*HEADER    CYTOKINE                                01-FEB-19   6NUG              
*TITLE     HGRNA4-28_3S                                                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GRANULIN-4;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 284-307;                                          
*COMPND   5 SYNONYM: PROEPITHELIN,PEPI;                                          
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606                                                 
*KEYWDS    WOUND HEALING AGENT, CYTOKINE                                         
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.DASTPEYMAN,P.BANSAL,D.WILSON,A.LOUKAS,M.SMOUT,N.DALY                
*REVDAT   1   05-FEB-20 6NUG    0                                                
# Restraints file 1: grna.aco
3 MET   PSI     -70.0    10.0
  5 VAL   PSI      90.0   180.0
  8 PRO   PSI     -50.0     0.0
  9 ASP  PSI     -30.0    30.0
 10 GLY   PHI      50.0   110.0
 10 GLY   PSI     -30.0    40.0
 11 TYR   PSI     100.0   180.0
 12 THR   PSI     100.0   180.0
 13 CYS   PHI    -180.0   -80.0
 13 CYS   PSI     100.0   180.0
 14 CYS   PSI     100.0   180.0
 17 GLN   PSI     -70.0     0.0
 19 GLY   PHI      50.0   120.0
 19 GLY   PSI     -30.0    50.0
 21 TRP PHI -150 -90
 24 CYS PHI -150 -90
12 THR PHI -150 -90
14 CYS PHI -150 -90
17 GLN PHI -80 -40
23 CYS PHI -150 -90
9 ASP PHI -90 -30
11 TYR PHI -150 -90
2 ASP PHI -180 -20
3 MET PHI -80 -40
4 GLU PHI -180 -20
18 SER PHI -90 -30
5 VAL PHI -150 -90
7 CYS PHI -150 -90
6 SER PHI -150 -90
15 ARG PHI -150 -90
16 LEU PHI -150 -90
18 SER PHI -80 -40
# Restraints file 2: D_1000239441_mr_P1.cyana.V2
22 GLY O 14 CYSS H 2.2
22 GLY O 14 CYSS N 3.2
12 THR O 24 CYSS H 2.2
12 THR O 24 CYSS N 3.2
16 LEU H 20 ALA O 2.2
16 LEU N 20 ALA O 3.2
19 GLY H 16 LEU O 2.2
19 GLY N 16 LEU O 3.2
12 THR H 24 CYSS O 2.2
12 THR N 24 CYSS O 3.2
2 ASP H 5 VAL O 2.2
2 ASP N 5 VAL O 3.2
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   CYS   1           H        CYS   1   1.807   0.001   0.856
    2    HA   CYS   1           HA       CYS   1   1.396  -0.068  -2.061
    3    HB2  CYS   1           HB2      CYS   1   2.336   2.102  -0.914
    4    HB3  CYS   1           HB3      CYS   1   3.837   1.184  -0.860
    5    H    ASP   2           H        ASP   2   3.494  -0.968   0.634
    6    HA   ASP   2           HA       ASP   2   4.784  -2.971  -1.093
    7    HB2  ASP   2           HB2      ASP   2   6.122  -1.177   0.252
    8    HB3  ASP   2           HB3      ASP   2   5.802  -2.227   1.630
    9    H    MET   3           H        MET   3   5.266  -5.073  -0.113
   10    HA   MET   3           HA       MET   3   2.982  -6.275   0.981
   11    HB2  MET   3           HB2      MET   3   5.796  -7.132   0.500
   12    HB3  MET   3           HB3      MET   3   4.797  -8.130   1.547
   13    HG2  MET   3           HG2      MET   3   4.421  -9.116  -0.475
   14    HG3  MET   3           HG3      MET   3   3.087  -7.965  -0.417
   15    HE1  MET   3           HE1      MET   3   3.081  -6.841  -3.671
   16    HE2  MET   3           HE2      MET   3   3.633  -8.512  -3.780
   17    HE3  MET   3           HE3      MET   3   2.505  -8.037  -2.511
   18    H    GLU   4           H        GLU   4   6.074  -5.393   2.500
   19    HA   GLU   4           HA       GLU   4   5.187  -6.204   5.112
   20    HB2  GLU   4           HB2      GLU   4   7.558  -6.328   4.463
   21    HB3  GLU   4           HB3      GLU   4   7.600  -4.579   4.290
   22    HG2  GLU   4           HG2      GLU   4   8.554  -5.534   6.423
   23    HG3  GLU   4           HG3      GLU   4   7.379  -4.231   6.596
   24    H    VAL   5           H        VAL   5   5.860  -3.084   3.540
   25    HA   VAL   5           HA       VAL   5   4.631  -1.670   5.777
   26    HB   VAL   5           HB       VAL   5   5.915  -0.548   3.282
   27   HG11  VAL   5          HG11      VAL   5   4.475   0.648   5.524
   28   HG12  VAL   5          HG12      VAL   5   6.063   1.361   5.241
   29   HG13  VAL   5          HG13      VAL   5   4.871   1.319   3.942
   30   HG21  VAL   5          HG21      VAL   5   7.004  -1.311   5.953
   31   HG22  VAL   5          HG22      VAL   5   7.708  -1.518   4.349
   32   HG23  VAL   5          HG23      VAL   5   7.690   0.075   5.105
   33    H    SER   6           H        SER   6   2.458  -1.808   5.688
   34    HA   SER   6           HA       SER   6   1.090  -1.448   3.134
   35    HB2  SER   6           HB2      SER   6  -0.969  -1.946   4.585
   36    HB3  SER   6           HB3      SER   6   0.186  -3.259   4.356
   37    HG   SER   6           HG       SER   6   0.956  -2.936   6.398
   38    H    CYS   7           H        CYS   7  -0.506   0.139   2.802
   39    HA   CYS   7           HA       CYS   7  -0.306   2.453   4.616
   40    HB2  CYS   7           HB2      CYS   7  -0.905   2.579   1.659
   41    HB3  CYS   7           HB3      CYS   7  -0.524   3.919   2.735
   42    HA   PRO   8           HA       PRO   8  -4.719   0.985   4.551
   43    HB2  PRO   8           HB2      PRO   8  -5.058   1.138   7.240
   44    HB3  PRO   8           HB3      PRO   8  -4.409  -0.295   6.434
   45    HG2  PRO   8           HG2      PRO   8  -2.953   1.904   7.849
   46    HG3  PRO   8           HG3      PRO   8  -2.677   0.154   7.918
   47    HD2  PRO   8           HD2      PRO   8  -1.159   1.811   6.407
   48    HD3  PRO   8           HD3      PRO   8  -1.504   0.135   5.934
   49    H    ASP   9           H        ASP   9  -3.099   3.606   6.274
   50    HA   ASP   9           HA       ASP   9  -5.251   5.184   6.980
   51    HB2  ASP   9           HB2      ASP   9  -2.661   6.288   5.889
   52    HB3  ASP   9           HB3      ASP   9  -3.737   7.030   7.071
   53    H    GLY  10           H        GLY  10  -3.826   4.675   3.831
   54    HA2  GLY  10           HA2      GLY  10  -5.238   4.971   1.884
   55    HA3  GLY  10           HA3      GLY  10  -5.955   6.363   2.682
   56    H    TYR  11           H        TYR  11  -2.522   5.563   2.399
   57    HA   TYR  11           HA       TYR  11  -2.041   8.200   1.266
   58    HB2  TYR  11           HB2      TYR  11  -0.324   6.080   2.501
   59    HB3  TYR  11           HB3      TYR  11   0.419   7.295   1.466
   60    HD1  TYR  11           HD1      TYR  11  -2.272   7.453   4.059
   61    HD2  TYR  11           HD2      TYR  11   1.526   8.856   2.752
   62    HE1  TYR  11           HE1      TYR  11  -2.204   9.018   5.956
   63    HE2  TYR  11           HE2      TYR  11   1.606  10.423   4.646
   64    HH   TYR  11           HH       TYR  11   0.129  11.524   6.187
   65    H    THR  12           H        THR  12  -0.787   8.527  -0.639
   66    HA   THR  12           HA       THR  12  -1.345   6.533  -2.684
   67    HB   THR  12           HB       THR  12  -1.907   8.838  -3.213
   68    HG1  THR  12           HG1      THR  12  -1.037   7.406  -4.880
   69   HG21  THR  12          HG21      THR  12   0.219  10.335  -3.664
   70   HG22  THR  12          HG22      THR  12  -0.522  10.267  -2.065
   71   HG23  THR  12          HG23      THR  12   0.923   9.316  -2.408
   72    H    CYS  13           H        CYS  13   0.250   5.763  -4.153
   73    HA   CYS  13           HA       CYS  13   2.770   5.201  -2.876
   74    HB2  CYS  13           HB2      CYS  13   1.539   4.369  -5.500
   75    HB3  CYS  13           HB3      CYS  13   3.183   3.926  -5.053
   76    H    CYS  14           H        CYS  14   4.599   6.295  -3.119
   77    HA   CYS  14           HA       CYS  14   5.176   7.685  -5.604
   78    HB2  CYS  14           HB2      CYS  14   5.560   9.833  -4.599
   79    HB3  CYS  14           HB3      CYS  14   3.931   9.321  -4.171
   80    H    ARG  15           H        ARG  15   7.421   8.795  -5.377
   81    HA   ARG  15           HA       ARG  15   9.193   6.825  -4.123
   82    HB2  ARG  15           HB2      ARG  15  10.933   7.763  -5.620
   83    HB3  ARG  15           HB3      ARG  15   9.548   7.124  -6.495
   84    HG2  ARG  15           HG2      ARG  15   8.724   9.306  -6.948
   85    HG3  ARG  15           HG3      ARG  15   9.893  10.040  -5.848
   86    HD2  ARG  15           HD2      ARG  15  10.876  10.422  -7.898
   87    HD3  ARG  15           HD3      ARG  15  11.650   8.917  -7.406
   88    HE   ARG  15           HE       ARG  15  10.651   7.880  -9.177
   89   HH11  ARG  15          HH11      ARG  15   8.977  10.864  -8.533
   90   HH12  ARG  15          HH12      ARG  15   7.965  10.750  -9.935
   91   HH21  ARG  15          HH21      ARG  15   9.323   7.718 -11.025
   92   HH22  ARG  15          HH22      ARG  15   8.162   8.960 -11.351
   93    H    LEU  16           H        LEU  16  10.627   7.351  -2.563
   94    HA   LEU  16           HA       LEU  16  10.387   9.998  -1.379
   95    HB2  LEU  16           HB2      LEU  16  11.463   7.364  -0.484
   96    HB3  LEU  16           HB3      LEU  16  11.991   8.834   0.333
   97    HG   LEU  16           HG       LEU  16  10.166   7.715   1.524
   98   HD11  LEU  16          HD11      LEU  16  10.485  10.266   1.381
   99   HD12  LEU  16          HD12      LEU  16   9.040  10.238   0.370
  100   HD13  LEU  16          HD13      LEU  16   8.968   9.640   2.027
  101   HD21  LEU  16          HD21      LEU  16   8.339   8.425  -0.745
  102   HD22  LEU  16          HD22      LEU  16   9.140   6.856  -0.669
  103   HD23  LEU  16          HD23      LEU  16   8.047   7.351   0.623
  104    H    GLN  17           H        GLN  17  12.103  11.399  -1.021
  105    HA   GLN  17           HA       GLN  17  13.999  11.690  -3.004
  106    HB2  GLN  17           HB2      GLN  17  14.223  12.660  -0.150
  107    HB3  GLN  17           HB3      GLN  17  15.107  13.298  -1.530
  108    HG2  GLN  17           HG2      GLN  17  12.113  13.362  -1.232
  109    HG3  GLN  17           HG3      GLN  17  13.196  14.699  -0.848
  110   HE21  GLN  17          HE21      GLN  17  11.290  13.315  -3.195
  111   HE22  GLN  17          HE22      GLN  17  11.903  14.157  -4.573
  112    H    SER  18           H        SER  18  14.387  10.199   0.192
  113    HA   SER  18           HA       SER  18  17.097   9.679   0.148
  114    HB2  SER  18           HB2      SER  18  16.020   9.189   2.169
  115    HB3  SER  18           HB3      SER  18  14.776   8.219   1.381
  116    HG   SER  18           HG       SER  18  16.436   7.009   2.524
  117    H    GLY  19           H        GLY  19  14.481   7.939  -1.433
  118    HA2  GLY  19           HA2      GLY  19  15.014   6.858  -3.559
  119    HA3  GLY  19           HA3      GLY  19  16.523   6.327  -2.831
  120    H    ALA  20           H        ALA  20  13.166   6.206  -1.658
  121    HA   ALA  20           HA       ALA  20  13.361   3.272  -1.627
  122    HB1  ALA  20           HB1      ALA  20  13.706   4.545   0.644
  123    HB2  ALA  20           HB2      ALA  20  11.946   4.644   0.606
  124    HB3  ALA  20           HB3      ALA  20  12.741   3.070   0.570
  125    H    TRP  21           H        TRP  21  11.299   2.169  -1.595
  126    HA   TRP  21           HA       TRP  21   9.283   3.662  -3.091
  127    HB2  TRP  21           HB2      TRP  21   9.722   0.713  -2.619
  128    HB3  TRP  21           HB3      TRP  21   8.285   1.346  -3.418
  129    HD1  TRP  21           HD1      TRP  21  11.605   0.049  -4.210
  130    HE1  TRP  21           HE1      TRP  21  12.292   0.654  -6.616
  131    HE3  TRP  21           HE3      TRP  21   8.070   3.610  -5.192
  132    HZ2  TRP  21           HZ2      TRP  21  11.447   2.409  -8.659
  133    HZ3  TRP  21           HZ3      TRP  21   8.079   4.704  -7.396
  134    HH2  TRP  21           HH2      TRP  21   9.734   4.115  -9.092
  135    H    GLY  22           H        GLY  22   8.156   4.830  -1.575
  136    HA2  GLY  22           HA2      GLY  22   6.617   3.217   0.360
  137    HA3  GLY  22           HA3      GLY  22   7.348   4.744   0.831
  138    H    CYS  23           H        CYS  23   4.980   5.041   1.422
  139    HA   CYS  23           HA       CYS  23   3.567   6.207  -0.887
  140    HB2  CYS  23           HB2      CYS  23   1.444   5.674   0.285
  141    HB3  CYS  23           HB3      CYS  23   2.366   4.237  -0.144
  142    H    CYS  24           H        CYS  24   3.077   8.301  -0.740
  143    HA   CYS  24           HA       CYS  24   3.305   9.592   1.900
  144    HB2  CYS  24           HB2      CYS  24   3.929  11.659   0.610
  145    HB3  CYS  24           HB3      CYS  24   5.107  10.354   0.518
  Start of MODEL    2
    1    H1   CYS   1           H        CYS   1   1.737   1.993   0.028
    2    HA   CYS   1           HA       CYS   1   0.754   0.079  -1.534
    3    HB2  CYS   1           HB2      CYS   1   1.807   1.227  -3.517
    4    HB3  CYS   1           HB3      CYS   1   0.951   2.294  -2.409
    5    H    ASP   2           H        ASP   2   2.674  -1.253   0.045
    6    HA   ASP   2           HA       ASP   2   3.996  -2.791  -2.026
    7    HB2  ASP   2           HB2      ASP   2   5.519  -1.344   0.140
    8    HB3  ASP   2           HB3      ASP   2   6.179  -2.734  -0.717
    9    H    MET   3           H        MET   3   5.220  -4.695  -0.937
   10    HA   MET   3           HA       MET   3   3.333  -6.138   0.593
   11    HB2  MET   3           HB2      MET   3   5.317  -6.912  -0.990
   12    HB3  MET   3           HB3      MET   3   6.192  -6.985   0.534
   13    HG2  MET   3           HG2      MET   3   4.362  -8.448   1.411
   14    HG3  MET   3           HG3      MET   3   3.709  -8.495  -0.225
   15    HE1  MET   3           HE1      MET   3   4.151 -11.335  -0.838
   16    HE2  MET   3           HE2      MET   3   4.176  -9.885  -1.842
   17    HE3  MET   3           HE3      MET   3   5.461 -11.083  -1.992
   18    H    GLU   4           H        GLU   4   6.351  -4.499   1.434
   19    HA   GLU   4           HA       GLU   4   6.047  -5.232   4.235
   20    HB2  GLU   4           HB2      GLU   4   8.166  -3.543   2.895
   21    HB3  GLU   4           HB3      GLU   4   8.205  -4.124   4.553
   22    HG2  GLU   4           HG2      GLU   4   8.562  -6.331   3.902
   23    HG3  GLU   4           HG3      GLU   4   8.026  -6.027   2.251
   24    H    VAL   5           H        VAL   5   6.067  -2.317   2.218
   25    HA   VAL   5           HA       VAL   5   5.149  -0.729   4.502
   26    HB   VAL   5           HB       VAL   5   5.998   0.178   1.748
   27   HG11  VAL   5          HG11      VAL   5   5.394   1.777   4.233
   28   HG12  VAL   5          HG12      VAL   5   6.000   2.425   2.709
   29   HG13  VAL   5          HG13      VAL   5   4.394   1.700   2.783
   30   HG21  VAL   5          HG21      VAL   5   8.107   0.200   2.461
   31   HG22  VAL   5          HG22      VAL   5   7.659   1.034   3.949
   32   HG23  VAL   5          HG23      VAL   5   7.570  -0.726   3.862
   33    H    SER   6           H        SER   6   3.002  -1.240   4.709
   34    HA   SER   6           HA       SER   6   1.276  -0.977   2.358
   35    HB2  SER   6           HB2      SER   6   0.528  -1.918   5.134
   36    HB3  SER   6           HB3      SER   6  -0.435  -2.074   3.665
   37    HG   SER   6           HG       SER   6   1.014  -3.913   4.508
   38    H    CYS   7           H        CYS   7  -0.484   0.429   2.298
   39    HA   CYS   7           HA       CYS   7  -0.514   2.522   4.370
   40    HB2  CYS   7           HB2      CYS   7  -0.392   2.762   1.396
   41    HB3  CYS   7           HB3      CYS   7  -1.303   3.971   2.296
   42    HA   PRO   8           HA       PRO   8  -4.735   0.641   3.903
   43    HB2  PRO   8           HB2      PRO   8  -5.190   0.427   6.571
   44    HB3  PRO   8           HB3      PRO   8  -4.357  -0.821   5.635
   45    HG2  PRO   8           HG2      PRO   8  -3.206   1.330   7.372
   46    HG3  PRO   8           HG3      PRO   8  -2.741  -0.377   7.248
   47    HD2  PRO   8           HD2      PRO   8  -1.360   1.602   6.021
   48    HD3  PRO   8           HD3      PRO   8  -1.500  -0.030   5.337
   49    H    ASP   9           H        ASP   9  -3.480   3.185   6.005
   50    HA   ASP   9           HA       ASP   9  -5.819   4.430   6.779
   51    HB2  ASP   9           HB2      ASP   9  -3.175   5.703   6.044
   52    HB3  ASP   9           HB3      ASP   9  -4.471   6.517   6.917
   53    H    GLY  10           H        GLY  10  -4.226   4.465   3.671
   54    HA2  GLY  10           HA2      GLY  10  -5.609   4.845   1.709
   55    HA3  GLY  10           HA3      GLY  10  -6.471   6.071   2.627
   56    H    TYR  11           H        TYR  11  -2.973   5.604   2.404
   57    HA   TYR  11           HA       TYR  11  -2.703   8.381   1.566
   58    HB2  TYR  11           HB2      TYR  11  -0.803   6.315   2.635
   59    HB3  TYR  11           HB3      TYR  11  -0.192   7.765   1.846
   60    HD1  TYR  11           HD1      TYR  11   0.347   9.537   3.213
   61    HD2  TYR  11           HD2      TYR  11  -2.709   6.853   4.461
   62    HE1  TYR  11           HE1      TYR  11   0.120  10.785   5.320
   63    HE2  TYR  11           HE2      TYR  11  -2.945   8.094   6.572
   64    HH   TYR  11           HH       TYR  11  -0.939  10.946   7.260
   65    H    THR  12           H        THR  12  -1.058   8.899  -0.117
   66    HA   THR  12           HA       THR  12  -1.537   7.232  -2.456
   67    HB   THR  12           HB       THR  12   0.004   9.814  -2.476
   68    HG1  THR  12           HG1      THR  12  -2.802   9.707  -2.827
   69   HG21  THR  12          HG21      THR  12  -1.294   8.044  -4.442
   70   HG22  THR  12          HG22      THR  12  -1.556   9.770  -4.691
   71   HG23  THR  12          HG23      THR  12   0.085   9.127  -4.628
   72    H    CYS  13           H        CYS  13   0.147   6.539  -3.861
   73    HA   CYS  13           HA       CYS  13   2.549   5.763  -2.423
   74    HB2  CYS  13           HB2      CYS  13   1.157   4.212  -3.912
   75    HB3  CYS  13           HB3      CYS  13   1.872   5.065  -5.276
   76    H    CYS  14           H        CYS  14   4.450   6.745  -2.605
   77    HA   CYS  14           HA       CYS  14   5.139   8.179  -5.046
   78    HB2  CYS  14           HB2      CYS  14   5.655  10.247  -3.959
   79    HB3  CYS  14           HB3      CYS  14   4.012   9.815  -3.499
   80    H    ARG  15           H        ARG  15   7.441   8.902  -5.016
   81    HA   ARG  15           HA       ARG  15   9.062   6.885  -3.638
   82    HB2  ARG  15           HB2      ARG  15   9.757   8.663  -5.984
   83    HB3  ARG  15           HB3      ARG  15  10.792   7.414  -5.304
   84    HG2  ARG  15           HG2      ARG  15   9.896   6.301  -7.083
   85    HG3  ARG  15           HG3      ARG  15   8.743   5.867  -5.820
   86    HD2  ARG  15           HD2      ARG  15   7.096   7.222  -6.668
   87    HD3  ARG  15           HD3      ARG  15   8.245   8.323  -7.427
   88    HE   ARG  15           HE       ARG  15   8.077   7.079  -9.325
   89   HH11  ARG  15          HH11      ARG  15   7.116   5.103  -6.625
   90   HH12  ARG  15          HH12      ARG  15   6.656   3.753  -7.609
   91   HH21  ARG  15          HH21      ARG  15   7.475   5.308 -10.631
   92   HH22  ARG  15          HH22      ARG  15   6.862   3.871  -9.888
   93    H    LEU  16           H        LEU  16  10.828   7.420  -2.388
