8           HG2      PRO   8  12.876 -17.205  -7.065
   60    HG3  PRO   8           HG3      PRO   8  12.222 -16.567  -8.585
   61    HD2  PRO   8           HD2      PRO   8  12.631 -15.011  -6.407
   62    HD3  PRO   8           HD3      PRO   8  11.316 -14.711  -7.561
   63    H    VAL   9           H        VAL   9  12.024 -16.708  -4.253
   64    HA   VAL   9           HA       VAL   9  11.974 -19.449  -3.203
   65    HB   VAL   9           HB       VAL   9  14.140 -19.044  -2.270
   66   HG11  VAL   9          HG11      VAL   9  13.760 -19.335  -4.848
   67   HG12  VAL   9          HG12      VAL   9  14.422 -17.700  -4.916
   68   HG13  VAL   9          HG13      VAL   9  15.370 -19.008  -4.208
   69   HG21  VAL   9          HG21      VAL   9  13.325 -16.292  -2.420
   70   HG22  VAL   9          HG22      VAL   9  14.649 -17.017  -1.509
   71   HG23  VAL   9          HG23      VAL   9  14.904 -16.506  -3.177
   72    HA   PRO  10           HA       PRO  10  10.089 -18.246   0.578
   73    HB2  PRO  10           HB2      PRO  10  11.227 -20.018   2.291
   74    HB3  PRO  10           HB3      PRO  10  10.008 -20.482   1.098
   75    HG2  PRO  10           HG2      PRO  10  12.986 -20.755   0.966
   76    HG3  PRO  10           HG3      PRO  10  11.734 -21.918   0.493
   77    HD2  PRO  10           HD2      PRO  10  13.042 -20.374  -1.306
   78    HD3  PRO  10           HD3      PRO  10  11.355 -20.878  -1.529
   79    HA   PRO  11           HA       PRO  11   9.387 -17.321   2.213
   80    HB2  PRO  11           HB2      PRO  11   9.004 -14.661   2.598
   81    HB3  PRO  11           HB3      PRO  11   9.447 -15.766   3.904
   82    HG2  PRO  11           HG2      PRO  11  11.185 -13.915   2.317
   83    HG3  PRO  11           HG3      PRO  11  11.189 -14.233   4.062
   84    HD2  PRO  11           HD2      PRO  11  12.981 -15.357   2.372
   85    HD3  PRO  11           HD3      PRO  11  12.396 -16.182   3.832
   86    H    PHE  12           H        PHE  12   8.053 -17.282   0.516
   87    HA   PHE  12           HA       PHE  12   8.878 -16.245  -1.995
   88    HB2  PHE  12           HB2      PHE  12   6.116 -17.171  -1.183
   89    HB3  PHE  12           HB3      PHE  12   6.739 -17.034  -2.824
   90    HD1  PHE  12           HD2      PHE  12   8.340 -18.648  -3.686
   91    HD2  PHE  12           HD1      PHE  12   6.728 -19.009   0.236
   92    HE1  PHE  12           HE2      PHE  12   9.129 -20.975  -3.580
   93    HE2  PHE  12           HE1      PHE  12   7.515 -21.337   0.350
   94    HZ   PHE  12           HZ       PHE  12   8.717 -22.324  -1.561
   95    H    ALA  13           H        ALA  13   7.612 -14.720   0.666
   96    HA   ALA  13           HA       ALA  13   5.717 -12.943  -0.324
   97    HB1  ALA  13           HB1      ALA  13   7.601 -12.940   1.962
   98    HB2  ALA  13           HB2      ALA  13   6.870 -11.399   1.514
   99    HB3  ALA  13           HB3      ALA  13   5.846 -12.771   1.936
  100    H    CYS  14           H        CYS  14   6.359 -10.409  -0.178
  101    HA   CYS  14           HA       CYS  14   8.043  -9.998  -2.499
  102    HB2  CYS  14           HB2      CYS  14   5.752  -8.843  -1.857
  103    HB3  CYS  14           HB3      CYS  14   6.808  -7.736  -0.986
  104    H    VAL  15           H        VAL  15  10.008  -9.043  -2.543
  105    HA   VAL  15           HA       VAL  15  11.298  -8.560   0.039
  106    HB   VAL  15           HB       VAL  15  12.491 -10.072  -1.413
  107   HG11  VAL  15          HG11      VAL  15  12.409  -7.836  -3.435
  108   HG12  VAL  15          HG12      VAL  15  13.383  -9.299  -3.595
  109   HG13  VAL  15          HG13      VAL  15  11.623  -9.410  -3.558
  110   HG21  VAL  15          HG21      VAL  15  14.226  -7.737  -1.802
  111   HG22  VAL  15          HG22      VAL  15  13.597  -7.927  -0.165
  112   HG23  VAL  15          HG23      VAL  15  14.516  -9.233  -0.913
  113    H    LYS  16           H        LYS  16  10.426  -6.945  -2.944
  114    HA   LYS  16           HA       LYS  16  11.411  -4.412  -1.801
  115    HB2  LYS  16           HB2      LYS  16  12.521  -5.340  -3.948
  116    HB3  LYS  16           HB3      LYS  16  11.031  -4.859  -4.750
  117    HG2  LYS  16           HG2      LYS  16  12.183  -2.952  -5.080
  118    HG3  LYS  16           HG3      LYS  16  11.583  -2.580  -3.461
  119    HD2  LYS  16           HD2      LYS  16  13.893  -2.089  -3.424
  120    HD3  LYS  16           HD3      LYS  16  13.716  -3.629  -2.581
  121    HE2  LYS  16           HE2      LYS  16  15.512  -4.054  -3.963
  122    HE3  LYS  16           HE3      LYS  16  14.166  -4.655  -4.931
  123    HZ1  LYS  16           HZ1      LYS  16  15.085  -1.874  -5.243
  124    HZ2  LYS  16           HZ2      LYS  16  14.277  -2.861  -6.353
  125    HZ3  LYS  16           HZ3      LYS  16  15.913  -3.130  -6.018
  126    H    PHE  17           H        PHE  17   9.810  -3.136  -1.175
  127    HA   PHE  17           HA       PHE  17   7.170  -3.438  -2.403
  128    HB2  PHE  17           HB2      PHE  17   8.119  -2.836   0.259
  129    HB3  PHE  17           HB3      PHE  17   7.005  -1.590  -0.295
  130    HD1  PHE  17           HD2      PHE  17   7.045  -5.251  -0.961
  131    HD2  PHE  17           HD1      PHE  17   5.020  -1.961   0.825
  132    HE1  PHE  17           HE2      PHE  17   5.145  -6.718  -0.422
  133    HE2  PHE  17           HE1      PHE  17   3.116  -3.422   1.367
  134    HZ   PHE  17           HZ       PHE  17   3.177  -5.804   0.742
  135    H    CYS  18           H        CYS  18   6.264  -1.908  -3.642
  136    HA   CYS  18           HA       CYS  18   7.869   0.413  -4.334
  137    HB2  CYS  18           HB2      CYS  18   5.906  -1.221  -5.659
  138    HB3  CYS  18           HB3      CYS  18   5.421   0.470  -5.739
  139    H    SER  19           H        SER  19   7.474   2.446  -3.717
  140    HA   SER  19           HA       SER  19   5.096   2.926  -2.060
  141    HB2  SER  19           HB2      SER  19   7.525   3.326  -1.222
  142    HB3  SER  19           HB3      SER  19   7.455   4.784  -2.211
  143    HG   SER  19           HG       SER  19   5.765   4.077  -0.047
  Start of MODEL   14
    1    H1   ALA   1           H        ALA   1   0.868   0.660   0.263
    2    HA   ALA   1           HA       ALA   1   2.677   0.892  -1.964
    3    HB1  ALA   1           HB1      ALA   1   3.538  -1.095  -0.113
    4    HB2  ALA   1           HB2      ALA   1   4.190   0.521  -0.386
    5    HB3  ALA   1           HB3      ALA   1   2.895   0.279   0.786
    6    H    ARG   2           H        ARG   2   3.272  -0.670  -3.415
    7    HA   ARG   2           HA       ARG   2   1.734  -3.183  -3.352
    8    HB2  ARG   2           HB2      ARG   2   2.572  -1.751  -5.872