   94    HA   LEU  16           HA       LEU  16  10.827  10.145  -1.352
   95    HB2  LEU  16           HB2      LEU  16  12.155   7.613  -0.405
   96    HB3  LEU  16           HB3      LEU  16  12.360   9.180   0.376
   97    HG   LEU  16           HG       LEU  16   9.678   7.849   0.060
   98   HD11  LEU  16          HD11      LEU  16  11.323   7.814   2.568
   99   HD12  LEU  16          HD12      LEU  16   9.877   6.883   2.179
  100   HD13  LEU  16          HD13      LEU  16  11.406   6.510   1.383
  101   HD21  LEU  16          HD21      LEU  16  10.704  10.322   1.288
  102   HD22  LEU  16          HD22      LEU  16   9.106   9.950   0.640
  103   HD23  LEU  16          HD23      LEU  16   9.550   9.407   2.258
  104    H    GLN  17           H        GLN  17  12.558  11.522  -1.421
  105    HA   GLN  17           HA       GLN  17  14.271  11.477  -3.585
  106    HB2  GLN  17           HB2      GLN  17  13.814  13.508  -2.324
  107    HB3  GLN  17           HB3      GLN  17  14.652  12.856  -0.922
  108    HG2  GLN  17           HG2      GLN  17  16.752  12.902  -2.097
  109    HG3  GLN  17           HG3      GLN  17  15.948  13.414  -3.580
  110   HE21  GLN  17          HE21      GLN  17  15.788  14.446  -0.186
  111   HE22  GLN  17          HE22      GLN  17  16.083  16.118  -0.504
  112    H    SER  18           H        SER  18  14.841  10.329  -0.290
  113    HA   SER  18           HA       SER  18  17.553   9.783  -0.440
  114    HB2  SER  18           HB2      SER  18  17.272   8.430   1.462
  115    HB3  SER  18           HB3      SER  18  15.936   9.575   1.565
  116    HG   SER  18           HG       SER  18  14.540   8.014   0.897
  117    H    GLY  19           H        GLY  19  14.820   7.923  -1.641
  118    HA2  GLY  19           HA2      GLY  19  15.210   6.602  -3.663
  119    HA3  GLY  19           HA3      GLY  19  16.747   6.118  -2.963
  120    H    ALA  20           H        ALA  20  13.432   6.201  -1.666
  121    HA   ALA  20           HA       ALA  20  13.467   3.290  -1.430
  122    HB1  ALA  20           HB1      ALA  20  13.624   5.176   0.829
  123    HB2  ALA  20           HB2      ALA  20  12.454   3.867   0.999
  124    HB3  ALA  20           HB3      ALA  20  14.154   3.498   0.708
  125    H    TRP  21           H        TRP  21  11.261   2.605  -0.355
  126    HA   TRP  21           HA       TRP  21   9.192   3.926  -1.935
  127    HB2  TRP  21           HB2      TRP  21   8.977   1.360  -0.352
  128    HB3  TRP  21           HB3      TRP  21   7.873   1.940  -1.596
  129    HD1  TRP  21           HD1      TRP  21  11.186   0.141  -1.137
  130    HE1  TRP  21           HE1      TRP  21  11.975  -0.760  -3.415
  131    HE3  TRP  21           HE3      TRP  21   7.762   2.447  -4.151
  132    HZ2  TRP  21           HZ2      TRP  21  11.242  -0.524  -6.131
  133    HZ3  TRP  21           HZ3      TRP  21   7.875   2.057  -6.578
  134    HH2  TRP  21           HH2      TRP  21   9.580   0.602  -7.545
  135    H    GLY  22           H        GLY  22   7.400   4.898  -1.090
  136    HA2  GLY  22           HA2      GLY  22   6.681   4.668   1.677
  137    HA3  GLY  22           HA3      GLY  22   7.477   6.193   1.321
  138    H    CYS  23           H        CYS  23   5.153   6.677   2.227
  139    HA   CYS  23           HA       CYS  23   3.315   6.912  -0.063
  140    HB2  CYS  23           HB2      CYS  23   2.898   6.274   2.776
  141    HB3  CYS  23           HB3      CYS  23   1.780   7.474   2.135
  142    H    CYS  24           H        CYS  24   1.962   8.874  -0.092
  143    HA   CYS  24           HA       CYS  24   3.229  11.190   1.193
  144    HB2  CYS  24           HB2      CYS  24   2.775  10.735  -1.732
  145    HB3  CYS  24           HB3      CYS  24   2.680  12.372  -1.089
  Start of MODEL    3
    1    H1   CYS   1           H        CYS   1   5.011   0.026  -4.881
    2    HA   CYS   1           HA       CYS   1   5.577  -0.127  -2.015
    3    HB2  CYS   1           HB2      CYS   1   2.774  -0.051  -3.152
    4    HB3  CYS   1           HB3      CYS   1   3.197  -0.302  -1.462
    5    H    ASP   2           H        ASP   2   4.597  -2.151  -1.056
    6    HA   ASP   2           HA       ASP   2   4.056  -4.305  -2.907
    7    HB2  ASP   2           HB2      ASP   2   5.930  -5.707  -1.871
    8    HB3  ASP   2           HB3      ASP   2   6.405  -4.483  -3.044
    9    H    MET   3           H        MET   3   4.195  -6.479  -1.418
   10    HA   MET   3           HA       MET   3   2.031  -6.292   0.338
   11    HB2  MET   3           HB2      MET   3   4.060  -8.373  -0.298
   12    HB3  MET   3           HB3      MET   3   3.118  -8.583   1.171
   13    HG2  MET   3           HG2      MET   3   1.965  -9.763  -0.486
   14    HG3  MET   3           HG3      MET   3   1.061  -8.267  -0.263
   15    HE1  MET   3           HE1      MET   3   0.504 -10.062  -2.341
   16    HE2  MET   3           HE2      MET   3   0.628  -9.315  -3.934
   17    HE3  MET   3           HE3      MET   3   1.853 -10.467  -3.403
   18    H    GLU   4           H        GLU   4   5.501  -6.638   1.065
   19    HA   GLU   4           HA       GLU   4   5.374  -6.676   3.822
   20    HB2  GLU   4           HB2      GLU   4   7.407  -6.892   2.229
   21    HB3  GLU   4           HB3      GLU   4   7.527  -5.146   2.391
   22    HG2  GLU   4           HG2      GLU   4   9.006  -6.051   3.974
   23    HG3  GLU   4           HG3      GLU   4   7.600  -5.497   4.883
   24    H    VAL   5           H        VAL   5   6.197  -3.758   1.941
   25    HA   VAL   5           HA       VAL   5   4.973  -2.148   4.081
   26    HB   VAL   5           HB       VAL   5   6.987  -1.216   2.033
   27   HG11  VAL   5          HG11      VAL   5   6.483   0.814   2.775
   28   HG12  VAL   5          HG12      VAL   5   5.328   0.139   3.925
   29   HG13  VAL   5          HG13      VAL   5   7.019   0.335   4.386
   30   HG21  VAL   5          HG21      VAL   5   7.421  -2.098   4.886
   31   HG22  VAL   5          HG22      VAL   5   8.017  -2.902   3.434
   32   HG23  VAL   5          HG23      VAL   5   8.629  -1.308   3.872
   33    H    SER   6           H        SER   6   3.164  -1.087   3.634
   34    HA   SER   6           HA       SER   6   2.633  -0.222   0.888
   35    HB2  SER   6           HB2      SER   6   0.531  -1.235   0.735
   36    HB3  SER   6           HB3      SER   6   1.507  -2.485   1.505
   37    HG   SER   6           HG       SER   6  -0.713  -1.441   2.408
   38    H    CYS   7           H        CYS   7   0.165   0.847   1.163
   39    HA   CYS   7           HA       CYS   7   0.545   2.869   3.273
   40    HB2  CYS   7           HB2      CYS   7  -0.779   3.165   0.568
   41    HB3  CYS   7           HB3      CYS   7  -0.675   4.429   1.789
   42    HA   PRO   8           HA       PRO   8  -3.391   0.590   4.210
   43    HB2  PRO   8           HB2      PRO   8  -2.909   0.380   6.873
   44    HB3  PRO   8           HB3      PRO   8  -2.320  -0.799   5.695
   45    HG2  PRO   8           HG2      PRO   8  -0.867   1.480   6.981
   46    HG3  PRO   8           HG3      PRO   8  -0.310  -0.176   6.684
   47    HD2  PRO   8           HD2      PRO   8   0.389   1.903   5.096
   48    HD3  PRO   8           HD3      PRO   8   0.185   0.253   4.474
   49    H    ASP   9           H        ASP   9  -1.756   3.271   5.827
   50    HA   ASP   9           HA       ASP   9  -3.819   4.302   7.344
   51    HB2  ASP   9           HB2      ASP   9  -1.556   5.648   5.883
   52    HB3  ASP   9           HB3      ASP   9  -2.693   6.563   6.869
   53    H    GLY  10           H        GLY  10  -3.334   4.448   3.889
   54    HA2  GLY  10           HA2      GLY  10  -5.308   4.675   2.490
   55    HA3  GLY  10           HA3      GLY  10  -5.933   5.827   3.661
   56    H    TYR  11           H        TYR  11  -2.672   5.681   2.300
   57    HA   TYR  11           HA       TYR  11  -3.146   8.344   1.132
   58    HB2  TYR  11           HB2      TYR  11  -0.738   7.153   2.475
   59    HB3  TYR  11           HB3      TYR  11  -0.557   8.481   1.335
   60    HD1  TYR  11           HD1      TYR  11  -2.736  10.256   1.885
   61    HD2  TYR  11           HD2      TYR  11  -0.437   7.947   4.621
   62    HE1  TYR  11           HE1      TYR  11  -3.256  11.866   3.671
   63    HE2  TYR  11           HE2      TYR  11  -0.952   9.550   6.415
   64    HH   TYR  11           HH       TYR  11  -2.397  11.256   7.001
   65    H    THR  12           H        THR  12  -1.238   8.755  -0.567
   66    HA   THR  12           HA       THR  12  -1.635   6.710  -2.603
   67    HB   THR  12           HB       THR  12  -0.195   9.335  -2.966
   68    HG1  THR  12           HG1      THR  12  -2.985   8.804  -3.243
   69   HG21  THR  12          HG21      THR  12   0.118   8.421  -4.991
   70   HG22  THR  12          HG22      THR  12  -1.069   7.150  -4.697
   71   HG23  THR  12          HG23      THR  12  -1.598   8.737  -5.254
   72    H    CYS  13           H        CYS  13   0.061   5.751  -3.776
   73    HA   CYS  13           HA       CYS  13   2.435   5.269  -2.203
   74    HB2  CYS  13           HB2      CYS  13   1.190   4.068  -4.629
   75    HB3  CYS  13           HB3      CYS  13   2.923   3.848  -4.404
   76    H    CYS  14           H        CYS  14   3.928   6.837  -2.248
   77    HA   CYS  14           HA       CYS  14   4.771   7.848  -4.885
   78    HB2  CYS  14           HB2      CYS  14   5.032   9.339  -2.271
   79    HB3  CYS  14           HB3      CYS  14   5.311   9.963  -3.894
   80    H    ARG  15           H        ARG  15   7.070   8.593  -4.928
   81    HA   ARG  15           HA       ARG  15   8.744   6.811  -3.282
   82    HB2  ARG  15           HB2      ARG  15  10.315   6.721  -5.159
   83    HB3  ARG  15           HB3      ARG  15   8.723   6.148  -5.636
   84    HG2  ARG  15           HG2      ARG  15   8.264   8.137  -6.833
   85    HG3  ARG  15           HG3      ARG  15   9.668   8.954  -6.143
   86    HD2  ARG  15           HD2      ARG  15  10.426   8.376  -8.248
   87    HD3  ARG  15           HD3      ARG  15  11.012   7.038  -7.260
   88    HE   ARG  15           HE       ARG  15   9.651   5.633  -8.437
   89   HH11  ARG  15          HH11      ARG  15   8.567   8.907  -8.911
   90   HH12  ARG  15          HH12      ARG  15   7.388   8.482 -10.108
   91   HH21  ARG  15          HH21      ARG  15   8.104   5.061 -10.012
   92   HH22  ARG  15          HH22      ARG  15   7.125   6.294 -10.733
   93    H    LEU  16           H        LEU  16  10.634   7.610  -2.406
   94    HA   LEU  16           HA       LEU  16  10.761  10.510  -2.191
   95    HB2  LEU  16           HB2      LEU  16  11.940   8.220  -0.681
   96    HB3  LEU  16           HB3      LEU  16  12.667   9.819  -0.544
   97    HG   LEU  16           HG       LEU  16  10.146  10.483   0.005
   98   HD11  LEU  16          HD11      LEU  16   9.214   8.687   1.491
   99   HD12  LEU  16          HD12      LEU  16   9.146   8.344  -0.238
  100   HD13  LEU  16          HD13      LEU  16  10.379   7.580   0.765
  101   HD21  LEU  16          HD21      LEU  16  10.755  10.526   2.292
  102   HD22  LEU  16          HD22      LEU  16  11.884   9.186   2.092
  103   HD23  LEU  16          HD23      LEU  16  12.246  10.758   1.379
  104    H    GLN  17           H        GLN  17  12.562  11.749  -2.701
  105    HA   GLN  17           HA       GLN  17  13.957  11.151  -5.006
  106    HB2  GLN  17           HB2      GLN  17  13.682  13.407  -3.840
  107    HB3  GLN  17           HB3      GLN  17  15.060  12.944  -2.850
  108    HG2  GLN  17           HG2      GLN  17  16.261  12.554  -5.093
  109    HG3  GLN  17           HG3      GLN  17  14.957  13.521  -5.780
  110   HE21  GLN  17          HE21      GLN  17  16.120  15.291  -6.329
  111   HE22  GLN  17          HE22      GLN  17  16.916  16.317  -5.190
  112    H    SER  18           H        SER  18  14.975  10.719  -1.640
  113    HA   SER  18           HA       SER  18  17.600   9.955  -2.018
  114    HB2  SER  18           HB2      SER  18  17.391   8.714   0.108
  115    HB3  SER  18           HB3      SER  18  16.626  10.301   0.203
  116    HG   SER  18           HG       SER  18  14.944   9.217   0.832
  117    H    GLY  19           H        GLY  19  14.661   8.070  -2.442
  118    HA2  GLY  19           HA2      GLY  19  14.729   6.343  -4.178
  119    HA3  GLY  19           HA3      GLY  19  16.322   5.907  -3.577
  120    H    ALA  20           H        ALA  20  13.322   6.552  -1.794
  121    HA   ALA  20           HA       ALA  20  13.295   3.739  -0.939
  122    HB1  ALA  20           HB1      ALA  20  14.222   5.680   0.701
  123    HB2  ALA  20           HB2      ALA  20  12.508   5.685   1.120
  124    HB3  ALA  20           HB3      ALA  20  13.446   4.198   1.259
  125    H    TRP  21           H        TRP  21  11.157   3.536   0.557
  126    HA   TRP  21           HA       TRP  21   8.987   4.228  -1.255
  127    HB2  TRP  21           HB2      TRP  21   7.667   2.621  -0.018
  128    HB3  TRP  21           HB3      TRP  21   9.234   1.908  -0.389
  129    HD1  TRP  21           HD1      TRP  21  10.679   1.087   1.612
  130    HE1  TRP  21           HE1      TRP  21  10.357   1.049   4.165
  131    HE3  TRP  21           HE3      TRP  21   6.545   4.074   1.952
  132    HZ2  TRP  21           HZ2      TRP  21   8.585   2.141   6.071
  133    HZ3  TRP  21           HZ3      TRP  21   5.598   4.528   4.177
  134    HH2  TRP  21           HH2      TRP  21   6.598   3.580   6.193
  135    H    GLY  22           H        GLY  22   7.057   5.257  -0.580
  136    HA2  GLY  22           HA2      GLY  22   6.837   6.396   2.050
  137    HA3  GLY  22           HA3      GLY  22   7.279   7.582   0.832
  138    H    CYS  23           H        CYS  23   4.860   7.457   2.432
  139    HA   CYS  23           HA       CYS  23   2.867   7.058   0.297
  140    HB2  CYS  23           HB2      CYS  23   2.505   6.919   3.297
  141    HB3  CYS  23           HB3      CYS  23   1.203   6.786   2.120
  142    H    CYS  24           H        CYS  24   1.657   8.747  -0.329
  143    HA   CYS  24           HA       CYS  24   2.220  11.337   0.883
  144    HB2  CYS  24           HB2      CYS  24   0.804  10.543  -1.665
  145    HB3  CYS  24           HB3      CYS  24   0.941  12.208  -1.109
  Start of MODEL    4
    1    H1   CYS   1           H        CYS   1   0.089  -0.754  -1.869
    2    HA   CYS   1           HA       CYS   1   0.128  -0.728  -4.780
    3    HB2  CYS   1           HB2      CYS   1   0.962   1.138  -3.090
    4    HB3  CYS   1           HB3      CYS   1   2.448   0.194  -3.143
    5    H    ASP   2           H        ASP   2   2.210  -1.912  -2.141
    6    HA   ASP   2           HA       ASP   2   3.048  -4.111  -3.896
    7    HB2  ASP   2           HB2      ASP   2   4.855  -2.278  -2.320
    8    HB3  ASP   2           HB3      ASP   2   5.374  -3.859  -2.896
    9    H    MET   3           H        MET   3   3.863  -5.980  -2.759
   10    HA   MET   3           HA       MET   3   2.307  -6.705  -0.551
   11    HB2  MET   3           HB2      MET   3   3.794  -8.686  -0.403
   12    HB3  MET   3           HB3      MET   3   3.215  -8.382  -2.035
   13    HG2  MET   3           HG2      MET   3   5.494  -7.044  -2.193
   14    HG3  MET   3           HG3      MET   3   5.949  -8.172  -0.918
   15    HE1  MET   3           HE1      MET   3   7.287 -10.938  -2.800
   16    HE2  MET   3           HE2      MET   3   7.961  -9.308  -2.817
   17    HE3  MET   3           HE3      MET   3   7.191  -9.928  -1.357
   18    H    GLU   4           H        GLU   4   5.663  -5.595  -0.748
   19    HA   GLU   4           HA       GLU   4   6.028  -5.796   2.113
   20    HB2  GLU   4           HB2      GLU   4   7.887  -6.224   0.532
   21    HB3  GLU   4           HB3      GLU   4   7.817  -4.543   0.023
   22    HG2  GLU   4           HG2      GLU   4   9.608  -5.156   1.696
   23    HG3  GLU   4           HG3      GLU   4   8.599  -3.765   2.087
   24    H    VAL   5           H        VAL   5   5.948  -3.152  -0.273
   25    HA   VAL   5           HA       VAL   5   5.727  -1.187   1.863
   26    HB   VAL   5           HB       VAL   5   5.768  -0.762  -1.128
   27   HG11  VAL   5          HG11      VAL   5   4.774   1.134  -0.140
   28   HG12  VAL   5          HG12      VAL   5   5.906   1.121   1.212
   29   HG13  VAL   5          HG13      VAL   5   6.463   1.568  -0.401
   30   HG21  VAL   5          HG21      VAL   5   8.133   0.187   0.004
   31   HG22  VAL   5          HG22      VAL   5   7.869  -1.391   0.746
   32   HG23  VAL   5          HG23      VAL   5   7.938  -1.243  -1.010
   33    H    SER   6           H        SER   6   3.812  -0.689   2.679
   34    HA   SER   6           HA       SER   6   1.482  -0.639   0.879
   35    HB2  SER   6           HB2      SER   6   1.354  -2.629   2.315
   36    HB3  SER   6           HB3      SER   6   1.517  -1.613   3.747
   37    HG   SER   6           HG       SER   6  -0.695  -2.228   2.391
   38    H    CYS   7           H        CYS   7  -0.367   0.640   1.882
   39    HA   CYS   7           HA       CYS   7   0.663   2.928   3.421
   40    HB2  CYS   7           HB2      CYS   7  -0.997   2.961   0.905
   41    HB3  CYS   7           HB3      CYS   7  -0.948   4.333   2.007
   42    HA   PRO   8           HA       PRO   8  -3.131   1.129   5.404
   43    HB2  PRO   8           HB2      PRO   8  -2.115   1.163   7.921
   44    HB3  PRO   8           HB3      PRO   8  -1.867  -0.184   6.804
   45    HG2  PRO   8           HG2      PRO   8  -0.028   2.079   7.480
   46    HG3  PRO   8           HG3      PRO   8   0.343   0.357   7.283
   47    HD2  PRO   8           HD2      PRO   8   0.829   2.182   5.343
   48    HD3  PRO   8           HD3      PRO   8   0.390   0.500   4.983
   49    H    ASP   9           H        ASP   9  -1.023   3.817   6.292
   50    HA   ASP   9           HA       ASP   9  -2.632   5.188   8.067
   51    HB2  ASP   9           HB2      ASP   9  -0.234   5.700   7.060
   52    HB3  ASP   9           HB3      ASP   9  -1.159   6.758   5.998
   53    H    GLY  10           H        GLY  10  -2.921   4.899   4.598
   54    HA2  GLY  10           HA2      GLY  10  -5.141   5.136   3.638
   55    HA3  GLY  10           HA3      GLY  10  -5.418   6.464   4.755
   56    H    TYR  11           H        TYR  11  -2.558   5.878   2.758
   57    HA   TYR  11           HA       TYR  11  -3.251   8.245   1.158
   58    HB2  TYR  11           HB2      TYR  11  -0.779   7.742   2.758
   59    HB3  TYR  11           HB3      TYR  11  -0.636   8.620   1.239
   60    HD1  TYR  11           HD1      TYR  11  -2.870  10.361   1.096
   61    HD2  TYR  11           HD2      TYR  11  -0.671   9.190   4.546
   62    HE1  TYR  11           HE1      TYR  11  -3.551  12.436   2.227
   63    HE2  TYR  11           HE2      TYR  11  -1.347  11.262   5.687
   64    HH   TYR  11           HH       TYR  11  -2.167  13.785   4.583
   65    H    THR  12           H        THR  12  -1.422   8.418  -0.660
   66    HA   THR  12           HA       THR  12  -1.597   5.897  -2.104
   67    HB   THR  12           HB       THR  12  -2.245   7.859  -3.347
   68    HG1  THR  12           HG1      THR  12  -1.331   6.826  -4.946