    9    HB3  ARG   2           HB3      ARG   2   1.464  -3.108  -5.721
   10    HG2  ARG   2           HG2      ARG   2  -0.183  -1.723  -4.662
   11    HG3  ARG   2           HG3      ARG   2   0.943  -0.365  -4.601
   12    HD2  ARG   2           HD2      ARG   2   0.854  -0.035  -6.911
   13    HD3  ARG   2           HD3      ARG   2   0.199  -1.645  -7.206
   14    HE   ARG   2           HE       ARG   2  -1.647  -0.237  -5.660
   15   HH11  ARG   2          HH11      ARG   2  -0.255  -0.125  -8.849
   16   HH12  ARG   2          HH12      ARG   2  -1.652   0.599  -9.575
   17   HH21  ARG   2          HH21      ARG   2  -3.492   0.717  -6.604
   18   HH22  ARG   2          HH22      ARG   2  -3.492   1.078  -8.297
   19    H    CYS   3           H        CYS   3   2.747  -5.012  -4.377
   20    HA   CYS   3           HA       CYS   3   5.422  -5.373  -3.650
   21    HB2  CYS   3           HB2      CYS   3   3.849  -7.235  -3.913
   22    HB3  CYS   3           HB3      CYS   3   3.777  -6.941  -5.648
   23    H    CYS   4           H        CYS   4   7.275  -4.827  -4.587
   24    HA   CYS   4           HA       CYS   4   7.203  -3.757  -7.313
   25    HB2  CYS   4           HB2      CYS   4   8.403  -2.825  -5.001
   26    HB3  CYS   4           HB3      CYS   4   9.744  -3.547  -5.884
   27    H    LEU   5           H        LEU   5   8.712  -6.246  -5.353
   28    HA   LEU   5           HA       LEU   5   9.384  -7.753  -7.712
   29    HB2  LEU   5           HB2      LEU   5  11.290  -6.053  -7.149
   30    HB3  LEU   5           HB3      LEU   5  11.681  -7.215  -5.883
   31    HG   LEU   5           HG       LEU   5  11.653  -8.910  -7.907
   32   HD11  LEU   5          HD11      LEU   5  11.848  -8.084  -9.981
   33   HD12  LEU   5          HD12      LEU   5  12.841  -6.725  -9.459
   34   HD13  LEU   5          HD13      LEU   5  11.087  -6.647  -9.298
   35   HD21  LEU   5          HD21      LEU   5  13.670  -8.931  -6.913
   36   HD22  LEU   5          HD22      LEU   5  13.722  -7.176  -6.743
   37   HD23  LEU   5          HD23      LEU   5  14.147  -7.926  -8.282
   38    H    VAL   6           H        VAL   6   8.533  -9.644  -7.146
   39    HA   VAL   6           HA       VAL   6   8.691 -10.559  -4.382
   40    HB   VAL   6           HB       VAL   6   6.530 -10.750  -5.491
   41   HG11  VAL   6          HG11      VAL   6   8.099 -11.623  -7.685
   42   HG12  VAL   6          HG12      VAL   6   6.984 -12.924  -7.263
   43   HG13  VAL   6          HG13      VAL   6   6.364 -11.314  -7.630
   44   HG21  VAL   6          HG21      VAL   6   7.366 -13.590  -5.338
   45   HG22  VAL   6          HG22      VAL   6   7.632 -12.590  -3.910
   46   HG23  VAL   6          HG23      VAL   6   6.007 -12.765  -4.573
   47    H    MET   7           H        MET   7   9.641 -12.495  -3.747
   48    HA   MET   7           HA       MET   7  11.675 -13.512  -5.602
   49    HB2  MET   7           HB2      MET   7  12.781 -14.406  -3.579
   50    HB3  MET   7           HB3      MET   7  12.563 -12.662  -3.513
   51    HG2  MET   7           HG2      MET   7  10.425 -13.187  -2.193
   52    HG3  MET   7           HG3      MET   7  11.118 -14.795  -1.995
   53    HE1  MET   7           HE1      MET   7  14.077 -14.234  -1.995
   54    HE2  MET   7           HE2      MET   7  14.616 -13.727  -0.395
   55    HE3  MET   7           HE3      MET   7  13.600 -15.158  -0.570
   56    HA   PRO   8           HA       PRO   8   9.337 -17.244  -6.048
   57    HB2  PRO   8           HB2      PRO   8  11.276 -18.718  -7.245
   58    HB3  PRO   8           HB3      PRO   8  10.371 -17.455  -8.088
   59    HG2  PRO   8           HG2      PRO   8  13.101 -17.334  -6.864
   60    HG3  PRO   8           HG3      PRO   8  12.542 -16.687  -8.418
   61    HD2  PRO   8           HD2      PRO   8  12.848 -15.136  -6.220
   62    HD3  PRO   8           HD3      PRO   8  11.604 -14.819  -7.447
   63    H    VAL   9           H        VAL   9  12.094 -16.821  -4.101
   64    HA   VAL   9           HA       VAL   9  11.949 -19.562  -3.056
   65    HB   VAL   9           HB       VAL   9  14.064 -19.176  -1.993
   66   HG11  VAL   9          HG11      VAL   9  14.184 -18.018  -4.775
   67   HG12  VAL   9          HG12      VAL   9  15.491 -18.826  -3.907
   68   HG13  VAL   9          HG13      VAL   9  14.064 -19.738  -4.403
   69   HG21  VAL   9          HG21      VAL   9  13.298 -16.424  -2.205
   70   HG22  VAL   9          HG22      VAL   9  14.592 -17.149  -1.250
   71   HG23  VAL   9          HG23      VAL   9  14.896 -16.654  -2.915
   72    HA   PRO  10           HA       PRO  10   9.882 -18.329   0.619
   73    HB2  PRO  10           HB2      PRO  10  10.912 -20.104   2.396
   74    HB3  PRO  10           HB3      PRO  10   9.753 -20.562   1.142
   75    HG2  PRO  10           HG2      PRO  10  12.732 -20.862   1.170
   76    HG3  PRO  10           HG3      PRO  10  11.496 -22.016   0.635
   77    HD2  PRO  10           HD2      PRO  10  12.912 -20.490  -1.097
   78    HD3  PRO  10           HD3      PRO  10  11.235 -20.981  -1.408
   79    HA   PRO  11           HA       PRO  11   9.103 -17.387   2.207
   80    HB2  PRO  11           HB2      PRO  11   8.727 -14.721   2.557
   81    HB3  PRO  11           HB3      PRO  11   9.087 -15.824   3.891
   82    HG2  PRO  11           HG2      PRO  11  10.927 -13.999   2.393
   83    HG3  PRO  11           HG3      PRO  11  10.832 -14.307   4.136
   84    HD2  PRO  11           HD2      PRO  11  12.703 -15.459   2.552
   85    HD3  PRO  11           HD3      PRO  11  12.031 -16.270   3.982
   86    H    PHE  12           H        PHE  12   7.871 -17.353   0.436
   87    HA   PHE  12           HA       PHE  12   8.840 -16.333  -2.030
   88    HB2  PHE  12           HB2      PHE  12   6.030 -17.233  -1.366
   89    HB3  PHE  12           HB3      PHE  12   6.741 -17.108  -2.972
   90    HD1  PHE  12           HD2      PHE  12   8.366 -18.739  -3.744
   91    HD2  PHE  12           HD1      PHE  12   6.556 -19.068   0.094
   92    HE1  PHE  12           HE2      PHE  12   9.130 -21.073  -3.588
   93    HE2  PHE  12           HE1      PHE  12   7.318 -21.402   0.257
   94    HZ   PHE  12           HZ       PHE  12   8.608 -22.407  -1.585
   95    H    ALA  13           H        ALA  13   7.428 -14.790   0.550
   96    HA   ALA  13           HA       ALA  13   5.615 -12.998  -0.563
   97    HB1  ALA  13           HB1      ALA  13   7.510 -12.682   1.755
   98    HB2  ALA  13           HB2      ALA  13   6.276 -11.493   1.338
   99    HB3  ALA  13           HB3      ALA  13   5.804 -13.128   1.801
  100    H    CYS  14           H        CYS  14   6.285 -10.466  -0.351
  101    HA   CYS  14           HA       CYS  14   8.114 -10.068  -2.563