   69   HG21  THR  12          HG21      THR  12  -1.261   9.834  -3.047
   70   HG22  THR  12          HG22      THR  12  -0.083   9.076  -1.976
   71   HG23  THR  12          HG23      THR  12   0.247   9.198  -3.704
   72    H    CYS  13           H        CYS  13   0.232   4.978  -3.208
   73    HA   CYS  13           HA       CYS  13   2.590   4.960  -1.553
   74    HB2  CYS  13           HB2      CYS  13   3.373   3.196  -3.099
   75    HB3  CYS  13           HB3      CYS  13   1.761   2.864  -2.473
   76    H    CYS  14           H        CYS  14   4.487   5.940  -1.918
   77    HA   CYS  14           HA       CYS  14   5.027   7.076  -4.565
   78    HB2  CYS  14           HB2      CYS  14   5.429   8.665  -2.028
   79    HB3  CYS  14           HB3      CYS  14   5.602   9.228  -3.687
   80    H    ARG  15           H        ARG  15   7.362   8.180  -4.374
   81    HA   ARG  15           HA       ARG  15   9.112   6.337  -2.893
   82    HB2  ARG  15           HB2      ARG  15  10.669   6.505  -4.916
   83    HB3  ARG  15           HB3      ARG  15   9.244   5.488  -5.081
   84    HG2  ARG  15           HG2      ARG  15   9.015   8.315  -5.938
   85    HG3  ARG  15           HG3      ARG  15   9.972   7.224  -6.941
   86    HD2  ARG  15           HD2      ARG  15   7.277   6.345  -6.026
   87    HD3  ARG  15           HD3      ARG  15   7.386   7.526  -7.331
   88    HE   ARG  15           HE       ARG  15   9.107   5.394  -7.911
   89   HH11  ARG  15          HH11      ARG  15   5.702   6.068  -7.638
   90   HH12  ARG  15          HH12      ARG  15   5.237   4.856  -8.786
   91   HH21  ARG  15          HH21      ARG  15   8.508   3.795  -9.423
   92   HH22  ARG  15          HH22      ARG  15   6.834   3.563  -9.799
   93    H    LEU  16           H        LEU  16  10.829   7.249  -1.898
   94    HA   LEU  16           HA       LEU  16  10.995  10.154  -1.943
   95    HB2  LEU  16           HB2      LEU  16  11.894   7.992  -0.123
   96    HB3  LEU  16           HB3      LEU  16  12.832   9.483  -0.133
   97    HG   LEU  16           HG       LEU  16  10.486  10.600   0.227
   98   HD11  LEU  16          HD11      LEU  16  10.034   7.839   1.351
   99   HD12  LEU  16          HD12      LEU  16   8.971   9.234   1.536
  100   HD13  LEU  16          HD13      LEU  16   9.217   8.518  -0.057
  101   HD21  LEU  16          HD21      LEU  16  12.620  10.073   1.814
  102   HD22  LEU  16          HD22      LEU  16  11.192  10.972   2.327
  103   HD23  LEU  16          HD23      LEU  16  11.331   9.253   2.696
  104    H    GLN  17           H        GLN  17  12.885  11.316  -2.372
  105    HA   GLN  17           HA       GLN  17  14.410  10.534  -4.534
  106    HB2  GLN  17           HB2      GLN  17  14.959  12.547  -2.361
  107    HB3  GLN  17           HB3      GLN  17  16.034  12.336  -3.737
  108    HG2  GLN  17           HG2      GLN  17  13.110  12.976  -4.000
  109    HG3  GLN  17           HG3      GLN  17  14.378  14.199  -3.937
  110   HE21  GLN  17          HE21      GLN  17  12.536  13.701  -6.077
  111   HE22  GLN  17          HE22      GLN  17  13.475  13.280  -7.465
  112    H    SER  18           H        SER  18  15.328  10.444  -1.097
  113    HA   SER  18           HA       SER  18  17.893   9.457  -1.343
  114    HB2  SER  18           HB2      SER  18  16.049   8.492   0.833
  115    HB3  SER  18           HB3      SER  18  17.772   8.858   0.930
  116    HG   SER  18           HG       SER  18  16.154  10.453   1.791
  117    H    GLY  19           H        GLY  19  14.830   7.736  -1.514
  118    HA2  GLY  19           HA2      GLY  19  14.795   5.778  -2.999
  119    HA3  GLY  19           HA3      GLY  19  16.337   5.317  -2.294
  120    H    ALA  20           H        ALA  20  13.607   6.549  -0.460
  121    HA   ALA  20           HA       ALA  20  13.384   3.908   0.828
  122    HB1  ALA  20           HB1      ALA  20  13.317   4.877   2.852
  123    HB2  ALA  20           HB2      ALA  20  14.060   6.248   2.028
  124    HB3  ALA  20           HB3      ALA  20  12.316   6.216   2.290
  125    H    TRP  21           H        TRP  21  11.208   3.462   1.787
  126    HA   TRP  21           HA       TRP  21   9.171   4.052  -0.206
  127    HB2  TRP  21           HB2      TRP  21   7.865   2.297   0.935
  128    HB3  TRP  21           HB3      TRP  21   9.467   1.727   0.474
  129    HD1  TRP  21           HD1      TRP  21  11.087   0.958   2.391
  130    HE1  TRP  21           HE1      TRP  21  10.795   0.611   4.924
  131    HE3  TRP  21           HE3      TRP  21   6.584   3.295   3.015
  132    HZ2  TRP  21           HZ2      TRP  21   8.904   1.243   6.923
  133    HZ3  TRP  21           HZ3      TRP  21   5.601   3.380   5.269
  134    HH2  TRP  21           HH2      TRP  21   6.739   2.374   7.181
  135    H    GLY  22           H        GLY  22   7.330   5.202   0.146
  136    HA2  GLY  22           HA2      GLY  22   6.606   6.024   2.839
  137    HA3  GLY  22           HA3      GLY  22   7.141   7.316   1.775
  138    H    CYS  23           H        CYS  23   4.737   7.723   2.657
  139    HA   CYS  23           HA       CYS  23   3.000   7.043   0.389
  140    HB2  CYS  23           HB2      CYS  23   2.230   6.937   3.312
  141    HB3  CYS  23           HB3      CYS  23   1.084   6.841   1.979
  142    H    CYS  24           H        CYS  24   1.880   8.716  -0.427
  143    HA   CYS  24           HA       CYS  24   2.237  11.321   0.855
  144    HB2  CYS  24           HB2      CYS  24   1.154  10.732  -1.905
  145    HB3  CYS  24           HB3      CYS  24   1.695  12.289  -1.284
  Start of MODEL    5
    1    H1   CYS   1           H        CYS   1   3.380   2.689  -0.482
    2    HA   CYS   1           HA       CYS   1   2.103   0.390   0.054
    3    HB2  CYS   1           HB2      CYS   1   1.605   0.222  -2.437
    4    HB3  CYS   1           HB3      CYS   1   1.226   1.760  -1.668
    5    H    ASP   2           H        ASP   2   2.916  -1.547   0.505
    6    HA   ASP   2           HA       ASP   2   4.357  -3.010  -1.504
    7    HB2  ASP   2           HB2      ASP   2   5.743  -1.947   0.914
    8    HB3  ASP   2           HB3      ASP   2   6.153  -3.573   0.373
    9    H    MET   3           H        MET   3   5.035  -5.240  -0.509
   10    HA   MET   3           HA       MET   3   2.648  -6.394   0.546
   11    HB2  MET   3           HB2      MET   3   3.896  -8.510   0.479
   12    HB3  MET   3           HB3      MET   3   4.043  -7.623  -1.032
   13    HG2  MET   3           HG2      MET   3   6.232  -6.711   0.035
   14    HG3  MET   3           HG3      MET   3   6.088  -8.125   1.076
   15    HE1  MET   3           HE1      MET   3   7.078  -9.874   0.843
   16    HE2  MET   3           HE2      MET   3   6.969 -10.983  -0.524
   17    HE3  MET   3           HE3      MET   3   8.399  -9.971  -0.321
   18    H    GLU   4           H        GLU   4   5.831  -5.624   1.856
   19    HA   GLU   4           HA       GLU   4   5.346  -6.860   4.392
   20    HB2  GLU   4           HB2      GLU   4   7.407  -5.618   5.086
   21    HB3  GLU   4           HB3      GLU   4   7.619  -6.643   3.674
   22    HG2  GLU   4           HG2      GLU   4   6.880  -4.157   2.658
   23    HG3  GLU   4           HG3      GLU   4   8.014  -3.809   3.962
   24    H    VAL   5           H        VAL   5   5.045  -3.608   3.082
   25    HA   VAL   5           HA       VAL   5   3.680  -2.810   5.568
   26    HB   VAL   5           HB       VAL   5   5.822  -1.683   5.531
   27   HG11  VAL   5          HG11      VAL   5   6.082  -1.869   3.025
   28   HG12  VAL   5          HG12      VAL   5   5.058  -0.438   2.901
   29   HG13  VAL   5          HG13      VAL   5   6.606  -0.346   3.742
   30   HG21  VAL   5          HG21      VAL   5   3.424  -0.471   5.885
   31   HG22  VAL   5          HG22      VAL   5   4.981   0.296   6.197
   32   HG23  VAL   5          HG23      VAL   5   4.151   0.575   4.666
   33    H    SER   6           H        SER   6   1.666  -2.119   5.282
   34    HA   SER   6           HA       SER   6   0.808  -1.426   2.554
   35    HB2  SER   6           HB2      SER   6  -0.375  -3.352   3.403
   36    HB3  SER   6           HB3      SER   6  -0.765  -2.508   4.902
   37    HG   SER   6           HG       SER   6  -1.659  -1.779   2.306
   38    H    CYS   7           H        CYS   7  -0.997   0.171   2.430
   39    HA   CYS   7           HA       CYS   7  -0.600   2.310   4.418
   40    HB2  CYS   7           HB2      CYS   7  -1.154   2.483   1.453
   41    HB3  CYS   7           HB3      CYS   7  -1.254   3.865   2.539
   42    HA   PRO   8           HA       PRO   8  -5.040   0.965   4.635
   43    HB2  PRO   8           HB2      PRO   8  -5.150   0.964   7.347
   44    HB3  PRO   8           HB3      PRO   8  -4.608  -0.431   6.407
   45    HG2  PRO   8           HG2      PRO   8  -2.982   1.648   7.819
   46    HG3  PRO   8           HG3      PRO   8  -2.747  -0.109   7.763
   47    HD2  PRO   8           HD2      PRO   8  -1.317   1.603   6.227
   48    HD3  PRO   8           HD3      PRO   8  -1.745  -0.034   5.689
   49    H    ASP   9           H        ASP   9  -3.214   3.443   6.363
   50    HA   ASP   9           HA       ASP   9  -5.258   5.022   7.338
   51    HB2  ASP   9           HB2      ASP   9  -2.505   5.672   6.326
   52    HB3  ASP   9           HB3      ASP   9  -3.585   6.954   6.867
   53    H    GLY  10           H        GLY  10  -4.114   4.672   4.056
   54    HA2  GLY  10           HA2      GLY  10  -5.696   5.113   2.266
   55    HA3  GLY  10           HA3      GLY  10  -6.272   6.490   3.193
   56    H    TYR  11           H        TYR  11  -2.919   5.566   2.554
   57    HA   TYR  11           HA       TYR  11  -2.543   8.181   1.266
   58    HB2  TYR  11           HB2      TYR  11  -0.770   6.413   2.898
   59    HB3  TYR  11           HB3      TYR  11  -0.035   7.487   1.712
   60    HD1  TYR  11           HD1      TYR  11   0.926   9.279   2.806
   61    HD2  TYR  11           HD2      TYR  11  -2.902   7.920   4.072
   62    HE1  TYR  11           HE1      TYR  11   0.803  11.139   4.410
   63    HE2  TYR  11           HE2      TYR  11  -3.036   9.778   5.679
   64    HH   TYR  11           HH       TYR  11  -1.489  11.277   6.892
   65    H    THR  12           H        THR  12  -1.356   8.357  -0.656
   66    HA   THR  12           HA       THR  12  -1.534   6.005  -2.360
   67    HB   THR  12           HB       THR  12  -2.382   8.220  -3.144
   68    HG1  THR  12           HG1      THR  12  -1.466   7.968  -5.226
   69   HG21  THR  12          HG21      THR  12  -0.988  10.021  -3.604
   70   HG22  THR  12          HG22      THR  12  -0.330   9.413  -2.084
   71   HG23  THR  12          HG23      THR  12   0.467   9.023  -3.609
   72    H    CYS  13           H        CYS  13   0.313   5.874  -4.068
   73    HA   CYS  13           HA       CYS  13   2.733   5.352  -2.596
   74    HB2  CYS  13           HB2      CYS  13   2.124   5.038  -5.543
   75    HB3  CYS  13           HB3      CYS  13   3.559   4.427  -4.726
   76    H    CYS  14           H        CYS  14   4.555   6.526  -2.553
   77    HA   CYS  14           HA       CYS  14   5.003   8.607  -4.544
   78    HB2  CYS  14           HB2      CYS  14   4.286   9.102  -1.724
   79    HB3  CYS  14           HB3      CYS  14   5.680  10.003  -2.311
   80    H    ARG  15           H        ARG  15   7.133   9.003  -4.938
   81    HA   ARG  15           HA       ARG  15   9.034   7.228  -3.618
   82    HB2  ARG  15           HB2      ARG  15   8.751   7.635  -6.200
   83    HB3  ARG  15           HB3      ARG  15   9.765   9.037  -5.886
   84    HG2  ARG  15           HG2      ARG  15  11.413   7.457  -4.816
   85    HG3  ARG  15           HG3      ARG  15  10.439   6.140  -5.473
   86    HD2  ARG  15           HD2      ARG  15  11.337   8.330  -7.287
   87    HD3  ARG  15           HD3      ARG  15  12.496   7.093  -6.799
   88    HE   ARG  15           HE       ARG  15  10.149   5.842  -7.694
   89   HH11  ARG  15          HH11      ARG  15  12.822   7.708  -8.917
   90   HH12  ARG  15          HH12      ARG  15  12.765   6.997 -10.495
   91   HH21  ARG  15          HH21      ARG  15  10.064   4.898  -9.769
   92   HH22  ARG  15          HH22      ARG  15  11.196   5.399 -10.979
   93    H    LEU  16           H        LEU  16  10.916   7.925  -2.614
   94    HA   LEU  16           HA       LEU  16  10.783  10.627  -1.542
   95    HB2  LEU  16           HB2      LEU  16  12.153   8.101  -0.801
   96    HB3  LEU  16           HB3      LEU  16  12.912   9.614  -0.309
   97    HG   LEU  16           HG       LEU  16  10.910  10.227   0.940
   98   HD11  LEU  16          HD11      LEU  16   9.038   8.757   1.177
   99   HD12  LEU  16          HD12      LEU  16   9.307   9.036  -0.544
  100   HD13  LEU  16          HD13      LEU  16   9.822   7.519   0.195
  101   HD21  LEU  16          HD21      LEU  16  12.742   8.811   1.936
  102   HD22  LEU  16          HD22      LEU  16  11.177   8.714   2.744
  103   HD23  LEU  16          HD23      LEU  16  11.697   7.415   1.670
  104    H    GLN  17           H        GLN  17  12.657  12.012  -1.473
  105    HA   GLN  17           HA       GLN  17  13.826  12.501  -3.924
  106    HB2  GLN  17           HB2      GLN  17  15.551  13.812  -2.566
  107    HB3  GLN  17           HB3      GLN  17  13.863  14.261  -2.367
  108    HG2  GLN  17           HG2      GLN  17  14.880  12.239  -0.486
  109    HG3  GLN  17           HG3      GLN  17  15.564  13.857  -0.329
  110   HE21  GLN  17          HE21      GLN  17  14.437  13.555   1.800
  111   HE22  GLN  17          HE22      GLN  17  12.796  14.085   1.900
  112    H    SER  18           H        SER  18  14.967  10.470  -1.296
  113    HA   SER  18           HA       SER  18  17.574  10.034  -2.327
  114    HB2  SER  18           HB2      SER  18  16.654   9.598   0.062
  115    HB3  SER  18           HB3      SER  18  16.131   8.046  -0.592
  116    HG   SER  18           HG       SER  18  18.251   7.544  -1.052
  117    H    GLY  19           H        GLY  19  14.479   8.422  -2.763
  118    HA2  GLY  19           HA2      GLY  19  14.125   7.379  -4.959
  119    HA3  GLY  19           HA3      GLY  19  15.753   6.731  -4.825
  120    H    ALA  20           H        ALA  20  13.365   6.817  -2.239
  121    HA   ALA  20           HA       ALA  20  13.342   3.870  -2.281
  122    HB1  ALA  20           HB1      ALA  20  13.912   3.922  -0.139
  123    HB2  ALA  20           HB2      ALA  20  13.960   5.684  -0.191
  124    HB3  ALA  20           HB3      ALA  20  12.463   4.854   0.235
  125    H    TRP  21           H        TRP  21  11.329   2.954  -1.173
  126    HA   TRP  21           HA       TRP  21   9.013   4.159  -2.461
  127    HB2  TRP  21           HB2      TRP  21   9.497   1.477  -1.168
  128    HB3  TRP  21           HB3      TRP  21   7.898   1.996  -1.693
  129    HD1  TRP  21           HD1      TRP  21  10.865   0.210  -2.921
  130    HE1  TRP  21           HE1      TRP  21  10.768  -0.079  -5.477
  131    HE3  TRP  21           HE3      TRP  21   7.092   3.497  -3.967
  132    HZ2  TRP  21           HZ2      TRP  21   9.288   0.950  -7.649
  133    HZ3  TRP  21           HZ3      TRP  21   6.396   3.787  -6.309
  134    HH2  TRP  21           HH2      TRP  21   7.473   2.539  -8.110
  135    H    GLY  22           H        GLY  22   7.168   4.835  -1.406
  136    HA2  GLY  22           HA2      GLY  22   6.776   4.495   1.404
  137    HA3  GLY  22           HA3      GLY  22   7.379   6.103   1.029
  138    H    CYS  23           H        CYS  23   5.136   6.365   2.161
  139    HA   CYS  23           HA       CYS  23   3.096   6.550   0.042
  140    HB2  CYS  23           HB2      CYS  23   2.962   5.357   2.661
  141    HB3  CYS  23           HB3      CYS  23   1.807   6.681   2.545
  142    H    CYS  24           H        CYS  24   1.921   8.437  -0.133
  143    HA   CYS  24           HA       CYS  24   2.634  10.638   1.677
  144    HB2  CYS  24           HB2      CYS  24   2.993  12.158  -0.134
  145    HB3  CYS  24           HB3      CYS  24   3.978  10.734  -0.451
  Start of MODEL    6
    1    H1   CYS   1           H        CYS   1   4.667   2.326  -0.873
    2    HA   CYS   1           HA       CYS   1   2.612   0.356  -1.205
    3    HB2  CYS   1           HB2      CYS   1   4.442   1.788  -3.128
    4    HB3  CYS   1           HB3      CYS   1   3.300   0.557  -3.659
    5    H    ASP   2           H        ASP   2   4.456  -0.854   0.333
    6    HA   ASP   2           HA       ASP   2   5.903  -2.660  -1.489
    7    HB2  ASP   2           HB2      ASP   2   7.119  -1.277   0.366
    8    HB3  ASP   2           HB3      ASP   2   6.466  -2.499   1.453
    9    H    MET   3           H        MET   3   6.008  -4.935  -0.847
   10    HA   MET   3           HA       MET   3   3.480  -6.039  -0.411
   11    HB2  MET   3           HB2      MET   3   5.385  -7.190  -1.529
   12    HB3  MET   3           HB3      MET   3   6.148  -7.385   0.044
   13    HG2  MET   3           HG2      MET   3   4.400  -8.818   0.797
   14    HG3  MET   3           HG3      MET   3   3.435  -8.482  -0.638
   15    HE1  MET   3           HE1      MET   3   3.203 -10.763  -2.141
   16    HE2  MET   3           HE2      MET   3   4.141 -12.101  -1.478
   17    HE3  MET   3           HE3      MET   3   3.194 -11.071  -0.404
   18    H    GLU   4           H        GLU   4   6.283  -6.082   1.802
   19    HA   GLU   4           HA       GLU   4   4.884  -7.116   4.004
   20    HB2  GLU   4           HB2      GLU   4   7.470  -6.739   3.531
   21    HB3  GLU   4           HB3      GLU   4   7.181  -5.269   4.450
   22    HG2  GLU   4           HG2      GLU   4   7.836  -6.724   6.094
   23    HG3  GLU   4           HG3      GLU   4   6.081  -6.871   6.170
   24    H    VAL   5           H        VAL   5   5.919  -3.756   3.394
   25    HA   VAL   5           HA       VAL   5   3.794  -2.865   5.231
   26    HB   VAL   5           HB       VAL   5   6.273  -1.347   4.409
   27   HG11  VAL   5          HG11      VAL   5   5.471  -0.118   6.622
   28   HG12  VAL   5          HG12      VAL   5   4.867   0.334   5.027
   29   HG13  VAL   5          HG13      VAL   5   3.901  -0.707   6.073
   30   HG21  VAL   5          HG21      VAL   5   6.526  -1.808   7.076
   31   HG22  VAL   5          HG22      VAL   5   5.778  -3.310   6.534
   32   HG23  VAL   5          HG23      VAL   5   7.296  -2.772   5.815
   33    H    SER   6           H        SER   6   2.130  -1.799   4.394
   34    HA   SER   6           HA       SER   6   2.484  -0.412   1.823
   35    HB2  SER   6           HB2      SER   6   1.262  -2.665   1.675
   36    HB3  SER   6           HB3      SER   6  -0.055  -1.873   2.541
   37    HG   SER   6           HG       SER   6   1.014  -1.218   0.003
   38    H    CYS   7           H        CYS   7   0.074   0.733   1.497
   39    HA   CYS   7           HA       CYS   7  -0.227   2.400   3.909
   40    HB2  CYS   7           HB2      CYS   7  -0.105   3.066   1.010
   41    HB3  CYS   7           HB3      CYS   7  -1.190   4.022   2.015
   42    HA   PRO   8           HA       PRO   8  -4.268   0.231   3.178