  102    HB2  CYS  14           HB2      CYS  14   5.800  -8.886  -2.054
  103    HB3  CYS  14           HB3      CYS  14   6.820  -7.792  -1.127
  104    H    VAL  15           H        VAL  15  10.080  -9.105  -2.484
  105    HA   VAL  15           HA       VAL  15  11.214  -8.662   0.178
  106    HB   VAL  15           HB       VAL  15  12.485 -10.173  -1.203
  107   HG11  VAL  15          HG11      VAL  15  12.529  -7.934  -3.221
  108   HG12  VAL  15          HG12      VAL  15  13.512  -9.395  -3.326
  109   HG13  VAL  15          HG13      VAL  15  11.753  -9.508  -3.394
  110   HG21  VAL  15          HG21      VAL  15  13.517  -7.942   0.048
  111   HG22  VAL  15          HG22      VAL  15  14.433  -9.353  -0.479
  112   HG23  VAL  15          HG23      VAL  15  14.317  -7.937  -1.523
  113    H    LYS  16           H        LYS  16  10.544  -7.018  -2.841
  114    HA   LYS  16           HA       LYS  16  11.474  -4.502  -1.617
  115    HB2  LYS  16           HB2      LYS  16  12.863  -5.148  -3.536
  116    HB3  LYS  16           HB3      LYS  16  11.429  -5.242  -4.550
  117    HG2  LYS  16           HG2      LYS  16  12.389  -3.182  -5.069
  118    HG3  LYS  16           HG3      LYS  16  11.064  -2.787  -3.972
  119    HD2  LYS  16           HD2      LYS  16  12.855  -1.504  -3.188
  120    HD3  LYS  16           HD3      LYS  16  12.830  -2.904  -2.113
  121    HE2  LYS  16           HE2      LYS  16  15.073  -2.740  -2.631
  122    HE3  LYS  16           HE3      LYS  16  14.510  -3.910  -3.823
  123    HZ1  LYS  16           HZ1      LYS  16  15.901  -2.280  -4.877
  124    HZ2  LYS  16           HZ2      LYS  16  14.958  -1.010  -4.278
  125    HZ3  LYS  16           HZ3      LYS  16  14.313  -2.076  -5.423
  126    H    PHE  17           H        PHE  17   9.847  -3.217  -1.085
  127    HA   PHE  17           HA       PHE  17   7.284  -3.495  -2.470
  128    HB2  PHE  17           HB2      PHE  17   8.118  -2.396   0.189
  129    HB3  PHE  17           HB3      PHE  17   6.602  -1.862  -0.531
  130    HD1  PHE  17           HD1      PHE  17   5.058  -3.823  -1.396
  131    HD2  PHE  17           HD2      PHE  17   8.086  -4.227   1.569
  132    HE1  PHE  17           HE1      PHE  17   3.938  -5.836  -0.532
  133    HE2  PHE  17           HE2      PHE  17   6.971  -6.242   2.437
  134    HZ   PHE  17           HZ       PHE  17   4.894  -7.048   1.387
  135    H    CYS  18           H        CYS  18   6.492  -1.981  -3.795
  136    HA   CYS  18           HA       CYS  18   8.143   0.337  -4.378
  137    HB2  CYS  18           HB2      CYS  18   6.344  -1.323  -5.855
  138    HB3  CYS  18           HB3      CYS  18   5.770   0.339  -5.945
  139    H    SER  19           H        SER  19   7.692   2.380  -3.827
  140    HA   SER  19           HA       SER  19   5.518   2.884  -2.013
  141    HB2  SER  19           HB2      SER  19   7.853   3.903  -1.872
  142    HB3  SER  19           HB3      SER  19   7.369   4.952  -3.204
  143    HG   SER  19           HG       SER  19   6.672   6.147  -1.603
  Start of MODEL   15
    1    H1   ALA   1           H        ALA   1   0.319   0.196  -0.678
    2    HA   ALA   1           HA       ALA   1   2.610   1.032  -2.213
    3    HB1  ALA   1           HB1      ALA   1   3.001   0.379   0.501
    4    HB2  ALA   1           HB2      ALA   1   3.633  -0.967  -0.448