   43    HB2  PRO   8           HB2      PRO   8  -4.670  -0.395   5.789
   44    HB3  PRO   8           HB3      PRO   8  -3.740  -1.418   4.688
   45    HG2  PRO   8           HG2      PRO   8  -2.766   0.562   6.710
   46    HG3  PRO   8           HG3      PRO   8  -2.151  -1.061   6.348
   47    HD2  PRO   8           HD2      PRO   8  -0.967   1.187   5.412
   48    HD3  PRO   8           HD3      PRO   8  -0.969  -0.339   4.506
   49    H    ASP   9           H        ASP   9  -3.219   2.564   5.610
   50    HA   ASP   9           HA       ASP   9  -5.647   3.471   6.557
   51    HB2  ASP   9           HB2      ASP   9  -3.319   5.292   5.943
   52    HB3  ASP   9           HB3      ASP   9  -4.528   5.476   7.211
   53    H    GLY  10           H        GLY  10  -4.117   4.076   3.476
   54    HA2  GLY  10           HA2      GLY  10  -5.563   4.591   1.592
   55    HA3  GLY  10           HA3      GLY  10  -6.515   5.599   2.673
   56    H    TYR  11           H        TYR  11  -2.993   5.483   2.365
   57    HA   TYR  11           HA       TYR  11  -2.981   8.361   1.927
   58    HB2  TYR  11           HB2      TYR  11  -0.974   6.333   2.788
   59    HB3  TYR  11           HB3      TYR  11  -0.381   7.795   2.006
   60    HD1  TYR  11           HD1      TYR  11   0.363   9.384   3.490
   61    HD2  TYR  11           HD2      TYR  11  -2.992   7.003   4.571
   62    HE1  TYR  11           HE1      TYR  11   0.198  10.597   5.624
   63    HE2  TYR  11           HE2      TYR  11  -3.168   8.209   6.707
   64    HH   TYR  11           HH       TYR  11  -1.798  11.074   7.319
   65    H    THR  12           H        THR  12  -1.294   9.199   0.348
   66    HA   THR  12           HA       THR  12  -1.794   7.939  -2.227
   67    HB   THR  12           HB       THR  12  -0.231  10.478  -1.878
   68    HG1  THR  12           HG1      THR  12  -1.968  11.525  -1.259
   69   HG21  THR  12          HG21      THR  12  -2.024   9.316  -3.999
   70   HG22  THR  12          HG22      THR  12  -1.524  11.007  -4.002
   71   HG23  THR  12          HG23      THR  12  -0.314   9.730  -4.120
   72    H    CYS  13           H        CYS  13  -0.274   7.035  -3.523
   73    HA   CYS  13           HA       CYS  13   2.237   6.306  -2.311
   74    HB2  CYS  13           HB2      CYS  13   0.670   4.907  -3.894
   75    HB3  CYS  13           HB3      CYS  13   1.575   5.714  -5.171
   76    H    CYS  14           H        CYS  14   4.107   7.332  -2.537
   77    HA   CYS  14           HA       CYS  14   4.544   9.006  -4.909
   78    HB2  CYS  14           HB2      CYS  14   5.326   9.879  -2.126
   79    HB3  CYS  14           HB3      CYS  14   5.406  10.823  -3.610
   80    H    ARG  15           H        ARG  15   6.767   9.375  -5.432
   81    HA   ARG  15           HA       ARG  15   8.525   7.263  -4.382
   82    HB2  ARG  15           HB2      ARG  15   7.875   7.448  -6.892
   83    HB3  ARG  15           HB3      ARG  15   9.030   8.773  -6.927
   84    HG2  ARG  15           HG2      ARG  15  10.803   7.293  -6.210
   85    HG3  ARG  15           HG3      ARG  15   9.657   5.959  -6.062
   86    HD2  ARG  15           HD2      ARG  15  10.822   5.711  -8.136
   87    HD3  ARG  15           HD3      ARG  15   9.166   6.200  -8.492
   88    HE   ARG  15           HE       ARG  15  10.001   8.078  -9.474
   89   HH11  ARG  15          HH11      ARG  15  12.397   6.817  -7.287
   90   HH12  ARG  15          HH12      ARG  15  13.607   7.972  -7.739
   91   HH21  ARG  15          HH21      ARG  15  11.584   9.604 -10.078
   92   HH22  ARG  15          HH22      ARG  15  13.143   9.558  -9.327
   93    H    LEU  16           H        LEU  16  10.455   7.746  -3.482
   94    HA   LEU  16           HA       LEU  16  11.012  10.565  -2.981
   95    HB2  LEU  16           HB2      LEU  16  12.568   8.275  -1.842
   96    HB3  LEU  16           HB3      LEU  16  12.315   9.885  -1.172
   97    HG   LEU  16           HG       LEU  16  10.322   7.624  -1.276
   98   HD11  LEU  16          HD11      LEU  16  11.359   7.088   0.628
   99   HD12  LEU  16          HD12      LEU  16  12.201   8.635   0.715
  100   HD13  LEU  16          HD13      LEU  16  10.545   8.497   1.307
  101   HD21  LEU  16          HD21      LEU  16   8.857   9.341  -1.486
  102   HD22  LEU  16          HD22      LEU  16   9.125   9.457   0.254
  103   HD23  LEU  16          HD23      LEU  16   9.988  10.533  -0.845
  104    H    GLN  17           H        GLN  17  12.669  11.655  -3.847
  105    HA   GLN  17           HA       GLN  17  14.028  10.780  -6.094
  106    HB2  GLN  17           HB2      GLN  17  15.464  12.725  -5.824
  107    HB3  GLN  17           HB3      GLN  17  13.797  13.147  -5.455
  108    HG2  GLN  17           HG2      GLN  17  14.340  12.875  -3.038
  109    HG3  GLN  17           HG3      GLN  17  16.029  12.666  -3.499
  110   HE21  GLN  17          HE21      GLN  17  13.419  14.885  -3.110
  111   HE22  GLN  17          HE22      GLN  17  14.325  16.331  -3.380
  112    H    SER  18           H        SER  18  14.958  10.594  -2.705
  113    HA   SER  18           HA       SER  18  17.626   9.925  -2.919
  114    HB2  SER  18           HB2      SER  18  17.478   9.053  -0.730
  115    HB3  SER  18           HB3      SER  18  16.203  10.270  -0.805
  116    HG   SER  18           HG       SER  18  15.894   7.819  -0.088
  117    H    GLY  19           H        GLY  19  14.789   7.907  -3.419
  118    HA2  GLY  19           HA2      GLY  19  15.079   6.137  -5.120
  119    HA3  GLY  19           HA3      GLY  19  16.592   5.744  -4.317
  120    H    ALA  20           H        ALA  20  13.423   6.443  -2.889
  121    HA   ALA  20           HA       ALA  20  13.190   3.646  -2.060
  122    HB1  ALA  20           HB1      ALA  20  12.506   5.523   0.079
  123    HB2  ALA  20           HB2      ALA  20  13.392   3.999   0.143
  124    HB3  ALA  20           HB3      ALA  20  14.222   5.483  -0.328
  125    H    TRP  21           H        TRP  21  11.011   3.463  -0.726
  126    HA   TRP  21           HA       TRP  21   8.967   4.828  -2.344
  127    HB2  TRP  21           HB2      TRP  21   7.498   2.914  -1.765
  128    HB3  TRP  21           HB3      TRP  21   8.948   2.418  -2.634
  129    HD1  TRP  21           HD1      TRP  21  10.567   0.751  -1.438
  130    HE1  TRP  21           HE1      TRP  21  10.483  -0.522   0.797
  131    HE3  TRP  21           HE3      TRP  21   6.639   3.193   0.740
  132    HZ2  TRP  21           HZ2      TRP  21   8.953  -0.496   3.169
  133    HZ3  TRP  21           HZ3      TRP  21   5.927   2.508   2.993
  134    HH2  TRP  21           HH2      TRP  21   7.061   0.701   4.181
  135    H    GLY  22           H        GLY  22   7.209   5.803  -1.376
  136    HA2  GLY  22           HA2      GLY  22   6.856   5.663   1.498
  137    HA3  GLY  22           HA3      GLY  22   7.431   7.215   0.905
  138    H    CYS  23           H        CYS  23   5.229   7.577   2.116
  139    HA   CYS  23           HA       CYS  23   3.138   7.633   0.043
  140    HB2  CYS  23           HB2      CYS  23   3.047   6.535   2.742
  141    HB3  CYS  23           HB3      CYS  23   1.782   7.727   2.463
  142    H    CYS  24           H        CYS  24   1.467   9.342   0.475
  143    HA   CYS  24           HA       CYS  24   2.643  11.695   1.795
  144    HB2  CYS  24           HB2      CYS  24   1.214  11.682  -0.873
  145    HB3  CYS  24           HB3      CYS  24   1.808  13.111  -0.033
  Start of MODEL    7
    1    H1   CYS   1           H        CYS   1   0.220  -2.416  -0.702
    2    HA   CYS   1           HA       CYS   1   0.531  -1.530  -3.455
    3    HB2  CYS   1           HB2      CYS   1  -0.157   0.095  -1.742
    4    HB3  CYS   1           HB3      CYS   1   1.338  -0.199  -0.860
    5    H    ASP   2           H        ASP   2   2.616  -2.236  -0.660
    6    HA   ASP   2           HA       ASP   2   4.892  -2.472  -2.512
    7    HB2  ASP   2           HB2      ASP   2   4.603  -1.283   0.111
    8    HB3  ASP   2           HB3      ASP   2   5.873  -2.504   0.113
    9    H    MET   3           H        MET   3   6.643  -3.998  -1.292
   10    HA   MET   3           HA       MET   3   5.571  -6.615  -1.527
   11    HB2  MET   3           HB2      MET   3   7.857  -7.327  -0.758
   12    HB3  MET   3           HB3      MET   3   7.845  -6.273  -2.166
   13    HG2  MET   3           HG2      MET   3   8.013  -4.623   0.120
   14    HG3  MET   3           HG3      MET   3   9.181  -5.928   0.318
   15    HE1  MET   3           HE1      MET   3  11.908  -5.365  -1.964
   16    HE2  MET   3           HE2      MET   3  11.771  -4.689  -0.341
   17    HE3  MET   3           HE3      MET   3  11.099  -6.282  -0.693
   18    H    GLU   4           H        GLU   4   6.391  -4.551   1.198
   19    HA   GLU   4           HA       GLU   4   4.888  -6.319   2.955
   20    HB2  GLU   4           HB2      GLU   4   6.738  -6.130   4.693
   21    HB3  GLU   4           HB3      GLU   4   7.029  -7.228   3.351
   22    HG2  GLU   4           HG2      GLU   4   8.543  -5.753   2.330
   23    HG3  GLU   4           HG3      GLU   4   8.035  -4.403   3.344
   24    H    VAL   5           H        VAL   5   4.321  -3.748   1.883
   25    HA   VAL   5           HA       VAL   5   3.919  -2.302   4.375
   26    HB   VAL   5           HB       VAL   5   5.252  -0.997   1.998
   27   HG11  VAL   5          HG11      VAL   5   3.921   0.074   4.425
   28   HG12  VAL   5          HG12      VAL   5   5.398   0.868   3.880
   29   HG13  VAL   5          HG13      VAL   5   4.014   0.741   2.795
   30   HG21  VAL   5          HG21      VAL   5   6.861  -2.282   3.213
   31   HG22  VAL   5          HG22      VAL   5   7.093  -0.586   3.640
   32   HG23  VAL   5          HG23      VAL   5   6.263  -1.671   4.756
   33    H    SER   6           H        SER   6   1.984  -1.316   4.442
   34    HA   SER   6           HA       SER   6   0.534  -0.922   1.912
   35    HB2  SER   6           HB2      SER   6  -0.940  -1.766   4.382
   36    HB3  SER   6           HB3      SER   6  -1.392  -1.966   2.689
   37    HG   SER   6           HG       SER   6  -0.709  -3.937   3.142
   38    H    CYS   7           H        CYS   7  -1.420   0.517   2.231
   39    HA   CYS   7           HA       CYS   7  -0.822   2.616   4.212
   40    HB2  CYS   7           HB2      CYS   7  -1.725   2.923   1.344
   41    HB3  CYS   7           HB3      CYS   7  -1.727   4.239   2.513
   42    HA   PRO   8           HA       PRO   8  -5.151   1.055   4.833
   43    HB2  PRO   8           HB2      PRO   8  -4.960   0.909   7.537
   44    HB3  PRO   8           HB3      PRO   8  -4.469  -0.409   6.467
   45    HG2  PRO   8           HG2      PRO   8  -2.783   1.669   7.809
   46    HG3  PRO   8           HG3      PRO   8  -2.483  -0.069   7.629
   47    HD2  PRO   8           HD2      PRO   8  -1.304   1.784   6.045
   48    HD3  PRO   8           HD3      PRO   8  -1.721   0.158   5.465
   49    H    ASP   9           H        ASP   9  -3.248   3.524   6.490
   50    HA   ASP   9           HA       ASP   9  -5.238   4.952   7.766
   51    HB2  ASP   9           HB2      ASP   9  -3.710   6.980   7.262
   52    HB3  ASP   9           HB3      ASP   9  -3.055   5.656   8.221
   53    H    GLY  10           H        GLY  10  -4.440   4.828   4.368
   54    HA2  GLY  10           HA2      GLY  10  -6.187   5.293   2.761
   55    HA3  GLY  10           HA3      GLY  10  -6.771   6.554   3.837
   56    H    TYR  11           H        TYR  11  -3.424   5.961   2.880
   57    HA   TYR  11           HA       TYR  11  -3.409   8.628   1.632
   58    HB2  TYR  11           HB2      TYR  11  -1.363   7.132   3.229
   59    HB3  TYR  11           HB3      TYR  11  -0.838   8.337   2.059
   60    HD1  TYR  11           HD1      TYR  11  -1.199   7.968   5.370
   61    HD2  TYR  11           HD2      TYR  11  -2.654  10.513   2.287
   62    HE1  TYR  11           HE1      TYR  11  -1.595   9.740   7.029
   63    HE2  TYR  11           HE2      TYR  11  -3.053  12.293   3.936
   64    HH   TYR  11           HH       TYR  11  -3.164  12.774   6.135
   65    H    THR  12           H        THR  12  -1.563   8.841  -0.022
   66    HA   THR  12           HA       THR  12  -1.864   6.638  -1.922
   67    HB   THR  12           HB       THR  12  -2.428   8.805  -2.817
   68    HG1  THR  12           HG1      THR  12  -0.810   8.875  -4.533
   69   HG21  THR  12          HG21      THR  12   0.337   9.622  -1.923
   70   HG22  THR  12          HG22      THR  12  -0.674  10.576  -3.008
   71   HG23  THR  12          HG23      THR  12  -1.204  10.266  -1.355
   72    H    CYS  13           H        CYS  13  -0.083   5.738  -3.032
   73    HA   CYS  13           HA       CYS  13   2.287   5.510  -1.401
   74    HB2  CYS  13           HB2      CYS  13   1.506   4.224  -4.025
   75    HB3  CYS  13           HB3      CYS  13   2.992   3.862  -3.153
   76    H    CYS  14           H        CYS  14   4.080   6.663  -1.621
   77    HA   CYS  14           HA       CYS  14   4.582   8.006  -4.196
   78    HB2  CYS  14           HB2      CYS  14   5.330   9.069  -1.466
   79    HB3  CYS  14           HB3      CYS  14   5.511   9.896  -3.010
   80    H    ARG  15           H        ARG  15   6.971   8.730  -4.321
   81    HA   ARG  15           HA       ARG  15   8.674   6.545  -3.315
   82    HB2  ARG  15           HB2      ARG  15   9.961   6.678  -5.390
   83    HB3  ARG  15           HB3      ARG  15   8.272   6.316  -5.722
   84    HG2  ARG  15           HG2      ARG  15   8.062   8.887  -6.045
   85    HG3  ARG  15           HG3      ARG  15   9.813   8.813  -6.253
   86    HD2  ARG  15           HD2      ARG  15   7.870   7.107  -7.799
   87    HD3  ARG  15           HD3      ARG  15   8.474   8.661  -8.372
   88    HE   ARG  15           HE       ARG  15  10.735   7.280  -7.817
   89   HH11  ARG  15          HH11      ARG  15   7.905   6.587  -9.724
   90   HH12  ARG  15          HH12      ARG  15   8.752   5.582 -10.852
   91   HH21  ARG  15          HH21      ARG  15  11.861   5.959  -9.297
   92   HH22  ARG  15          HH22      ARG  15  11.002   5.224 -10.608
   93    H    LEU  16           H        LEU  16  10.508   7.107  -2.299
   94    HA   LEU  16           HA       LEU  16  11.048   9.955  -1.963
   95    HB2  LEU  16           HB2      LEU  16  11.740   7.476  -0.466
   96    HB3  LEU  16           HB3      LEU  16  12.781   8.887  -0.290
   97    HG   LEU  16           HG       LEU  16  11.133   8.719   1.516
   98   HD11  LEU  16          HD11      LEU  16  11.976  10.923   0.526
   99   HD12  LEU  16          HD12      LEU  16  10.375  11.058  -0.202
  100   HD13  LEU  16          HD13      LEU  16  10.543  10.977   1.552
  101   HD21  LEU  16          HD21      LEU  16   9.341   7.602   0.324
  102   HD22  LEU  16          HD22      LEU  16   8.755   9.110   1.026
  103   HD23  LEU  16          HD23      LEU  16   9.107   9.019  -0.700
  104    H    GLN  17           H        GLN  17  12.936  10.946  -2.533
  105    HA   GLN  17           HA       GLN  17  14.373   9.995  -4.721
  106    HB2  GLN  17           HB2      GLN  17  14.302  12.352  -4.230
  107    HB3  GLN  17           HB3      GLN  17  15.096  12.101  -2.682
  108    HG2  GLN  17           HG2      GLN  17  17.141  11.465  -3.779
  109    HG3  GLN  17           HG3      GLN  17  16.359  11.550  -5.356
  110   HE21  GLN  17          HE21      GLN  17  18.455  13.101  -3.485
  111   HE22  GLN  17          HE22      GLN  17  18.181  14.736  -3.973
  112    H    SER  18           H        SER  18  15.030   9.746  -1.276
  113    HA   SER  18           HA       SER  18  17.669   8.911  -1.315
  114    HB2  SER  18           HB2      SER  18  16.464   9.408   0.760
  115    HB3  SER  18           HB3      SER  18  15.456   7.979   0.531
  116    HG   SER  18           HG       SER  18  18.201   8.134   1.156
  117    H    GLY  19           H        GLY  19  14.733   7.086  -1.961
  118    HA2  GLY  19           HA2      GLY  19  15.016   5.272  -3.624
  119    HA3  GLY  19           HA3      GLY  19  16.430   4.782  -2.702
  120    H    ALA  20           H        ALA  20  13.314   5.792  -1.389
  121    HA   ALA  20           HA       ALA  20  12.828   3.021  -0.527
  122    HB1  ALA  20           HB1      ALA  20  12.054   3.893   1.664
  123    HB2  ALA  20           HB2      ALA  20  13.776   4.142   1.376
  124    HB3  ALA  20           HB3      ALA  20  12.650   5.487   1.199
  125    H    TRP  21           H        TRP  21  10.543   2.749   0.304
  126    HA   TRP  21           HA       TRP  21   8.724   4.243  -1.458
  127    HB2  TRP  21           HB2      TRP  21   8.238   1.564  -0.145
  128    HB3  TRP  21           HB3      TRP  21   7.256   2.329  -1.390
  129    HD1  TRP  21           HD1      TRP  21   9.669  -0.320  -1.088
  130    HE1  TRP  21           HE1      TRP  21  10.844  -0.817  -3.323
  131    HE3  TRP  21           HE3      TRP  21   8.383   3.918  -3.641
  132    HZ2  TRP  21           HZ2      TRP  21  11.181   0.423  -5.836
  133    HZ3  TRP  21           HZ3      TRP  21   9.173   4.186  -5.955
  134    HH2  TRP  21           HH2      TRP  21  10.543   2.474  -7.029
  135    H    GLY  22           H        GLY  22   7.661   5.817  -0.450
  136    HA2  GLY  22           HA2      GLY  22   6.857   5.381   2.358
  137    HA3  GLY  22           HA3      GLY  22   7.171   6.957   1.648
  138    H    CYS  23           H        CYS  23   4.994   7.284   2.711
  139    HA   CYS  23           HA       CYS  23   2.937   6.916   0.668
  140    HB2  CYS  23           HB2      CYS  23   2.877   5.148   2.619
  141    HB3  CYS  23           HB3      CYS  23   2.152   6.475   3.521
  142    H    CYS  24           H        CYS  24   2.013   8.801   0.246
  143    HA   CYS  24           HA       CYS  24   2.308  10.990   2.159
  144    HB2  CYS  24           HB2      CYS  24   1.236  11.137  -0.662
  145    HB3  CYS  24           HB3      CYS  24   1.815  12.467   0.336
  Start of MODEL    8
    1    H1   CYS   1           H        CYS   1   4.145   1.715  -0.877
    2    HA   CYS   1           HA       CYS   1   2.203  -0.270  -1.628
    3    HB2  CYS   1           HB2      CYS   1   4.136   1.475  -3.122
    4    HB3  CYS   1           HB3      CYS   1   3.326   0.146  -3.944
    5    H    ASP   2           H        ASP   2   3.989  -1.457   0.070
    6    HA   ASP   2           HA       ASP   2   5.088  -3.524  -1.644
    7    HB2  ASP   2           HB2      ASP   2   6.813  -1.963   0.289
    8    HB3  ASP   2           HB3      ASP   2   7.294  -3.476  -0.474
    9    H    MET   3           H        MET   3   6.155  -5.270  -0.140
   10    HA   MET   3           HA       MET   3   4.112  -6.162   1.616
   11    HB2  MET   3           HB2      MET   3   6.829  -7.157   0.852
   12    HB3  MET   3           HB3      MET   3   6.003  -7.879   2.226
   13    HG2  MET   3           HG2      MET   3   4.021  -8.053   0.497
   14    HG3  MET   3           HG3      MET   3   5.345  -7.995  -0.664
   15    HE1  MET   3           HE1      MET   3   4.652  -9.885  -1.633
   16    HE2  MET   3           HE2      MET   3   6.010 -10.995  -1.442
   17    HE3  MET   3           HE3      MET   3   4.392 -11.485  -0.938
   18    H    GLU   4           H        GLU   4   7.317  -4.757   2.123
   19    HA   GLU   4           HA       GLU   4   7.393  -5.083   4.923
   20    HB2  GLU   4           HB2      GLU   4   8.817  -3.278   2.995
   21    HB3  GLU   4           HB3      GLU   4   9.030  -3.070   4.727
   22    HG2  GLU   4           HG2      GLU   4   9.536  -5.645   3.259
   23    HG3  GLU   4           HG3      GLU   4  10.778  -4.452   3.636
   24    H    VAL   5           H        VAL   5   6.468  -2.294   2.916
   25    HA   VAL   5           HA       VAL   5   4.929  -1.273   5.211
   26    HB   VAL   5           HB       VAL   5   6.923   0.110   4.949
   27   HG11  VAL   5          HG11      VAL   5   7.543   1.192   2.976
   28   HG12  VAL   5          HG12      VAL   5   7.080  -0.423   2.441
   29   HG13  VAL   5          HG13      VAL   5   5.968   0.930   2.227
   30   HG21  VAL   5          HG21      VAL   5   5.808   2.296   4.659
   31   HG22  VAL   5          HG22      VAL   5   4.386   1.461   4.032
   32   HG23  VAL   5          HG23      VAL   5   4.899   1.200   5.700
   33    H    SER   6           H        SER   6   2.899  -0.567   4.788
   34    HA   SER   6           HA       SER   6   2.058  -0.338   1.984
   35    HB2  SER   6           HB2      SER   6   1.505  -2.607   3.189
   36    HB3  SER   6           HB3      SER   6   0.230  -1.661   3.957
   37    HG   SER   6           HG       SER   6  -0.102  -2.805   1.776
   38    H    CYS   7           H        CYS   7  -0.266   0.565   1.900
   39    HA   CYS   7           HA       CYS   7  -0.722   2.498   4.061
   40    HB2  CYS   7           HB2      CYS   7  -0.107   3.066   1.220
   41    HB3  CYS   7           HB3      CYS   7  -1.427   3.996   1.923
   42    HA   PRO   8           HA       PRO   8  -4.589   0.244   2.823
   43    HB2  PRO   8           HB2      PRO   8  -5.366  -0.297   5.367
   44    HB3  PRO   8           HB3      PRO   8  -4.273  -1.344   4.453
   45    HG2  PRO   8           HG2      PRO   8  -3.629   0.721   6.523
   46    HG3  PRO   8           HG3      PRO   8  -2.951  -0.905   6.315
   47    HD2  PRO   8           HD2      PRO   8  -1.664   1.328   5.482
   48    HD3  PRO   8           HD3      PRO   8  -1.517  -0.229   4.642
   49    H    ASP   9           H        ASP   9  -3.930   2.681   5.288
   50    HA   ASP   9           HA       ASP   9  -6.479   3.582   5.842
   51    HB2  ASP   9           HB2      ASP   9  -3.940   5.206   5.573
   52    HB3  ASP   9           HB3      ASP   9  -5.421   5.778   6.335
   53    H    GLY  10           H        GLY  10  -4.533   4.094   2.988
   54    HA2  GLY  10           HA2      GLY  10  -5.702   4.511   0.898
   55    HA3  GLY  10           HA3      GLY  10  -6.809   5.543   1.792
   56    H    TYR  11           H        TYR  11  -3.278   5.476   1.991
   57    HA   TYR  11           HA       TYR  11  -3.244   8.333   1.410
   58    HB2  TYR  11           HB2      TYR  11  -1.425   6.421   2.767
   59    HB3  TYR  11           HB3      TYR  11  -0.665   7.771   1.933
   60    HD1  TYR  11           HD1      TYR  11  -0.041   9.408   3.428
   61    HD2  TYR  11           HD2      TYR  11  -3.763   7.430   4.003
   62    HE1  TYR  11           HE1      TYR  11  -0.511  10.866   5.352
   63    HE2  TYR  11           HE2      TYR  11  -4.244   8.883   5.929
   64    HH   TYR  11           HH       TYR  11  -3.484  11.263   6.675
   65    H    THR  12           H        THR  12  -1.279   9.098   0.107
   66    HA   THR  12           HA       THR  12  -1.359   7.712  -2.451
   67    HB   THR  12           HB       THR  12   0.061  10.306  -1.852
   68    HG1  THR  12           HG1      THR  12  -2.649   9.890  -2.642
   69   HG21  THR  12          HG21      THR  12  -0.659  10.627  -4.329
   70   HG22  THR  12          HG22      THR  12   0.730   9.604  -3.964
   71   HG23  THR  12          HG23      THR  12  -0.833   8.872  -4.326
   72    H    CYS  13           H        CYS  13   0.356   6.765  -3.449
   73    HA   CYS  13           HA       CYS  13   2.677   6.205  -1.787
   74    HB2  CYS  13           HB2      CYS  13   1.404   4.966  -4.160
   75    HB3  CYS  13           HB3      CYS  13   3.153   4.803  -4.040
   76    H    CYS  14           H        CYS  14   4.511   7.296  -1.952
   77    HA   CYS  14           HA       CYS  14   5.120   8.651  -4.498
   78    HB2  CYS  14           HB2      CYS  14   5.946   9.636  -1.765
   79    HB3  CYS  14           HB3      CYS  14   6.084  10.488  -3.300
   80    H    ARG  15           H        ARG  15   7.604   9.368  -4.349
   81    HA   ARG  15           HA       ARG  15   9.102   6.931  -3.640
   82    HB2  ARG  15           HB2      ARG  15   9.233   8.738  -6.015
   83    HB3  ARG  15           HB3      ARG  15  10.708   7.946  -5.478
   84    HG2  ARG  15           HG2      ARG  15   9.904   6.469  -7.048
   85    HG3  ARG  15           HG3      ARG  15   9.276   5.787  -5.547
   86    HD2  ARG  15           HD2      ARG  15   7.480   5.751  -7.077
   87    HD3  ARG  15           HD3      ARG  15   7.162   7.101  -5.988
   88    HE   ARG  15           HE       ARG  15   8.570   7.999  -8.266
   89   HH11  ARG  15          HH11      ARG  15   5.426   6.892  -7.263
   90   HH12  ARG  15          HH12      ARG  15   4.579   7.782  -8.485
   91   HH21  ARG  15          HH21      ARG  15   7.467   9.176  -9.878
   92   HH22  ARG  15          HH22      ARG  15   5.741   9.080  -9.972
   93    H    LEU  16           H        LEU  16  11.110   7.138  -2.671
   94    HA   LEU  16           HA       LEU  16  11.716   9.824  -1.626
   95    HB2  LEU  16           HB2      LEU  16  12.403   7.143  -0.433
   96    HB3  LEU  16           HB3      LEU  16  12.756   8.717   0.276
   97    HG   LEU  16           HG       LEU  16   9.974   7.655  -0.207
   98   HD11  LEU  16          HD11      LEU  16   9.984   7.454   2.319
   99   HD12  LEU  16          HD12      LEU  16  10.900   6.238   1.429
  100   HD13  LEU  16          HD13      LEU  16  11.741   7.570   2.222
  101   HD21  LEU  16          HD21      LEU  16  11.000  10.023   1.357
  102   HD22  LEU  16          HD22      LEU  16  10.102  10.080  -0.160
  103   HD23  LEU  16          HD23      LEU  16   9.323   9.478   1.303
  104    H    GLN  17           H        GLN  17  13.635  10.713  -2.073
  105    HA   GLN  17           HA       GLN  17  15.333   9.722  -4.030
  106    HB2  GLN  17           HB2      GLN  17  15.131  12.108  -3.095
  107    HB3  GLN  17           HB3      GLN  17  16.272  11.587  -1.863
  108    HG2  GLN  17           HG2      GLN  17  17.559  12.638  -3.514
  109    HG3  GLN  17           HG3      GLN  17  17.803  10.908  -3.754
  110   HE21  GLN  17          HE21      GLN  17  17.859  10.379  -5.805
  111   HE22  GLN  17          HE22      GLN  17  16.930  11.093  -7.074
  112    H    SER  18           H        SER  18  15.467   9.360  -0.535
  113    HA   SER  18           HA       SER  18  18.029   8.385  -0.199
  114    HB2  SER  18           HB2      SER  18  17.329   7.564   1.879
  115    HB3  SER  18           HB3      SER  18  16.167   8.849   1.551
  116    HG   SER  18           HG       SER  18  14.936   7.146   2.119
  117    H    GLY  19           H        GLY  19  15.159   6.729  -1.380
  118    HA2  GLY  19           HA2      GLY  19  15.634   4.967  -3.058
  119    HA3  GLY  19           HA3      GLY  19  16.854   4.373  -1.941
  120    H    ALA  20           H        ALA  20  13.558   5.462  -1.235
  121    HA   ALA  20           HA       ALA  20  12.753   2.710  -0.672
  122    HB1  ALA  20           HB1      ALA  20  12.642   2.894   1.547
  123    HB2  ALA  20           HB2      ALA  20  13.644   4.334   1.373
  124    HB3  ALA  20           HB3      ALA  20  11.889   4.486   1.458
  125    H    TRP  21           H        TRP  21  10.356   2.742   0.099
  126    HA   TRP  21           HA       TRP  21   8.912   4.621  -1.650
  127    HB2  TRP  21           HB2      TRP  21   8.508   1.738  -0.995
  128    HB3  TRP  21           HB3      TRP  21   7.087   2.719  -1.342
  129    HD1  TRP  21           HD1      TRP  21  10.307   1.438  -3.009
  130    HE1  TRP  21           HE1      TRP  21   9.996   1.546  -5.562
  131    HE3  TRP  21           HE3      TRP  21   5.802   3.848  -3.177
  132    HZ2  TRP  21           HZ2      TRP  21   8.093   2.525  -7.403
  133    HZ3  TRP  21           HZ3      TRP  21   4.805   4.334  -5.373
  134    HH2  TRP  21           HH2      TRP  21   5.929   3.685  -7.442
  135    H    GLY  22           H        GLY  22   8.000   6.211  -0.524
  136    HA2  GLY  22           HA2      GLY  22   6.869   5.567   2.127
  137    HA3  GLY  22           HA3      GLY  22   7.489   7.147   1.673
  138    H    CYS  23           H        CYS  23   5.155   7.375   2.713
  139    HA   CYS  23           HA       CYS  23   3.248   7.495   0.469
  140    HB2  CYS  23           HB2      CYS  23   2.965   6.418   3.154
  141    HB3  CYS  23           HB3      CYS  23   1.746   7.641   2.811
  142    H    CYS  24           H        CYS  24   1.752   9.283   0.485
  143    HA   CYS  24           HA       CYS  24   2.650  11.595   2.066
  144    HB2  CYS  24           HB2      CYS  24   1.840  11.772  -0.838
  145    HB3  CYS  24           HB3      CYS  24   2.537  13.043   0.162
  Start of MODEL    9
    1    H1   CYS   1           H        CYS   1   1.072   0.194   0.416
    2    HA   CYS   1           HA       CYS   1  -0.683  -0.409  -1.631
    3    HB2  CYS   1           HB2      CYS   1   1.134   0.354  -3.170
    4    HB3  CYS   1           HB3      CYS   1   0.832   1.453  -1.828
    5    H    ASP   2           H        ASP   2   2.212  -2.119  -0.608
    6    HA   ASP   2           HA       ASP   2   1.574  -4.234  -2.560
    7    HB2  ASP   2           HB2      ASP   2   4.233  -3.202  -1.602
    8    HB3  ASP   2           HB3      ASP   2   4.074  -4.820  -2.281
    9    H    MET   3           H        MET   3   2.697  -6.384  -1.800
   10    HA   MET   3           HA       MET   3   1.368  -7.237   0.511
   11    HB2  MET   3           HB2      MET   3   2.451  -8.545  -1.529
   12    HB3  MET   3           HB3      MET   3   3.797  -8.701  -0.409
   13    HG2  MET   3           HG2      MET   3   2.312  -9.739   1.230
   14    HG3  MET   3           HG3      MET   3   0.968  -9.589   0.100
   15    HE1  MET   3           HE1      MET   3   0.450 -10.701  -1.632
   16    HE2  MET   3           HE2      MET   3   1.497 -11.646  -2.690
   17    HE3  MET   3           HE3      MET   3   0.577 -12.446  -1.416
   18    H    GLU   4           H        GLU   4   4.680  -6.146   0.004
   19    HA   GLU   4           HA       GLU   4   5.650  -6.851   2.571
   20    HB2  GLU   4           HB2      GLU   4   7.120  -6.391   0.642
   21    HB3  GLU   4           HB3      GLU   4   6.637  -4.701   0.689
   22    HG2  GLU   4           HG2      GLU   4   7.720  -4.346   2.754
   23    HG3  GLU   4           HG3      GLU   4   7.942  -6.074   3.017
   24    H    VAL   5           H        VAL   5   5.214  -3.538   1.340
   25    HA   VAL   5           HA       VAL   5   4.579  -2.675   4.067
   26    HB   VAL   5           HB       VAL   5   6.379  -1.492   2.815
   27   HG11  VAL   5          HG11      VAL   5   4.499   0.066   1.204
   28   HG12  VAL   5          HG12      VAL   5   6.092  -0.570   0.793
   29   HG13  VAL   5          HG13      VAL   5   4.672  -1.611   0.688
   30   HG21  VAL   5          HG21      VAL   5   4.027   0.295   3.411
   31   HG22  VAL   5          HG22      VAL   5   5.038  -0.446   4.651
   32   HG23  VAL   5          HG23      VAL   5   5.740   0.702   3.512
   33    H    SER   6           H        SER   6   2.682  -1.698   4.617
   34    HA   SER   6           HA       SER   6   0.618  -1.536   2.518
   35    HB2  SER   6           HB2      SER   6  -1.036  -2.112   4.306
   36    HB3  SER   6           HB3      SER   6   0.105  -3.410   3.958
   37    HG   SER   6           HG       SER   6   1.209  -2.925   5.821
   38    H    CYS   7           H        CYS   7  -0.507   0.315   2.361
   39    HA   CYS   7           HA       CYS   7   0.009   2.385   4.394
   40    HB2  CYS   7           HB2      CYS   7  -0.271   2.523   1.412
   41    HB3  CYS   7           HB3      CYS   7  -0.669   3.930   2.392
   42    HA   PRO   8           HA       PRO   8  -4.527   1.402   4.530
   43    HB2  PRO   8           HB2      PRO   8  -4.679   1.390   7.240
   44    HB3  PRO   8           HB3      PRO   8  -4.236  -0.037   6.297
   45    HG2  PRO   8           HG2      PRO   8  -2.472   1.896   7.751
   46    HG3  PRO   8           HG3      PRO   8  -2.376   0.126   7.683
   47    HD2  PRO   8           HD2      PRO   8  -0.791   1.729   6.183
   48    HD3  PRO   8           HD3      PRO   8  -1.339   0.135   5.625
   49    H    ASP   9           H        ASP   9  -2.527   3.724   6.276
   50    HA   ASP   9           HA       ASP   9  -4.439   5.452   7.259
   51    HB2  ASP   9           HB2      ASP   9  -1.678   5.977   6.165
   52    HB3  ASP   9           HB3      ASP   9  -2.662   7.252   6.878
   53    H    GLY  10           H        GLY  10  -3.348   5.018   3.970
   54    HA2  GLY  10           HA2      GLY  10  -4.909   5.578   2.193
   55    HA3  GLY  10           HA3      GLY  10  -5.367   6.997   3.123
   56    H    TYR  11           H        TYR  11  -2.103   5.810   2.453
   57    HA   TYR  11           HA       TYR  11  -1.577   8.346   1.049
   58    HB2  TYR  11           HB2      TYR  11   0.271   6.594   2.678
   59    HB3  TYR  11           HB3      TYR  11   0.815   7.964   1.716
   60    HD1  TYR  11           HD1      TYR  11  -0.790  10.155   2.213
   61    HD2  TYR  11           HD2      TYR  11   0.149   7.020   4.933
   62    HE1  TYR  11           HE1      TYR  11  -1.240  11.666   4.101
   63    HE2  TYR  11           HE2      TYR  11  -0.300   8.522   6.828
   64    HH   TYR  11           HH       TYR  11  -1.898  10.808   7.026
   65    H    THR  12           H        THR  12  -0.203   8.318  -0.780
   66    HA   THR  12           HA       THR  12  -0.398   5.843  -2.305
   67    HB   THR  12           HB       THR  12   0.740   8.405  -3.384
   68    HG1  THR  12           HG1      THR  12  -1.194   9.304  -3.440
   69   HG21  THR  12          HG21      THR  12  -0.488   7.536  -5.433
   70   HG22  THR  12          HG22      THR  12   0.908   6.598  -4.902
   71   HG23  THR  12          HG23      THR  12  -0.723   6.038  -4.534
   72    H    CYS  13           H        CYS  13   1.312   4.671  -3.049
   73    HA   CYS  13           HA       CYS  13   3.829   5.035  -1.696
   74    HB2  CYS  13           HB2      CYS  13   2.587   2.937  -3.398
   75    HB3  CYS  13           HB3      CYS  13   4.346   2.996  -3.354
   76    H    CYS  14           H        CYS  14   5.257   6.467  -2.411
   77    HA   CYS  14           HA       CYS  14   5.843   6.540  -5.288
   78    HB2  CYS  14           HB2      CYS  14   5.977   8.943  -5.297
   79    HB3  CYS  14           HB3      CYS  14   4.404   8.485  -4.652
   80    H    ARG  15           H        ARG  15   7.919   8.070  -5.530
   81    HA   ARG  15           HA       ARG  15   9.897   6.961  -3.659
   82    HB2  ARG  15           HB2      ARG  15  11.532   7.525  -5.519
   83    HB3  ARG  15           HB3      ARG  15  10.391   6.229  -5.852
   84    HG2  ARG  15           HG2      ARG  15   9.621   8.969  -6.673
   85    HG3  ARG  15           HG3      ARG  15  10.894   8.162  -7.591
   86    HD2  ARG  15           HD2      ARG  15   9.485   6.553  -8.395
   87    HD3  ARG  15           HD3      ARG  15   8.423   6.628  -6.990
   88    HE   ARG  15           HE       ARG  15   8.314   9.020  -8.537
   89   HH11  ARG  15          HH11      ARG  15   7.168   5.737  -8.374
   90   HH12  ARG  15          HH12      ARG  15   5.726   6.057  -9.279
   91   HH21  ARG  15          HH21      ARG  15   6.420   9.455  -9.731
   92   HH22  ARG  15          HH22      ARG  15   5.302   8.172 -10.052
   93    H    LEU  16           H        LEU  16  11.190   8.264  -2.487
   94    HA   LEU  16           HA       LEU  16  10.628  11.118  -2.555
   95    HB2  LEU  16           HB2      LEU  16  12.009   9.286  -0.633
   96    HB3  LEU  16           HB3      LEU  16  12.230  11.030  -0.519
   97    HG   LEU  16           HG       LEU  16   9.567  10.969  -0.518
   98   HD11  LEU  16          HD11      LEU  16  10.256   8.235  -0.307
   99   HD12  LEU  16          HD12      LEU  16   9.628   8.748   1.259
  100   HD13  LEU  16          HD13      LEU  16   8.659   8.976  -0.197
  101   HD21  LEU  16          HD21      LEU  16   9.677  11.437   1.745
  102   HD22  LEU  16          HD22      LEU  16  10.959  10.261   2.032
  103   HD23  LEU  16          HD23      LEU  16  11.323  11.779   1.212
  104    H    GLN  17           H        GLN  17  12.218  12.721  -2.761
  105    HA   GLN  17           HA       GLN  17  14.105  12.390  -4.746
  106    HB2  GLN  17           HB2      GLN  17  15.154  14.505  -3.764
  107    HB3  GLN  17           HB3      GLN  17  13.468  14.598  -4.254
  108    HG2  GLN  17           HG2      GLN  17  13.868  13.820  -1.463
  109    HG3  GLN  17           HG3      GLN  17  14.454  15.433  -1.865
  110   HE21  GLN  17          HE21      GLN  17  12.734  16.439  -3.575
  111   HE22  GLN  17          HE22      GLN  17  11.132  16.494  -2.931
  112    H    SER  18           H        SER  18  14.448  11.969  -1.276
  113    HA   SER  18           HA       SER  18  17.197  11.891  -1.015
  114    HB2  SER  18           HB2      SER  18  15.515  11.734   0.848
  115    HB3  SER  18           HB3      SER  18  15.281  10.040   0.418
  116    HG   SER  18           HG       SER  18  17.761  11.209   1.158
  117    H    GLY  19           H        GLY  19  15.006   9.419  -2.224
  118    HA2  GLY  19           HA2      GLY  19  15.851   7.909  -3.933
  119    HA3  GLY  19           HA3      GLY  19  17.371   7.859  -3.052
  120    H    ALA  20           H        ALA  20  14.024   7.498  -1.913
  121    HA   ALA  20           HA       ALA  20  14.509   4.684  -1.328
  122    HB1  ALA  20           HB1      ALA  20  14.813   6.655   0.653
  123    HB2  ALA  20           HB2      ALA  20  13.286   5.839   0.988
  124    HB3  ALA  20           HB3      ALA  20  14.776   4.904   0.863
  125    H    TRP  21           H        TRP  21  12.504   3.605  -0.510
  126    HA   TRP  21           HA       TRP  21  10.212   4.641  -1.991
  127    HB2  TRP  21           HB2      TRP  21   9.259   2.367  -1.604
  128    HB3  TRP  21           HB3      TRP  21  10.797   2.347  -2.461
  129    HD1  TRP  21           HD1      TRP  21  12.878   1.247  -1.231
  130    HE1  TRP  21           HE1      TRP  21  13.073  -0.265   0.842
  131    HE3  TRP  21           HE3      TRP  21   8.203   1.937   0.719
  132    HZ2  TRP  21           HZ2      TRP  21  11.458  -1.061   3.017
  133    HZ3  TRP  21           HZ3      TRP  21   7.607   0.764   2.798
  134    HH2  TRP  21           HH2      TRP  21   9.202  -0.704   3.921
  135    H    GLY  22           H        GLY  22   8.371   5.350  -1.069
  136    HA2  GLY  22           HA2      GLY  22   7.588   4.650   1.593
  137    HA3  GLY  22           HA3      GLY  22   8.252   6.275   1.516