    5    HB3  ALA   1           HB3      ALA   1   4.225   0.669  -0.736
    6    H    ARG   2           H        ARG   2   3.349  -0.555  -3.633
    7    HA   ARG   2           HA       ARG   2   1.797  -3.060  -3.648
    8    HB2  ARG   2           HB2      ARG   2   2.730  -1.596  -6.116
    9    HB3  ARG   2           HB3      ARG   2   1.633  -2.968  -6.031
   10    HG2  ARG   2           HG2      ARG   2   1.059  -0.211  -4.966
   11    HG3  ARG   2           HG3      ARG   2   0.462  -0.870  -6.491
   12    HD2  ARG   2           HD2      ARG   2  -0.419  -2.796  -4.934
   13    HD3  ARG   2           HD3      ARG   2  -0.302  -1.550  -3.692
   14    HE   ARG   2           HE       ARG   2  -2.128  -0.520  -4.606
   15   HH11  ARG   2          HH11      ARG   2  -0.839  -2.799  -6.901
   16   HH12  ARG   2          HH12      ARG   2  -2.158  -2.626  -8.011
   17   HH21  ARG   2          HH21      ARG   2  -3.871  -0.285  -6.059
   18   HH22  ARG   2          HH22      ARG   2  -3.882  -1.195  -7.531
   19    H    CYS   3           H        CYS   3   2.838  -4.890  -4.633
   20    HA   CYS   3           HA       CYS   3   5.491  -5.255  -3.822
   21    HB2  CYS   3           HB2      CYS   3   3.986  -7.138  -4.084
   22    HB3  CYS   3           HB3      CYS   3   3.835  -6.821  -5.809
   23    H    CYS   4           H        CYS   4   7.353  -4.653  -4.695
   24    HA   CYS   4           HA       CYS   4   7.366  -3.607  -7.424
   25    HB2  CYS   4           HB2      CYS   4   8.529  -2.710  -5.078
   26    HB3  CYS   4           HB3      CYS   4   9.878  -3.435  -5.945
   27    H    LEU   5           H        LEU   5   8.813  -6.120  -5.444
   28    HA   LEU   5           HA       LEU   5   9.509  -7.628  -7.794
   29    HB2  LEU   5           HB2      LEU   5  11.422  -5.935  -7.152
   30    HB3  LEU   5           HB3      LEU   5  11.792  -7.159  -5.939
   31    HG   LEU   5           HG       LEU   5  11.745  -8.753  -8.050
   32   HD11  LEU   5          HD11      LEU   5  12.829  -7.513  -9.961
   33   HD12  LEU   5          HD12      LEU   5  12.297  -6.023  -9.182
   34   HD13  LEU   5          HD13      LEU   5  11.108  -7.209  -9.721
   35   HD21  LEU   5          HD21      LEU   5  14.263  -7.482  -8.236
   36   HD22  LEU   5          HD22      LEU   5  13.841  -8.951  -7.355
   37   HD23  LEU   5          HD23      LEU   5  13.744  -7.382  -6.553
   38    H    VAL   6           H        VAL   6   8.633  -9.513  -7.246
   39    HA   VAL   6           HA       VAL   6   8.737 -10.433  -4.480
   40    HB   VAL   6           HB       VAL   6   6.598 -10.587  -5.682
   41   HG11  VAL   6          HG11      VAL   6   8.222 -11.563  -7.776
   42   HG12  VAL   6          HG12      VAL   6   7.114 -12.861  -7.325
   43   HG13  VAL   6          HG13      VAL   6   6.481 -11.281  -7.787
   44   HG21  VAL   6          HG21      VAL   6   7.341 -13.433  -5.369
   45   HG22  VAL   6          HG22      VAL   6   7.623 -12.382  -3.982
   46   HG23  VAL   6          HG23      VAL   6   6.003 -12.525  -4.665
   47    H    MET   7           H        MET   7   9.613 -12.421  -3.850
   48    HA   MET   7           HA       MET   7  11.684 -13.441  -5.667
   49    HB2  MET   7           HB2      MET   7  12.755 -14.343  -3.632
   50    HB3  MET   7           HB3      MET   7  12.546 -12.598  -3.562