  138    H    CYS  23           H        CYS  23   5.723   6.054   2.359
  139    HA   CYS  23           HA       CYS  23   3.959   6.495   0.071
  140    HB2  CYS  23           HB2      CYS  23   3.620   5.496   2.751
  141    HB3  CYS  23           HB3      CYS  23   2.532   6.853   2.477
  142    H    CYS  24           H        CYS  24   3.116   8.432  -0.470
  143    HA   CYS  24           HA       CYS  24   3.687  10.721   1.291
  144    HB2  CYS  24           HB2      CYS  24   4.047  12.071  -0.807
  145    HB3  CYS  24           HB3      CYS  24   5.295  10.876  -0.471
  Start of MODEL   10
    1    H1   CYS   1           H        CYS   1   5.015   1.608  -1.919
    2    HA   CYS   1           HA       CYS   1   3.266   0.417   0.132
    3    HB2  CYS   1           HB2      CYS   1   1.561   0.240  -1.751
    4    HB3  CYS   1           HB3      CYS   1   1.869   1.858  -1.128
    5    H    ASP   2           H        ASP   2   3.550  -1.691   0.347
    6    HA   ASP   2           HA       ASP   2   3.895  -3.381  -1.983
    7    HB2  ASP   2           HB2      ASP   2   6.006  -3.148   0.165
    8    HB3  ASP   2           HB3      ASP   2   5.897  -4.520  -0.933
    9    H    MET   3           H        MET   3   4.056  -5.755  -1.246
   10    HA   MET   3           HA       MET   3   1.778  -6.446   0.153
   11    HB2  MET   3           HB2      MET   3   3.378  -7.865  -1.350
   12    HB3  MET   3           HB3      MET   3   4.162  -8.262   0.173
   13    HG2  MET   3           HG2      MET   3   2.153  -9.233   1.030
   14    HG3  MET   3           HG3      MET   3   1.234  -8.673  -0.365
   15    HE1  MET   3           HE1      MET   3   2.992 -11.149   1.378
   16    HE2  MET   3           HE2      MET   3   1.793 -12.214   0.645
   17    HE3  MET   3           HE3      MET   3   3.503 -12.426   0.273
   18    H    GLU   4           H        GLU   4   5.121  -6.291   1.344
   19    HA   GLU   4           HA       GLU   4   4.521  -7.129   3.979
   20    HB2  GLU   4           HB2      GLU   4   6.806  -6.998   2.769
   21    HB3  GLU   4           HB3      GLU   4   6.822  -5.321   3.295
   22    HG2  GLU   4           HG2      GLU   4   6.863  -5.922   5.565
   23    HG3  GLU   4           HG3      GLU   4   6.422  -7.591   5.213
   24    H    VAL   5           H        VAL   5   5.357  -3.871   2.781
   25    HA   VAL   5           HA       VAL   5   3.990  -2.734   5.117
   26    HB   VAL   5           HB       VAL   5   5.837  -1.357   3.163
   27   HG11  VAL   5          HG11      VAL   5   5.902   0.169   5.358
   28   HG12  VAL   5          HG12      VAL   5   4.745   0.420   4.051
   29   HG13  VAL   5          HG13      VAL   5   4.261  -0.461   5.500
   30   HG21  VAL   5          HG21      VAL   5   7.141  -1.420   5.560
   31   HG22  VAL   5          HG22      VAL   5   6.349  -2.996   5.534
   32   HG23  VAL   5          HG23      VAL   5   7.430  -2.530   4.221
   33    H    SER   6           H        SER   6   1.877  -2.500   4.655
   34    HA   SER   6           HA       SER   6   1.097  -1.425   2.045
   35    HB2  SER   6           HB2      SER   6  -1.253  -1.979   2.932
   36    HB3  SER   6           HB3      SER   6  -0.189  -3.336   2.561
   37    HG   SER   6           HG       SER   6  -1.298  -2.624   4.921
   38    H    CYS   7           H        CYS   7  -0.681   0.200   2.029
   39    HA   CYS   7           HA       CYS   7  -0.293   2.152   4.203
   40    HB2  CYS   7           HB2      CYS   7  -0.497   2.447   1.246
   41    HB3  CYS   7           HB3      CYS   7  -1.192   3.722   2.242
   42    HA   PRO   8           HA       PRO   8  -4.739   0.819   4.302
   43    HB2  PRO   8           HB2      PRO   8  -4.855   0.602   7.005
   44    HB3  PRO   8           HB3      PRO   8  -4.317  -0.717   5.958
   45    HG2  PRO   8           HG2      PRO   8  -2.685   1.236   7.534
   46    HG3  PRO   8           HG3      PRO   8  -2.457  -0.512   7.338
   47    HD2  PRO   8           HD2      PRO   8  -1.017   1.310   5.946
   48    HD3  PRO   8           HD3      PRO   8  -1.451  -0.277   5.278
   49    H    ASP   9           H        ASP   9  -2.898   3.154   6.197
   50    HA   ASP   9           HA       ASP   9  -4.922   4.657   7.317
   51    HB2  ASP   9           HB2      ASP   9  -2.340   5.710   6.141
   52    HB3  ASP   9           HB3      ASP   9  -3.347   6.532   7.331
   53    H    GLY  10           H        GLY  10  -3.841   4.546   3.998
   54    HA2  GLY  10           HA2      GLY  10  -5.459   5.114   2.276
   55    HA3  GLY  10           HA3      GLY  10  -6.013   6.422   3.310
   56    H    TYR  11           H        TYR  11  -2.676   5.540   2.537
   57    HA   TYR  11           HA       TYR  11  -2.272   8.262   1.532
   58    HB2  TYR  11           HB2      TYR  11  -0.385   6.151   2.561
   59    HB3  TYR  11           HB3      TYR  11   0.192   7.581   1.713
   60    HD1  TYR  11           HD1      TYR  11  -0.870   9.859   2.671
   61    HD2  TYR  11           HD2      TYR  11  -0.411   6.240   4.862
   62    HE1  TYR  11           HE1      TYR  11  -0.923  11.133   4.774
   63    HE2  TYR  11           HE2      TYR  11  -0.464   7.504   6.971
   64    HH   TYR  11           HH       TYR  11  -0.117   9.706   7.806
   65    H    THR  12           H        THR  12  -0.940   8.596  -0.367
   66    HA   THR  12           HA       THR  12  -1.589   6.668  -2.448
   67    HB   THR  12           HB       THR  12  -0.561   8.473  -3.953
   68    HG1  THR  12           HG1      THR  12  -0.800  10.595  -2.692
   69   HG21  THR  12          HG21      THR  12  -3.112   8.207  -2.780
   70   HG22  THR  12          HG22      THR  12  -2.743   9.932  -2.802
   71   HG23  THR  12          HG23      THR  12  -2.698   9.002  -4.299
   72    H    CYS  13           H        CYS  13   0.049   6.119  -4.093
   73    HA   CYS  13           HA       CYS  13   2.541   5.367  -2.788
   74    HB2  CYS  13           HB2      CYS  13   1.312   4.586  -5.437
   75    HB3  CYS  13           HB3      CYS  13   2.889   4.025  -4.892
   76    H    CYS  14           H        CYS  14   4.346   6.495  -3.019
   77    HA   CYS  14           HA       CYS  14   4.939   7.822  -5.539
   78    HB2  CYS  14           HB2      CYS  14   5.324   9.986  -4.588
   79    HB3  CYS  14           HB3      CYS  14   3.707   9.484  -4.105
   80    H    ARG  15           H        ARG  15   7.188   9.044  -5.170
   81    HA   ARG  15           HA       ARG  15   8.935   7.127  -3.771
   82    HB2  ARG  15           HB2      ARG  15  10.655   7.660  -5.461
   83    HB3  ARG  15           HB3      ARG  15   9.212   6.954  -6.175
   84    HG2  ARG  15           HG2      ARG  15   8.459   9.207  -6.822
   85    HG3  ARG  15           HG3      ARG  15   9.957   9.870  -6.166
   86    HD2  ARG  15           HD2      ARG  15  11.163   8.277  -7.743
   87    HD3  ARG  15           HD3      ARG  15   9.599   8.036  -8.520
   88    HE   ARG  15           HE       ARG  15   9.886  10.734  -8.481
   89   HH11  ARG  15          HH11      ARG  15  11.869   8.108  -9.617
   90   HH12  ARG  15          HH12      ARG  15  12.599   9.036 -10.885
   91   HH21  ARG  15          HH21      ARG  15  10.840  11.966 -10.147
   92   HH22  ARG  15          HH22      ARG  15  12.014  11.230 -11.185
   93    H    LEU  16           H        LEU  16  10.933   7.983  -2.906
   94    HA   LEU  16           HA       LEU  16  10.562  10.692  -1.869
   95    HB2  LEU  16           HB2      LEU  16  12.104   8.294  -0.997
   96    HB3  LEU  16           HB3      LEU  16  12.632   9.889  -0.466
   97    HG   LEU  16           HG       LEU  16  11.240   8.756   1.208
   98   HD11  LEU  16          HD11      LEU  16   9.913  11.165  -0.027
   99   HD12  LEU  16          HD12      LEU  16   9.704  10.595   1.629
  100   HD13  LEU  16          HD13      LEU  16  11.273  11.198   1.094
  101   HD21  LEU  16          HD21      LEU  16   9.837   7.665  -0.722
  102   HD22  LEU  16          HD22      LEU  16   9.101   8.014   0.842
  103   HD23  LEU  16          HD23      LEU  16   8.837   9.104  -0.519
  104    H    GLN  17           H        GLN  17  12.179  12.270  -1.967
  105    HA   GLN  17           HA       GLN  17  13.544  12.548  -4.356
  106    HB2  GLN  17           HB2      GLN  17  12.999  14.279  -2.484
  107    HB3  GLN  17           HB3      GLN  17  14.577  13.833  -1.850
  108    HG2  GLN  17           HG2      GLN  17  14.102  14.829  -4.647
  109    HG3  GLN  17           HG3      GLN  17  14.580  15.852  -3.293
  110   HE21  GLN  17          HE21      GLN  17  15.920  15.130  -5.852
  111   HE22  GLN  17          HE22      GLN  17  17.478  14.545  -5.390
  112    H    SER  18           H        SER  18  14.706  11.294  -1.261
  113    HA   SER  18           HA       SER  18  17.410  11.085  -1.803
  114    HB2  SER  18           HB2      SER  18  15.559   9.406  -0.123
  115    HB3  SER  18           HB3      SER  18  17.279   9.033  -0.238
  116    HG   SER  18           HG       SER  18  17.079  10.383   1.481
  117    H    GLY  19           H        GLY  19  14.765   8.993  -2.804
  118    HA2  GLY  19           HA2      GLY  19  15.072   7.901  -4.992
  119    HA3  GLY  19           HA3      GLY  19  16.698   7.494  -4.465
  120    H    ALA  20           H        ALA  20  13.678   7.249  -2.634
  121    HA   ALA  20           HA       ALA  20  13.965   4.320  -2.669
  122    HB1  ALA  20           HB1      ALA  20  13.863   4.112  -0.393
  123    HB2  ALA  20           HB2      ALA  20  14.740   5.636  -0.523
  124    HB3  ALA  20           HB3      ALA  20  13.010   5.641  -0.179
  125    H    TRP  21           H        TRP  21  11.851   3.467  -1.353
  126    HA   TRP  21           HA       TRP  21   9.590   4.593  -2.854
  127    HB2  TRP  21           HB2      TRP  21   8.516   2.411  -2.569
  128    HB3  TRP  21           HB3      TRP  21  10.105   2.233  -3.310
  129    HD1  TRP  21           HD1      TRP  21  11.855   0.753  -2.065
  130    HE1  TRP  21           HE1      TRP  21  11.798  -0.660   0.085
  131    HE3  TRP  21           HE3      TRP  21   7.422   2.404  -0.126
  132    HZ2  TRP  21           HZ2      TRP  21  10.099  -1.027   2.309
  133    HZ3  TRP  21           HZ3      TRP  21   6.652   1.471   2.017
  134    HH2  TRP  21           HH2      TRP  21   7.964  -0.209   3.207
  135    H    GLY  22           H        GLY  22   7.486   4.661  -1.808
  136    HA2  GLY  22           HA2      GLY  22   6.947   4.228   0.866
  137    HA3  GLY  22           HA3      GLY  22   7.641   5.840   0.784
  138    H    CYS  23           H        CYS  23   5.333   6.092   1.738
  139    HA   CYS  23           HA       CYS  23   3.371   6.395  -0.427
  140    HB2  CYS  23           HB2      CYS  23   3.195   5.667   2.385
  141    HB3  CYS  23           HB3      CYS  23   2.083   6.969   1.972
  142    H    CYS  24           H        CYS  24   1.883   8.326  -0.163
  143    HA   CYS  24           HA       CYS  24   3.382  10.684   0.764
  144    HB2  CYS  24           HB2      CYS  24   2.281  10.090  -1.917
  145    HB3  CYS  24           HB3      CYS  24   1.978  11.715  -1.310
  Start of MODEL   11
    1    H1   CYS   1           H        CYS   1   1.313   0.139  -1.295
    2    HA   CYS   1           HA       CYS   1   2.752  -0.546  -3.386
    3    HB2  CYS   1           HB2      CYS   1   3.560  -0.087  -0.567
    4    HB3  CYS   1           HB3      CYS   1   4.788  -0.751  -1.640
    5    H    ASP   2           H        ASP   2   2.726  -2.598  -0.475
    6    HA   ASP   2           HA       ASP   2   2.753  -5.002  -1.993
    7    HB2  ASP   2           HB2      ASP   2   5.195  -4.030  -2.040
    8    HB3  ASP   2           HB3      ASP   2   5.270  -4.676  -0.403
    9    H    MET   3           H        MET   3   3.185  -6.940  -0.484
   10    HA   MET   3           HA       MET   3   1.398  -6.793   1.671
   11    HB2  MET   3           HB2      MET   3   2.186  -8.848   0.330
   12    HB3  MET   3           HB3      MET   3   3.544  -8.889   1.446
   13    HG2  MET   3           HG2      MET   3   2.237  -9.483   3.234
   14    HG3  MET   3           HG3      MET   3   0.778  -8.781   2.538
   15    HE1  MET   3           HE1      MET   3   0.234  -9.466   0.141
   16    HE2  MET   3           HE2      MET   3   0.418 -11.084  -0.536
   17    HE3  MET   3           HE3      MET   3  -0.901 -10.742   0.583
   18    H    GLU   4           H        GLU   4   4.953  -6.948   1.639
   19    HA   GLU   4           HA       GLU   4   5.368  -6.920   4.393
   20    HB2  GLU   4           HB2      GLU   4   7.004  -6.054   2.041
   21    HB3  GLU   4           HB3      GLU   4   7.573  -5.695   3.665
   22    HG2  GLU   4           HG2      GLU   4   7.351  -8.135   4.182
   23    HG3  GLU   4           HG3      GLU   4   7.034  -8.398   2.469
   24    H    VAL   5           H        VAL   5   5.128  -4.200   2.122
   25    HA   VAL   5           HA       VAL   5   4.679  -2.428   4.435
   26    HB   VAL   5           HB       VAL   5   5.588  -0.582   2.956
   27   HG11  VAL   5          HG11      VAL   5   7.690  -0.831   3.837
   28   HG12  VAL   5          HG12      VAL   5   6.796  -1.992   4.819
   29   HG13  VAL   5          HG13      VAL   5   7.765  -2.551   3.455
   30   HG21  VAL   5          HG21      VAL   5   7.284  -2.365   1.432
   31   HG22  VAL   5          HG22      VAL   5   5.580  -2.586   1.034
   32   HG23  VAL   5          HG23      VAL   5   6.319  -0.991   0.891
   33    H    SER   6           H        SER   6   2.607  -1.874   4.491
   34    HA   SER   6           HA       SER   6   1.204  -1.405   1.943
   35    HB2  SER   6           HB2      SER   6   0.137  -2.292   4.630
   36    HB3  SER   6           HB3      SER   6  -0.891  -1.819   3.278
   37    HG   SER   6           HG       SER   6  -0.498  -3.664   2.339
   38    H    CYS   7           H        CYS   7  -0.865   0.062   2.504
   39    HA   CYS   7           HA       CYS   7   0.092   2.388   4.034
   40    HB2  CYS   7           HB2      CYS   7   0.161   2.471   1.394
   41    HB3  CYS   7           HB3      CYS   7  -1.559   2.798   1.576
   42    HA   PRO   8           HA       PRO   8  -4.138   1.082   5.437
   43    HB2  PRO   8           HB2      PRO   8  -3.570   1.266   8.085
   44    HB3  PRO   8           HB3      PRO   8  -3.261  -0.192   7.135
   45    HG2  PRO   8           HG2      PRO   8  -1.362   1.971   7.956
   46    HG3  PRO   8           HG3      PRO   8  -1.125   0.214   7.960
   47    HD2  PRO   8           HD2      PRO   8  -0.145   1.811   6.006
   48    HD3  PRO   8           HD3      PRO   8  -0.671   0.143   5.702
   49    H    ASP   9           H        ASP   9  -1.971   3.672   6.455
   50    HA   ASP   9           HA       ASP   9  -3.707   5.323   7.822
   51    HB2  ASP   9           HB2      ASP   9  -1.365   5.925   6.030
   52    HB3  ASP   9           HB3      ASP   9  -2.264   7.216   6.823
   53    H    GLY  10           H        GLY  10  -3.482   4.727   4.387
   54    HA2  GLY  10           HA2      GLY  10  -5.393   5.037   2.977
   55    HA3  GLY  10           HA3      GLY  10  -5.900   6.359   4.017
   56    H    TYR  11           H        TYR  11  -2.692   5.801   2.638
   57    HA   TYR  11           HA       TYR  11  -3.017   8.299   1.106
   58    HB2  TYR  11           HB2      TYR  11  -0.829   7.355   2.880
   59    HB3  TYR  11           HB3      TYR  11  -0.353   8.208   1.416
   60    HD1  TYR  11           HD1      TYR  11  -2.161  10.336   1.051
   61    HD2  TYR  11           HD2      TYR  11  -0.744   8.726   4.726
   62    HE1  TYR  11           HE1      TYR  11  -2.602  12.488   2.157
   63    HE2  TYR  11           HE2      TYR  11  -1.182  10.873   5.842
   64    HH   TYR  11           HH       TYR  11  -2.871  12.904   5.328
   65    H    THR  12           H        THR  12  -1.244   8.441  -0.658
   66    HA   THR  12           HA       THR  12  -1.410   5.963  -2.205
   67    HB   THR  12           HB       THR  12  -0.390   8.578  -3.280
   68    HG1  THR  12           HG1      THR  12  -3.116   7.767  -3.046
   69   HG21  THR  12          HG21      THR  12  -1.394   6.007  -4.368
   70   HG22  THR  12          HG22      THR  12  -1.811   7.473  -5.256
   71   HG23  THR  12          HG23      THR  12  -0.119   7.069  -4.966
   72    H    CYS  13           H        CYS  13   0.431   5.190  -3.398
   73    HA   CYS  13           HA       CYS  13   2.848   5.287  -1.830
   74    HB2  CYS  13           HB2      CYS  13   1.853   3.681  -4.138
   75    HB3  CYS  13           HB3      CYS  13   3.593   3.771  -3.884
   76    H    CYS  14           H        CYS  14   4.184   6.957  -2.044
   77    HA   CYS  14           HA       CYS  14   4.699   7.997  -4.753
   78    HB2  CYS  14           HB2      CYS  14   4.481   9.368  -2.099
   79    HB3  CYS  14           HB3      CYS  14   5.516  10.060  -3.344
   80    H    ARG  15           H        ARG  15   6.931   9.290  -4.644
   81    HA   ARG  15           HA       ARG  15   8.899   7.368  -3.596
   82    HB2  ARG  15           HB2      ARG  15   9.049   9.239  -5.963
   83    HB3  ARG  15           HB3      ARG  15  10.412   8.303  -5.365
   84    HG2  ARG  15           HG2      ARG  15   8.979   6.246  -5.729
   85    HG3  ARG  15           HG3      ARG  15   7.878   7.299  -6.620
   86    HD2  ARG  15           HD2      ARG  15  10.811   7.001  -7.247
   87    HD3  ARG  15           HD3      ARG  15   9.535   6.079  -8.041
   88    HE   ARG  15           HE       ARG  15   9.027   8.868  -8.193
   89   HH11  ARG  15          HH11      ARG  15  10.987   6.333  -9.555
   90   HH12  ARG  15          HH12      ARG  15  11.190   7.131 -11.080
   91   HH21  ARG  15          HH21      ARG  15   9.287   9.928 -10.196
   92   HH22  ARG  15          HH22      ARG  15  10.223   9.176 -11.443
   93    H    LEU  16           H        LEU  16  10.780   8.127  -2.593
   94    HA   LEU  16           HA       LEU  16  10.539  10.850  -1.516
   95    HB2  LEU  16           HB2      LEU  16  12.182   8.551  -0.470
   96    HB3  LEU  16           HB3      LEU  16  11.920  10.104   0.320
   97    HG   LEU  16           HG       LEU  16   9.602   8.306  -0.276
   98   HD11  LEU  16          HD11      LEU  16  11.733   7.898   1.738
   99   HD12  LEU  16          HD12      LEU  16  10.065   7.682   2.271
  100   HD13  LEU  16          HD13      LEU  16  10.693   6.726   0.929
  101   HD21  LEU  16          HD21      LEU  16  10.075  10.181   2.028
  102   HD22  LEU  16          HD22      LEU  16   9.367  10.701   0.499
  103   HD23  LEU  16          HD23      LEU  16   8.550   9.485   1.481
  104    H    GLN  17           H        GLN  17  12.079  12.346  -1.859
  105    HA   GLN  17           HA       GLN  17  13.893  12.124  -3.948
  106    HB2  GLN  17           HB2      GLN  17  13.110  14.273  -3.075
  107    HB3  GLN  17           HB3      GLN  17  13.993  13.999  -1.579
  108    HG2  GLN  17           HG2      GLN  17  16.050  14.343  -2.573
  109    HG3  GLN  17           HG3      GLN  17  15.435  14.013  -4.192
  110   HE21  GLN  17          HE21      GLN  17  16.879  16.130  -4.163
  111   HE22  GLN  17          HE22      GLN  17  15.960  17.593  -4.130
  112    H    SER  18           H        SER  18  14.355  11.594  -0.493
  113    HA   SER  18           HA       SER  18  17.114  11.419  -0.377
  114    HB2  SER  18           HB2      SER  18  15.086   9.768   1.151
  115    HB3  SER  18           HB3      SER  18  16.782   9.958   1.591
  116    HG   SER  18           HG       SER  18  16.378  12.210   1.805
  117    H    GLY  19           H        GLY  19  14.767   9.041  -1.478
  118    HA2  GLY  19           HA2      GLY  19  15.577   7.559  -3.282
  119    HA3  GLY  19           HA3      GLY  19  17.026   7.328  -2.315
  120    H    ALA  20           H        ALA  20  13.612   7.297  -1.343
  121    HA   ALA  20           HA       ALA  20  13.794   4.427  -0.813
  122    HB1  ALA  20           HB1      ALA  20  13.469   6.551   1.247
  123    HB2  ALA  20           HB2      ALA  20  12.601   5.030   1.453
  124    HB3  ALA  20           HB3      ALA  20  14.359   5.030   1.321
  125    H    TRP  21           H        TRP  21  11.563   3.658   0.073
  126    HA   TRP  21           HA       TRP  21   9.524   4.851  -1.670
  127    HB2  TRP  21           HB2      TRP  21   9.423   2.136  -0.351
  128    HB3  TRP  21           HB3      TRP  21   8.426   2.726  -1.677
  129    HD1  TRP  21           HD1      TRP  21  11.596   0.887  -0.982
  130    HE1  TRP  21           HE1      TRP  21  12.829   0.393  -3.187
  131    HE3  TRP  21           HE3      TRP  21   8.889   3.885  -4.116
  132    HZ2  TRP  21           HZ2      TRP  21  12.675   1.172  -5.896
  133    HZ3  TRP  21           HZ3      TRP  21   9.497   3.954  -6.499
  134    HH2  TRP  21           HH2      TRP  21  11.352   2.625  -7.369
  135    H    GLY  22           H        GLY  22   7.909   5.970  -0.800
  136    HA2  GLY  22           HA2      GLY  22   7.062   5.330   1.945
  137    HA3  GLY  22           HA3      GLY  22   7.462   6.990   1.530
  138    H    CYS  23           H        CYS  23   5.086   6.887   2.468
  139    HA   CYS  23           HA       CYS  23   3.258   6.701   0.163
  140    HB2  CYS  23           HB2      CYS  23   3.065   5.400   2.619
  141    HB3  CYS  23           HB3      CYS  23   1.938   6.746   2.754
  142    H    CYS  24           H        CYS  24   2.668   8.618  -0.581
  143    HA   CYS  24           HA       CYS  24   2.872  10.973   1.116
  144    HB2  CYS  24           HB2      CYS  24   2.516  12.245  -0.939
  145    HB3  CYS  24           HB3      CYS  24   3.788  11.049  -1.169
  Start of MODEL   12
    1    H1   CYS   1           H        CYS   1  -0.442  -0.641  -4.736
    2    HA   CYS   1           HA       CYS   1   2.360  -0.445  -3.865
    3    HB2  CYS   1           HB2      CYS   1  -0.043  -0.999  -2.122
    4    HB3  CYS   1           HB3      CYS   1   1.575  -0.536  -1.605
    5    H    ASP   2           H        ASP   2   2.456  -2.314  -1.902
    6    HA   ASP   2           HA       ASP   2   1.567  -4.864  -2.978
    7    HB2  ASP   2           HB2      ASP   2   3.888  -4.140  -3.955
    8    HB3  ASP   2           HB3      ASP   2   4.490  -4.611  -2.368
    9    H    MET   3           H        MET   3   2.395  -6.694  -1.490
   10    HA   MET   3           HA       MET   3   1.405  -6.280   1.074
   11    HB2  MET   3           HB2      MET   3   2.970  -8.422  -0.259
   12    HB3  MET   3           HB3      MET   3   2.941  -8.435   1.499
   13    HG2  MET   3           HG2      MET   3   1.197  -9.849   0.718
   14    HG3  MET   3           HG3      MET   3   0.461  -8.400   1.399
   15    HE1  MET   3           HE1      MET   3  -0.439 -10.786  -0.634
   16    HE2  MET   3           HE2      MET   3  -1.777  -9.691  -0.282
   17    HE3  MET   3           HE3      MET   3  -1.346 -10.049  -1.954
   18    H    GLU   4           H        GLU   4   4.811  -6.608   0.067
   19    HA   GLU   4           HA       GLU   4   6.006  -6.204   2.529
   20    HB2  GLU   4           HB2      GLU   4   7.088  -5.170  -0.094
   21    HB3  GLU   4           HB3      GLU   4   8.010  -5.618   1.335
   22    HG2  GLU   4           HG2      GLU   4   7.199  -7.956   1.035
   23    HG3  GLU   4           HG3      GLU   4   6.483  -7.451  -0.494
   24    H    VAL   5           H        VAL   5   4.911  -3.811   0.167
   25    HA   VAL   5           HA       VAL   5   5.334  -1.720   2.203
   26    HB   VAL   5           HB       VAL   5   5.308  -1.288  -0.784
   27   HG11  VAL   5          HG11      VAL   5   5.181   0.866  -0.269
   28   HG12  VAL   5          HG12      VAL   5   5.138   0.469   1.448
   29   HG13  VAL   5          HG13      VAL   5   6.684   0.732   0.642
   30   HG21  VAL   5          HG21      VAL   5   7.618  -1.656   1.112
   31   HG22  VAL   5          HG22      VAL   5   7.246  -2.589  -0.338
   32   HG23  VAL   5          HG23      VAL   5   7.780  -0.914  -0.480
   33    H    SER   6           H        SER   6   3.309  -1.740   3.109
   34    HA   SER   6           HA       SER   6   1.025  -1.283   1.314
   35    HB2  SER   6           HB2      SER   6   1.120  -3.204   3.097
   36    HB3  SER   6           HB3      SER   6   0.717  -1.914   4.229
   37    HG   SER   6           HG       SER   6  -1.251  -1.976   3.522
   38    H    CYS   7           H        CYS   7  -0.783  -0.028   2.710
   39    HA   CYS   7           HA       CYS   7   0.360   2.214   4.161
   40    HB2  CYS   7           HB2      CYS   7   0.272   2.612   1.550
   41    HB3  CYS   7           HB3      CYS   7  -1.429   2.928   1.875
   42    HA   PRO   8           HA       PRO   8  -3.793   0.779   5.658
   43    HB2  PRO   8           HB2      PRO   8  -3.067   0.658   8.271
   44    HB3  PRO   8           HB3      PRO   8  -2.830  -0.684   7.145
   45    HG2  PRO   8           HG2      PRO   8  -0.863   1.366   8.089
   46    HG3  PRO   8           HG3      PRO   8  -0.645  -0.382   7.880
   47    HD2  PRO   8           HD2      PRO   8   0.234   1.424   6.064
   48    HD3  PRO   8           HD3      PRO   8  -0.327  -0.197   5.605
   49    H    ASP   9           H        ASP   9  -1.544   3.235   6.811
   50    HA   ASP   9           HA       ASP   9  -3.166   4.726   8.470
   51    HB2  ASP   9           HB2      ASP   9  -1.079   5.714   6.515
   52    HB3  ASP   9           HB3      ASP   9  -1.764   6.677   7.822
   53    H    GLY  10           H        GLY  10  -3.194   4.508   4.984
   54    HA2  GLY  10           HA2      GLY  10  -5.262   4.959   3.818
   55    HA3  GLY  10           HA3      GLY  10  -5.573   6.248   4.971
   56    H    TYR  11           H        TYR  11  -2.565   5.581   3.236
   57    HA   TYR  11           HA       TYR  11  -2.926   8.118   1.785
   58    HB2  TYR  11           HB2      TYR  11  -0.716   7.234   3.535
   59    HB3  TYR  11           HB3      TYR  11  -0.226   7.975   2.016
   60    HD1  TYR  11           HD1      TYR  11  -1.308   8.569   5.353
   61    HD2  TYR  11           HD2      TYR  11  -1.249  10.275   1.456
   62    HE1  TYR  11           HE1      TYR  11  -1.679  10.796   6.330
   63    HE2  TYR  11           HE2      TYR  11  -1.618  12.507   2.422
   64    HH   TYR  11           HH       TYR  11  -1.767  13.701   4.296
   65    H    THR  12           H        THR  12  -1.001   8.220   0.058
   66    HA   THR  12           HA       THR  12  -1.276   5.753  -1.514
   67    HB   THR  12           HB       THR  12  -0.266   8.338  -2.653
   68    HG1  THR  12           HG1      THR  12  -2.337   9.057  -2.917
   69   HG21  THR  12          HG21      THR  12  -1.767   7.297  -4.565
   70   HG22  THR  12          HG22      THR  12  -0.117   6.738  -4.291
   71   HG23  THR  12          HG23      THR  12  -1.478   5.810  -3.661
   72    H    CYS  13           H        CYS  13   0.444   4.550  -2.050
   73    HA   CYS  13           HA       CYS  13   3.002   5.188  -0.889
   74    HB2  CYS  13           HB2      CYS  13   3.690   2.986  -1.778
   75    HB3  CYS  13           HB3      CYS  13   2.207   2.888  -0.834
   76    H    CYS  14           H        CYS  14   4.738   6.022  -1.871
   77    HA   CYS  14           HA       CYS  14   4.990   5.939  -4.764
   78    HB2  CYS  14           HB2      CYS  14   5.273   8.354  -4.996
   79    HB3  CYS  14           HB3      CYS  14   3.675   7.983  -4.357
   80    H    ARG  15           H        ARG  15   7.090   7.341  -5.323
   81    HA   ARG  15           HA       ARG  15   9.165   6.352  -3.492
   82    HB2  ARG  15           HB2      ARG  15   9.312   5.473  -5.758
   83    HB3  ARG  15           HB3      ARG  15   9.318   7.104  -6.416
   84    HG2  ARG  15           HG2      ARG  15  11.467   7.550  -5.462
   85    HG3  ARG  15           HG3      ARG  15  11.445   6.018  -4.586
   86    HD2  ARG  15           HD2      ARG  15  11.568   4.775  -6.628
   87    HD3  ARG  15           HD3      ARG  15  11.350   6.237  -7.589
   88    HE   ARG  15           HE       ARG  15  13.791   5.259  -6.488
   89   HH11  ARG  15          HH11      ARG  15  12.069   8.162  -7.342
   90   HH12  ARG  15          HH12      ARG  15  13.506   9.099  -7.585
   91   HH21  ARG  15          HH21      ARG  15  15.690   6.483  -6.806
   92   HH22  ARG  15          HH22      ARG  15  15.565   8.143  -7.281
   93    H    LEU  16           H        LEU  16  10.618   7.698  -2.568
   94    HA   LEU  16           HA       LEU  16  10.106  10.553  -2.798
   95    HB2  LEU  16           HB2      LEU  16  11.614   8.823  -0.882
   96    HB3  LEU  16           HB3      LEU  16  11.919  10.559  -0.932
   97    HG   LEU  16           HG       LEU  16  10.372  10.025   0.851
   98   HD11  LEU  16          HD11      LEU  16   8.874  11.340  -1.407
   99   HD12  LEU  16          HD12      LEU  16   8.629  11.576   0.323
  100   HD13  LEU  16          HD13      LEU  16  10.116  12.137  -0.442
  101   HD21  LEU  16          HD21      LEU  16   8.301   8.937   0.533
  102   HD22  LEU  16          HD22      LEU  16   8.444   9.010  -1.223
  103   HD23  LEU  16          HD23      LEU  16   9.500   7.944  -0.296
  104    H    GLN  17           H        GLN  17  11.378  11.956  -3.835
  105    HA   GLN  17           HA       GLN  17  13.330  11.186  -5.640
  106    HB2  GLN  17           HB2      GLN  17  12.093  13.381  -5.579
  107    HB3  GLN  17           HB3      GLN  17  13.195  13.891  -4.307
  108    HG2  GLN  17           HG2      GLN  17  15.078  13.690  -5.802
  109    HG3  GLN  17           HG3      GLN  17  14.034  13.057  -7.073
  110   HE21  GLN  17          HE21      GLN  17  14.435  14.663  -8.533
  111   HE22  GLN  17          HE22      GLN  17  13.916  16.297  -8.316
  112    H    SER  18           H        SER  18  13.678  12.275  -2.300
  113    HA   SER  18           HA       SER  18  16.414  12.612  -2.154
  114    HB2  SER  18           HB2      SER  18  16.188  12.520   0.160
  115    HB3  SER  18           HB3      SER  18  14.543  12.902  -0.345
  116    HG   SER  18           HG       SER  18  15.455  10.743   0.981
  117    H    GLY  19           H        GLY  19  14.541   9.634  -2.119
  118    HA2  GLY  19           HA2      GLY  19  15.708   7.706  -3.155
  119    HA3  GLY  19           HA3      GLY  19  17.087   8.132  -2.153
  120    H    ALA  20           H        ALA  20  13.614   7.807  -1.440
  121    HA   ALA  20           HA       ALA  20  14.131   5.489   0.229
  122    HB1  ALA  20           HB1      ALA  20  14.142   6.516   2.194
  123    HB2  ALA  20           HB2      ALA  20  14.077   8.072   1.367
  124    HB3  ALA  20           HB3      ALA  20  12.584   7.262   1.838
  125    H    TRP  21           H        TRP  21  11.983   4.819   1.340
  126    HA   TRP  21           HA       TRP  21   9.819   5.182  -0.627
  127    HB2  TRP  21           HB2      TRP  21   9.017   2.932   0.194
  128    HB3  TRP  21           HB3      TRP  21  10.545   2.909  -0.682
  129    HD1  TRP  21           HD1      TRP  21  12.779   2.444   0.768
  130    HE1  TRP  21           HE1      TRP  21  13.111   1.256   3.027
  131    HE3  TRP  21           HE3      TRP  21   7.950   2.526   2.445
  132    HZ2  TRP  21           HZ2      TRP  21  11.534   0.459   5.228
  133    HZ3  TRP  21           HZ3      TRP  21   7.446   1.529   4.637
  134    HH2  TRP  21           HH2      TRP  21   9.202   0.517   5.998
  135    H    GLY  22           H        GLY  22   7.792   5.708   0.062
  136    HA2  GLY  22           HA2      GLY  22   6.973   5.513   2.794
  137    HA3  GLY  22           HA3      GLY  22   7.405   7.162   2.365
  138    H    CYS  23           H        CYS  23   5.006   7.224   3.076
  139    HA   CYS  23           HA       CYS  23   3.303   6.788   0.711
  140    HB2  CYS  23           HB2      CYS  23   2.828   6.474   3.619
  141    HB3  CYS  23           HB3      CYS  23   1.505   7.172   2.689
  142    H    CYS  24           H        CYS  24   2.996   8.603  -0.388
  143    HA   CYS  24           HA       CYS  24   2.884  11.152   1.072
  144    HB2  CYS  24           HB2      CYS  24   3.304  12.198  -1.143
  145    HB3  CYS  24           HB3      CYS  24   4.591  11.106  -0.645
  Start of MODEL   13
    1    H1   CYS   1           H        CYS   1   4.664   1.385   0.138
    2    HA   CYS   1           HA       CYS   1   3.188   0.148  -1.158
    3    HB2  CYS   1           HB2      CYS   1   4.207   2.147  -2.471
    4    HB3  CYS   1           HB3      CYS   1   5.053   0.905  -3.389
    5    H    ASP   2           H        ASP   2   5.008  -1.636  -0.030
    6    HA   ASP   2           HA       ASP   2   5.736  -3.435  -2.232
    7    HB2  ASP   2           HB2      ASP   2   6.479  -3.750   0.676
    8    HB3  ASP   2           HB3      ASP   2   7.212  -4.538  -0.718
    9    H    MET   3           H        MET   3   5.569  -5.862  -1.450
   10    HA   MET   3           HA       MET   3   2.843  -6.494  -1.353
   11    HB2  MET   3           HB2      MET   3   4.890  -7.913  -2.112
   12    HB3  MET   3           HB3      MET   3   4.952  -8.417  -0.428
   13    HG2  MET   3           HG2      MET   3   3.049  -9.641  -0.573
   14    HG3  MET   3           HG3      MET   3   2.338  -8.595  -1.800
   15    HE1  MET   3           HE1      MET   3   2.002 -11.819  -3.281
   16    HE2  MET   3           HE2      MET   3   1.354 -10.230  -2.872
   17    HE3  MET   3           HE3      MET   3   2.074 -10.507  -4.457
   18    H    GLU   4           H        GLU   4   5.293  -6.369   1.190
   19    HA   GLU   4           HA       GLU   4   3.334  -7.151   3.200
   20    HB2  GLU   4           HB2      GLU   4   5.215  -7.140   4.760
   21    HB3  GLU   4           HB3      GLU   4   5.591  -8.099   3.335
   22    HG2  GLU   4           HG2      GLU   4   6.650  -5.852   2.493
   23    HG3  GLU   4           HG3      GLU   4   6.712  -5.491   4.218
   24    H    VAL   5           H        VAL   5   5.230  -4.348   2.218
   25    HA   VAL   5           HA       VAL   5   4.113  -2.726   4.363
   26    HB   VAL   5           HB       VAL   5   5.938  -1.837   2.128
   27   HG11  VAL   5          HG11      VAL   5   5.639   0.186   2.992
   28   HG12  VAL   5          HG12      VAL   5   4.598  -0.471   4.255
   29   HG13  VAL   5          HG13      VAL   5   6.342  -0.384   4.506
   30   HG21  VAL   5          HG21      VAL   5   7.696  -2.011   3.990
   31   HG22  VAL   5          HG22      VAL   5   6.547  -3.083   4.789
   32   HG23  VAL   5          HG23      VAL   5   7.184  -3.501   3.198
   33    H    SER   6           H        SER   6   2.008  -2.278   3.984
   34    HA   SER   6           HA       SER   6   1.238  -1.297   1.327
   35    HB2  SER   6           HB2      SER   6  -1.107  -1.608   2.177
   36    HB3  SER   6           HB3      SER   6  -0.162  -3.096   2.107
   37    HG   SER   6           HG       SER   6  -1.442  -2.514   4.118
   38    H    CYS   7           H        CYS   7  -0.852   0.277   1.750
   39    HA   CYS   7           HA       CYS   7   0.220   2.478   3.391
   40    HB2  CYS   7           HB2      CYS   7  -0.030   2.624   0.764
   41    HB3  CYS   7           HB3      CYS   7  -1.711   2.969   1.162
   42    HA   PRO   8           HA       PRO   8  -3.825   1.195   5.273
   43    HB2  PRO   8           HB2      PRO   8  -2.938   1.327   7.836
   44    HB3  PRO   8           HB3      PRO   8  -2.763  -0.117   6.832
   45    HG2  PRO   8           HG2      PRO   8  -0.754   2.014   7.450
   46    HG3  PRO   8           HG3      PRO   8  -0.538   0.254   7.398
   47    HD2  PRO   8           HD2      PRO   8   0.216   1.876   5.364
   48    HD3  PRO   8           HD3      PRO   8  -0.362   0.218   5.100
   49    H    ASP   9           H        ASP   9  -1.523   3.751   6.042
   50    HA   ASP   9           HA       ASP   9  -3.049   5.395   7.646
   51    HB2  ASP   9           HB2      ASP   9  -1.133   6.248   5.465
   52    HB3  ASP   9           HB3      ASP   9  -1.685   7.260   6.797
   53    H    GLY  10           H        GLY  10  -3.290   4.841   4.206
   54    HA2  GLY  10           HA2      GLY  10  -5.375   5.183   3.074
   55    HA3  GLY  10           HA3      GLY  10  -5.717   6.504   4.182
   56    H    TYR  11           H        TYR  11  -2.735   5.914   2.374
   57    HA   TYR  11           HA       TYR  11  -3.268   8.372   0.841
   58    HB2  TYR  11           HB2      TYR  11  -0.688   7.498   2.146
   59    HB3  TYR  11           HB3      TYR  11  -0.778   8.779   0.942
   60    HD1  TYR  11           HD1      TYR  11  -2.403  10.738   1.471
   61    HD2  TYR  11           HD2      TYR  11  -0.947   8.013   4.397
   62    HE1  TYR  11           HE1      TYR  11  -2.923  12.368   3.239
   63    HE2  TYR  11           HE2      TYR  11  -1.465   9.635   6.172
   64    HH   TYR  11           HH       TYR  11  -2.110  11.724   6.627
   65    H    THR  12           H        THR  12  -1.421   8.487  -0.969
   66    HA   THR  12           HA       THR  12  -1.761   6.026  -2.509
   67    HB   THR  12           HB       THR  12  -0.474   8.428  -3.708
   68    HG1  THR  12           HG1      THR  12  -3.283   8.361  -3.573
   69   HG21  THR  12          HG21      THR  12  -0.750   6.829  -5.322
   70   HG22  THR  12          HG22      THR  12  -2.190   6.152  -4.560
   71   HG23  THR  12          HG23      THR  12  -2.300   7.658  -5.472
   72    H    CYS  13           H        CYS  13   0.089   5.377  -3.940
   73    HA   CYS  13           HA       CYS  13   2.440   5.028  -2.314
   74    HB2  CYS  13           HB2      CYS  13   1.681   4.057  -5.070
   75    HB3  CYS  13           HB3      CYS  13   3.235   3.699  -4.325
   76    H    CYS  14           H        CYS  14   4.186   6.269  -2.327
   77    HA   CYS  14           HA       CYS  14   4.888   7.742  -4.762
   78    HB2  CYS  14           HB2      CYS  14   4.947   9.043  -2.038
   79    HB3  CYS  14           HB3      CYS  14   5.210   9.807  -3.603
   80    H    ARG  15           H        ARG  15   7.116   8.904  -4.304
   81    HA   ARG  15           HA       ARG  15   8.848   7.046  -2.816
   82    HB2  ARG  15           HB2      ARG  15  10.541   7.295  -4.616
   83    HB3  ARG  15           HB3      ARG  15   9.074   6.488  -5.154
   84    HG2  ARG  15           HG2      ARG  15   9.220   9.421  -5.529
   85    HG3  ARG  15           HG3      ARG  15  10.248   8.414  -6.552
   86    HD2  ARG  15           HD2      ARG  15   7.393   7.646  -6.235
   87    HD3  ARG  15           HD3      ARG  15   7.771   9.042  -7.243