   51    HG2  MET   7           HG2      MET   7  10.363 -13.156  -2.292
   52    HG3  MET   7           HG3      MET   7  11.111 -14.733  -2.050
   53    HE1  MET   7           HE1      MET   7  14.485 -12.893  -1.648
   54    HE2  MET   7           HE2      MET   7  14.339 -14.015  -0.295
   55    HE3  MET   7           HE3      MET   7  13.791 -14.495  -1.902
   56    HA   PRO   8           HA       PRO   8   9.322 -17.151  -6.149
   57    HB2  PRO   8           HB2      PRO   8  11.272 -18.653  -7.295
   58    HB3  PRO   8           HB3      PRO   8  10.402 -17.383  -8.163
   59    HG2  PRO   8           HG2      PRO   8  13.103 -17.288  -6.876
   60    HG3  PRO   8           HG3      PRO   8  12.588 -16.642  -8.445
   61    HD2  PRO   8           HD2      PRO   8  12.860 -15.084  -6.247
   62    HD3  PRO   8           HD3      PRO   8  11.649 -14.759  -7.503
   63    H    VAL   9           H        VAL   9  12.125 -16.801  -4.209
   64    HA   VAL   9           HA       VAL   9  11.902 -19.520  -3.140
   65    HB   VAL   9           HB       VAL   9  13.997 -19.166  -2.050
   66   HG11  VAL   9          HG11      VAL   9  14.023 -19.632  -4.494
   67   HG12  VAL   9          HG12      VAL   9  14.212 -17.900  -4.777
   68   HG13  VAL   9          HG13      VAL   9  15.462 -18.795  -3.913
   69   HG21  VAL   9          HG21      VAL   9  14.886 -16.639  -2.844
   70   HG22  VAL   9          HG22      VAL   9  13.249 -16.390  -2.236
   71   HG23  VAL   9          HG23      VAL   9  14.463 -17.158  -1.213
   72    HA   PRO  10           HA       PRO  10   9.753 -18.284   0.486
   73    HB2  PRO  10           HB2      PRO  10  10.731 -20.069   2.283
   74    HB3  PRO  10           HB3      PRO  10   9.600 -20.518   1.001
   75    HG2  PRO  10           HG2      PRO  10  12.575 -20.834   1.099
   76    HG3  PRO  10           HG3      PRO  10  11.346 -21.980   0.531
   77    HD2  PRO  10           HD2      PRO  10  12.812 -20.458  -1.162
   78    HD3  PRO  10           HD3      PRO  10  11.139 -20.939  -1.514
   79    HA   PRO  11           HA       PRO  11   8.942 -17.356   2.072
   80    HB2  PRO  11           HB2      PRO  11   8.562 -14.692   2.432
   81    HB3  PRO  11           HB3      PRO  11   8.894 -15.804   3.765
   82    HG2  PRO  11           HG2      PRO  11  10.766 -13.972   2.316
   83    HG3  PRO  11           HG3      PRO  11  10.637 -14.291   4.055
   84    HD2  PRO  11           HD2      PRO  11  12.536 -15.435   2.501
   85    HD3  PRO  11           HD3      PRO  11  11.836 -16.255   3.911
   86    H    PHE  12           H        PHE  12   7.723 -17.283   0.289
   87    HA   PHE  12           HA       PHE  12   8.746 -16.270  -2.159
   88    HB2  PHE  12           HB2      PHE  12   5.862 -16.997  -1.686
   89    HB3  PHE  12           HB3      PHE  12   6.799 -17.143  -3.170
   90    HD1  PHE  12           HD2      PHE  12   8.879 -18.751  -2.998
   91    HD2  PHE  12           HD1      PHE  12   5.482 -18.884  -0.437
   92    HE1  PHE  12           HE2      PHE  12   9.392 -21.093  -2.445
   93    HE2  PHE  12           HE1      PHE  12   5.990 -21.226   0.121
   94    HZ   PHE  12           HZ       PHE  12   7.947 -22.333  -0.883
   95    H    ALA  13           H        ALA  13   7.311 -14.718   0.407
   96    HA   ALA  13           HA       ALA  13   5.547 -12.894  -0.729
   97    HB1  ALA  13           HB1      ALA  13   6.191 -11.408   1.190
   98    HB2  ALA  13           HB2      ALA  13   5.696 -13.041   1.639
   99    HB3  ALA  13           HB3      ALA  13   7.406 -12.611   1.622
  100    H    CYS  14           H        CYS  14   6.249 -10.374  -0.495
  101    HA   CYS  14           HA       CYS  14   8.125  -9.994  -2.671
  102    HB2  CYS  14           HB2      CYS  14   5.808  -8.774  -2.147
  103    HB3  CYS  14           HB3      CYS  14   6.878  -7.677  -1.280
  104    H    VAL  15           H        VAL  15  10.076  -8.972  -2.565
  105    HA   VAL  15           HA       VAL  15  11.176  -8.586   0.124
  106    HB   VAL  15           HB       VAL  15  12.470 -10.091  -1.231
  107   HG11  VAL  15          HG11      VAL  15  11.765  -9.447  -3.434
  108   HG12  VAL  15          HG12      VAL  15  12.527  -7.865  -3.263
  109   HG13  VAL  15          HG13      VAL  15  13.521  -9.319  -3.348
  110   HG21  VAL  15          HG21      VAL  15  14.422  -9.268  -0.519
  111   HG22  VAL  15          HG22      VAL  15  14.290  -7.835  -1.539
  112   HG23  VAL  15          HG23      VAL  15  13.492  -7.875   0.033
  113    H    LYS  16           H        LYS  16  10.575  -6.916  -2.896
  114    HA   LYS  16           HA       LYS  16  11.494  -4.415  -1.636
  115    HB2  LYS  16           HB2      LYS  16  12.818  -5.263  -3.647
  116    HB3  LYS  16           HB3      LYS  16  11.390  -4.904  -4.609
  117    HG2  LYS  16           HG2      LYS  16  12.794  -3.041  -4.841
  118    HG3  LYS  16           HG3      LYS  16  11.541  -2.545  -3.701
  119    HD2  LYS  16           HD2      LYS  16  13.456  -1.782  -2.660
  120    HD3  LYS  16           HD3      LYS  16  13.242  -3.362  -1.902
  121    HE2  LYS  16           HE2      LYS  16  14.840  -4.323  -3.505
  122    HE3  LYS  16           HE3      LYS  16  15.072  -2.727  -4.217
  123    HZ1  LYS  16           HZ1      LYS  16  15.623  -3.359  -1.371
  124    HZ2  LYS  16           HZ2      LYS  16  16.014  -1.935  -2.196
  125    HZ3  LYS  16           HZ3      LYS  16  16.802  -3.381  -2.585
  126    H    PHE  17           H        PHE  17   9.863  -3.126  -1.126
  127    HA   PHE  17           HA       PHE  17   7.322  -3.388  -2.549
  128    HB2  PHE  17           HB2      PHE  17   8.132  -2.266   0.108
  129    HB3  PHE  17           HB3      PHE  17   6.629  -1.730  -0.635
  130    HD1  PHE  17           HD1      PHE  17   5.089  -3.697  -1.504
  131    HD2  PHE  17           HD2      PHE  17   8.064  -4.074   1.516
  132    HE1  PHE  17           HE1      PHE  17   3.946  -5.693  -0.632
  133    HE2  PHE  17           HE2      PHE  17   6.926  -6.071   2.393
  134    HZ   PHE  17           HZ       PHE  17   4.865  -6.884   1.318
  135    H    CYS  18           H        CYS  18   6.559  -1.885  -3.902
  136    HA   CYS  18           HA       CYS  18   8.232   0.417  -4.487
  137    HB2  CYS  18           HB2      CYS  18   6.468  -1.255  -5.978
  138    HB3  CYS  18           HB3      CYS  18   5.868   0.397  -6.079
  139    H    SER  19           H        SER  19   7.778   2.473  -3.980
  140    HA   SER  19           HA       SER  19   5.698   3.041  -2.120
  141    HB2  SER  19           HB2      SER  19   6.497   5.399  -2.332
  142    HB3  SER  19           HB3      SER  19   7.791   4.253  -1.981
  143    HG   SER  19           HG       SER  19   7.875   5.952  -3.852