   88    HE   ARG  15           HE       ARG  15   9.445   6.944  -8.009
   89   HH11  ARG  15          HH11      ARG  15   6.061   7.762  -8.034
   90   HH12  ARG  15          HH12      ARG  15   5.709   6.818  -9.443
   91   HH21  ARG  15          HH21      ARG  15   8.995   5.698  -9.866
   92   HH22  ARG  15          HH22      ARG  15   7.379   5.644 -10.484
   93    H    LEU  16           H        LEU  16  11.078   8.009  -2.472
   94    HA   LEU  16           HA       LEU  16  10.778  10.853  -1.778
   95    HB2  LEU  16           HB2      LEU  16  12.204   8.575  -0.484
   96    HB3  LEU  16           HB3      LEU  16  12.804  10.215  -0.245
   97    HG   LEU  16           HG       LEU  16  10.328  10.690   0.474
   98   HD11  LEU  16          HD11      LEU  16   9.053   8.935   1.200
   99   HD12  LEU  16          HD12      LEU  16   9.840   8.197  -0.195
  100   HD13  LEU  16          HD13      LEU  16  10.443   7.874   1.430
  101   HD21  LEU  16          HD21      LEU  16  12.500  10.706   1.829
  102   HD22  LEU  16          HD22      LEU  16  10.986  10.492   2.708
  103   HD23  LEU  16          HD23      LEU  16  12.018   9.100   2.377
  104    H    GLN  17           H        GLN  17  12.542  12.269  -2.094
  105    HA   GLN  17           HA       GLN  17  13.850  12.098  -4.517
  106    HB2  GLN  17           HB2      GLN  17  13.539  14.112  -2.924
  107    HB3  GLN  17           HB3      GLN  17  15.051  13.585  -2.198
  108    HG2  GLN  17           HG2      GLN  17  14.921  13.973  -5.146
  109    HG3  GLN  17           HG3      GLN  17  15.020  15.383  -4.094
  110   HE21  GLN  17          HE21      GLN  17  17.038  15.246  -5.677
  111   HE22  GLN  17          HE22      GLN  17  18.459  14.613  -4.927
  112    H    SER  18           H        SER  18  15.072  11.240  -1.300
  113    HA   SER  18           HA       SER  18  17.695  10.650  -1.930
  114    HB2  SER  18           HB2      SER  18  15.810   9.465   0.100
  115    HB3  SER  18           HB3      SER  18  17.484   8.925  -0.027
  116    HG   SER  18           HG       SER  18  18.182  10.885   0.603
  117    H    GLY  19           H        GLY  19  14.802   8.713  -2.425
  118    HA2  GLY  19           HA2      GLY  19  14.853   7.244  -4.401
  119    HA3  GLY  19           HA3      GLY  19  16.467   6.764  -3.896
  120    H    ALA  20           H        ALA  20  13.395   7.076  -2.122
  121    HA   ALA  20           HA       ALA  20  13.520   4.198  -1.539
  122    HB1  ALA  20           HB1      ALA  20  13.182   6.416   0.469
  123    HB2  ALA  20           HB2      ALA  20  12.794   4.729   0.807
  124    HB3  ALA  20           HB3      ALA  20  14.449   5.190   0.410
  125    H    TRP  21           H        TRP  21  11.400   3.511  -0.402
  126    HA   TRP  21           HA       TRP  21   9.214   4.528  -2.044
  127    HB2  TRP  21           HB2      TRP  21   7.994   2.520  -1.228
  128    HB3  TRP  21           HB3      TRP  21   9.511   2.125  -2.030
  129    HD1  TRP  21           HD1      TRP  21  11.236   0.733  -0.684
  130    HE1  TRP  21           HE1      TRP  21  11.321  -0.213   1.708
  131    HE3  TRP  21           HE3      TRP  21   7.183   3.146   1.287
  132    HZ2  TRP  21           HZ2      TRP  21   9.862   0.031   4.112
  133    HZ3  TRP  21           HZ3      TRP  21   6.595   2.734   3.641
  134    HH2  TRP  21           HH2      TRP  21   7.908   1.208   5.022
  135    H    GLY  22           H        GLY  22   7.067   4.839  -1.064
  136    HA2  GLY  22           HA2      GLY  22   6.594   5.104   1.672
  137    HA3  GLY  22           HA3      GLY  22   7.186   6.656   1.100
  138    H    CYS  23           H        CYS  23   4.943   7.181   1.964
  139    HA   CYS  23           HA       CYS  23   3.046   7.024  -0.279
  140    HB2  CYS  23           HB2      CYS  23   2.625   6.325   2.582
  141    HB3  CYS  23           HB3      CYS  23   1.318   7.168   1.758
  142    H    CYS  24           H        CYS  24   1.838   8.853  -0.683
  143    HA   CYS  24           HA       CYS  24   2.147  11.154   1.088
  144    HB2  CYS  24           HB2      CYS  24   2.951  12.619  -0.610
  145    HB3  CYS  24           HB3      CYS  24   3.985  11.194  -0.650
  Start of MODEL   14
    1    H1   CYS   1           H        CYS   1   0.017  -0.256  -0.985
    2    HA   CYS   1           HA       CYS   1  -1.412  -1.817  -2.703
    3    HB2  CYS   1           HB2      CYS   1   0.376  -1.259  -4.420
    4    HB3  CYS   1           HB3      CYS   1  -0.330   0.111  -3.570
    5    H    ASP   2           H        ASP   2   1.757  -2.518  -1.332
    6    HA   ASP   2           HA       ASP   2   1.687  -5.163  -2.622
    7    HB2  ASP   2           HB2      ASP   2   3.982  -3.490  -1.608
    8    HB3  ASP   2           HB3      ASP   2   4.159  -5.203  -1.982
    9    H    MET   3           H        MET   3   2.236  -7.018  -1.382
   10    HA   MET   3           HA       MET   3   1.013  -7.190   1.108
   11    HB2  MET   3           HB2      MET   3   2.218  -9.374   1.323
   12    HB3  MET   3           HB3      MET   3   1.350  -9.174  -0.194
   13    HG2  MET   3           HG2      MET   3   3.509  -8.489  -1.244
   14    HG3  MET   3           HG3      MET   3   4.311  -8.932   0.261
   15    HE1  MET   3           HE1      MET   3   5.892 -10.640  -0.564
   16    HE2  MET   3           HE2      MET   3   5.074 -11.357   0.825
   17    HE3  MET   3           HE3      MET   3   5.385 -12.329  -0.613
   18    H    GLU   4           H        GLU   4   4.433  -6.755   0.296
   19    HA   GLU   4           HA       GLU   4   5.282  -6.777   3.036
   20    HB2  GLU   4           HB2      GLU   4   6.616  -7.294   0.817
   21    HB3  GLU   4           HB3      GLU   4   6.938  -5.566   0.864
   22    HG2  GLU   4           HG2      GLU   4   8.750  -6.359   1.994
   23    HG3  GLU   4           HG3      GLU   4   7.639  -6.073   3.333
   24    H    VAL   5           H        VAL   5   4.955  -4.250   0.550
   25    HA   VAL   5           HA       VAL   5   5.134  -2.221   2.670
   26    HB   VAL   5           HB       VAL   5   5.312  -1.788  -0.313
   27   HG11  VAL   5          HG11      VAL   5   4.657   0.221   0.762
   28   HG12  VAL   5          HG12      VAL   5   5.817  -0.020   2.069
   29   HG13  VAL   5          HG13      VAL   5   6.386   0.364   0.445
   30   HG21  VAL   5          HG21      VAL   5   7.355  -2.541   1.700
   31   HG22  VAL   5          HG22      VAL   5   7.260  -2.927  -0.018
   32   HG23  VAL   5          HG23      VAL   5   7.805  -1.332   0.498
   33    H    SER   6           H        SER   6   3.271  -1.455   3.396
   34    HA   SER   6           HA       SER   6   1.013  -1.228   1.515
   35    HB2  SER   6           HB2      SER   6  -0.504  -1.648   3.403
   36    HB3  SER   6           HB3      SER   6   0.611  -2.995   3.181
   37    HG   SER   6           HG       SER   6   1.520  -2.564   5.045
   38    H    CYS   7           H        CYS   7  -0.714   0.331   2.552
   39    HA   CYS   7           HA       CYS   7   0.615   2.645   3.767
   40    HB2  CYS   7           HB2      CYS   7  -1.002   2.652   1.219
   41    HB3  CYS   7           HB3      CYS   7  -0.713   4.110   2.164
   42    HA   PRO   8           HA       PRO   8  -3.435   1.596   5.783
   43    HB2  PRO   8           HB2      PRO   8  -2.481   1.764   8.320
   44    HB3  PRO   8           HB3      PRO   8  -2.396   0.284   7.357
   45    HG2  PRO   8           HG2      PRO   8  -0.279   2.339   7.864
   46    HG3  PRO   8           HG3      PRO   8  -0.144   0.571   7.861
   47    HD2  PRO   8           HD2      PRO   8   0.633   2.095   5.762
   48    HD3  PRO   8           HD3      PRO   8  -0.025   0.458   5.562
   49    H    ASP   9           H        ASP   9  -0.998   4.056   6.467
   50    HA   ASP   9           HA       ASP   9  -2.444   5.814   8.029
   51    HB2  ASP   9           HB2      ASP   9  -0.234   6.152   6.045
   52    HB3  ASP   9           HB3      ASP   9  -1.028   7.592   6.677
   53    H    GLY  10           H        GLY  10  -2.689   5.195   4.600
   54    HA2  GLY  10           HA2      GLY  10  -4.832   5.623   3.538
   55    HA3  GLY  10           HA3      GLY  10  -4.950   7.090   4.500
   56    H    TYR  11           H        TYR  11  -2.152   5.913   2.683
   57    HA   TYR  11           HA       TYR  11  -2.472   8.171   0.828
   58    HB2  TYR  11           HB2      TYR  11  -0.052   7.432   2.451
   59    HB3  TYR  11           HB3      TYR  11   0.111   8.308   0.933
   60    HD1  TYR  11           HD1      TYR  11   0.376   8.901   4.184
   61    HD2  TYR  11           HD2      TYR  11  -2.072  10.193   0.953
   62    HE1  TYR  11           HE1      TYR  11  -0.056  11.015   5.365
   63    HE2  TYR  11           HE2      TYR  11  -2.510  12.311   2.124
   64    HH   TYR  11           HH       TYR  11  -1.766  13.658   3.834
   65    H    THR  12           H        THR  12  -0.898   7.935  -1.068
   66    HA   THR  12           HA       THR  12  -1.208   5.236  -2.110
   67    HB   THR  12           HB       THR  12  -0.190   6.445  -4.215
   68    HG1  THR  12           HG1      THR  12  -0.041   8.551  -4.049
   69   HG21  THR  12          HG21      THR  12  -2.965   6.795  -3.105
   70   HG22  THR  12          HG22      THR  12  -2.522   7.343  -4.722
   71   HG23  THR  12          HG23      THR  12  -2.403   5.633  -4.307
   72    H    CYS  13           H        CYS  13   0.564   4.234  -3.341
   73    HA   CYS  13           HA       CYS  13   3.011   4.320  -1.809
   74    HB2  CYS  13           HB2      CYS  13   2.257   2.632  -4.205
   75    HB3  CYS  13           HB3      CYS  13   3.683   2.402  -3.198
   76    H    CYS  14           H        CYS  14   4.654   5.612  -2.263
   77    HA   CYS  14           HA       CYS  14   5.431   6.081  -5.023
   78    HB2  CYS  14           HB2      CYS  14   5.391   8.469  -4.902
   79    HB3  CYS  14           HB3      CYS  14   3.799   7.900  -4.412
   80    H    ARG  15           H        ARG  15   7.444   7.668  -4.951
   81    HA   ARG  15           HA       ARG  15   9.151   6.822  -2.703
   82    HB2  ARG  15           HB2      ARG  15  11.030   6.659  -4.261
   83    HB3  ARG  15           HB3      ARG  15   9.725   5.579  -4.733
   84    HG2  ARG  15           HG2      ARG  15  10.221   6.455  -6.763
   85    HG3  ARG  15           HG3      ARG  15   9.041   7.654  -6.227
   86    HD2  ARG  15           HD2      ARG  15  10.703   9.211  -5.683
   87    HD3  ARG  15           HD3      ARG  15  11.972   7.987  -5.681
   88    HE   ARG  15           HE       ARG  15  11.037   8.003  -8.246
   89   HH11  ARG  15          HH11      ARG  15  12.334  10.399  -6.079
   90   HH12  ARG  15          HH12      ARG  15  13.021  11.361  -7.346
   91   HH21  ARG  15          HH21      ARG  15  11.937   9.261  -9.922
   92   HH22  ARG  15          HH22      ARG  15  12.794  10.714  -9.531
   93    H    LEU  16           H        LEU  16  10.885   8.256  -2.148
   94    HA   LEU  16           HA       LEU  16  10.254  11.053  -2.787
   95    HB2  LEU  16           HB2      LEU  16  11.717   9.812  -0.465
   96    HB3  LEU  16           HB3      LEU  16  11.607  11.550  -0.738
   97    HG   LEU  16           HG       LEU  16   9.028  11.089  -0.697
   98   HD11  LEU  16          HD11      LEU  16  10.216   8.635   0.523
   99   HD12  LEU  16          HD12      LEU  16   8.692   9.278   1.135
  100   HD13  LEU  16          HD13      LEU  16   8.830   8.796  -0.556
  101   HD21  LEU  16          HD21      LEU  16  10.780  11.115   1.758
  102   HD22  LEU  16          HD22      LEU  16  10.163  12.517   0.883
  103   HD23  LEU  16          HD23      LEU  16   9.049  11.457   1.747
  104    H    GLN  17           H        GLN  17  12.171  12.555  -2.768
  105    HA   GLN  17           HA       GLN  17  13.917  11.980  -4.826
  106    HB2  GLN  17           HB2      GLN  17  14.124  13.946  -2.553
  107    HB3  GLN  17           HB3      GLN  17  15.326  13.870  -3.835
  108    HG2  GLN  17           HG2      GLN  17  13.262  14.099  -5.404
  109    HG3  GLN  17           HG3      GLN  17  12.476  14.733  -3.959
  110   HE21  GLN  17          HE21      GLN  17  14.147  15.563  -6.655
  111   HE22  GLN  17          HE22      GLN  17  14.764  17.097  -6.157
  112    H    SER  18           H        SER  18  14.413  11.599  -1.344
  113    HA   SER  18           HA       SER  18  17.099  10.971  -1.287
  114    HB2  SER  18           HB2      SER  18  15.412  11.197   0.659
  115    HB3  SER  18           HB3      SER  18  15.110   9.477   0.410
  116    HG   SER  18           HG       SER  18  17.486   9.272   0.601
  117    H    GLY  19           H        GLY  19  14.373   8.958  -2.213
  118    HA2  GLY  19           HA2      GLY  19  14.924   7.270  -3.947
  119    HA3  GLY  19           HA3      GLY  19  16.293   6.829  -2.936
  120    H    ALA  20           H        ALA  20  14.717   7.083  -0.461
  121    HA   ALA  20           HA       ALA  20  13.845   4.413  -0.248
  122    HB1  ALA  20           HB1      ALA  20  14.661   5.884   1.623
  123    HB2  ALA  20           HB2      ALA  20  13.075   6.655   1.607
  124    HB3  ALA  20           HB3      ALA  20  13.216   4.937   1.979
  125    H    TRP  21           H        TRP  21  11.659   3.714   0.403
  126    HA   TRP  21           HA       TRP  21   9.681   4.891  -1.377
  127    HB2  TRP  21           HB2      TRP  21   8.407   2.878  -1.039
  128    HB3  TRP  21           HB3      TRP  21  10.086   2.422  -1.313
  129    HD1  TRP  21           HD1      TRP  21  11.313   1.110   0.589
  130    HE1  TRP  21           HE1      TRP  21  10.562   0.137   2.851
  131    HE3  TRP  21           HE3      TRP  21   6.750   3.382   0.976
  132    HZ2  TRP  21           HZ2      TRP  21   8.331   0.309   4.571
  133    HZ3  TRP  21           HZ3      TRP  21   5.369   2.925   2.961
  134    HH2  TRP  21           HH2      TRP  21   6.145   1.419   4.719
  135    H    GLY  22           H        GLY  22   7.644   5.617  -0.727
  136    HA2  GLY  22           HA2      GLY  22   7.109   5.815   2.142
  137    HA3  GLY  22           HA3      GLY  22   7.278   7.320   1.251
  138    H    CYS  23           H        CYS  23   4.963   6.950   2.531
  139    HA   CYS  23           HA       CYS  23   3.064   6.081   0.453
  140    HB2  CYS  23           HB2      CYS  23   2.883   6.125   3.455
  141    HB3  CYS  23           HB3      CYS  23   1.430   6.089   2.461
  142    H    CYS  24           H        CYS  24   2.947   7.990  -0.704
  143    HA   CYS  24           HA       CYS  24   1.849  10.305   0.753
  144    HB2  CYS  24           HB2      CYS  24   2.877  11.764  -0.841
  145    HB3  CYS  24           HB3      CYS  24   4.112  10.631  -0.303
  Start of MODEL   15
    1    H1   CYS   1           H        CYS   1  -0.736  -1.724   0.173
    2    HA   CYS   1           HA       CYS   1  -0.398  -1.295  -2.658
    3    HB2  CYS   1           HB2      CYS   1   0.384   0.181  -0.613
    4    HB3  CYS   1           HB3      CYS   1   1.808  -0.851  -0.690
    5    H    ASP   2           H        ASP   2   1.372  -3.103  -0.151
    6    HA   ASP   2           HA       ASP   2   2.293  -4.941  -2.253
    7    HB2  ASP   2           HB2      ASP   2   4.025  -3.190  -1.324
    8    HB3  ASP   2           HB3      ASP   2   4.101  -4.298   0.043
    9    H    MET   3           H        MET   3   3.350  -6.946  -1.125
   10    HA   MET   3           HA       MET   3   1.302  -8.163   0.428
   11    HB2  MET   3           HB2      MET   3   4.012  -9.020  -0.529
   12    HB3  MET   3           HB3      MET   3   3.133 -10.009   0.630
   13    HG2  MET   3           HG2      MET   3   2.587 -10.928  -1.429
   14    HG3  MET   3           HG3      MET   3   1.199  -9.920  -1.030
   15    HE1  MET   3           HE1      MET   3   1.799 -11.123  -3.784
   16    HE2  MET   3           HE2      MET   3   2.435 -10.029  -5.013
   17    HE3  MET   3           HE3      MET   3   3.538 -10.857  -3.913
   18    H    GLU   4           H        GLU   4   4.467  -6.807   1.163
   19    HA   GLU   4           HA       GLU   4   4.049  -7.422   4.007
   20    HB2  GLU   4           HB2      GLU   4   6.464  -6.911   4.264
   21    HB3  GLU   4           HB3      GLU   4   6.154  -8.252   3.171
   22    HG2  GLU   4           HG2      GLU   4   6.414  -6.690   1.264
   23    HG3  GLU   4           HG3      GLU   4   6.864  -5.430   2.411
   24    H    VAL   5           H        VAL   5   4.883  -4.807   1.774
   25    HA   VAL   5           HA       VAL   5   4.605  -2.843   3.921
   26    HB   VAL   5           HB       VAL   5   5.372  -2.374   1.038
   27   HG11  VAL   5          HG11      VAL   5   6.362  -0.479   2.974
   28   HG12  VAL   5          HG12      VAL   5   5.412  -0.201   1.514
   29   HG13  VAL   5          HG13      VAL   5   4.603  -0.586   3.034
   30   HG21  VAL   5          HG21      VAL   5   7.220  -3.522   1.646
   31   HG22  VAL   5          HG22      VAL   5   7.655  -1.997   2.417
   32   HG23  VAL   5          HG23      VAL   5   6.927  -3.291   3.370
   33    H    SER   6           H        SER   6   2.613  -2.154   4.331
   34    HA   SER   6           HA       SER   6   0.781  -1.732   2.060
   35    HB2  SER   6           HB2      SER   6  -1.075  -2.111   3.646
   36    HB3  SER   6           HB3      SER   6  -0.010  -3.513   3.543
   37    HG   SER   6           HG       SER   6   0.731  -3.123   5.528
   38    H    CYS   7           H        CYS   7  -0.751   0.038   2.292
   39    HA   CYS   7           HA       CYS   7   0.371   2.248   3.886
   40    HB2  CYS   7           HB2      CYS   7   0.312   2.267   1.245
   41    HB3  CYS   7           HB3      CYS   7  -1.363   2.745   1.501
   42    HA   PRO   8           HA       PRO   8  -3.878   1.354   5.531
   43    HB2  PRO   8           HB2      PRO   8  -3.160   1.546   8.142
   44    HB3  PRO   8           HB3      PRO   8  -3.029   0.045   7.218
   45    HG2  PRO   8           HG2      PRO   8  -0.909   2.051   7.884
   46    HG3  PRO   8           HG3      PRO   8  -0.826   0.280   7.925
   47    HD2  PRO   8           HD2      PRO   8   0.187   1.739   5.882
   48    HD3  PRO   8           HD3      PRO   8  -0.497   0.118   5.649
   49    H    ASP   9           H        ASP   9  -1.444   3.764   6.372
   50    HA   ASP   9           HA       ASP   9  -2.959   5.593   7.776
   51    HB2  ASP   9           HB2      ASP   9  -0.802   6.180   5.736
   52    HB3  ASP   9           HB3      ASP   9  -1.387   7.309   6.956
   53    H    GLY  10           H        GLY  10  -2.963   4.898   4.353
   54    HA2  GLY  10           HA2      GLY  10  -4.900   5.346   3.023
   55    HA3  GLY  10           HA3      GLY  10  -5.249   6.723   4.057
   56    H    TYR  11           H        TYR  11  -2.164   5.882   2.546
   57    HA   TYR  11           HA       TYR  11  -2.377   8.343   0.939
   58    HB2  TYR  11           HB2      TYR  11  -0.080   7.280   2.557
   59    HB3  TYR  11           HB3      TYR  11   0.208   8.343   1.184
   60    HD1  TYR  11           HD1      TYR  11   0.279   8.471   4.504
   61    HD2  TYR  11           HD2      TYR  11  -1.874  10.320   1.334
   62    HE1  TYR  11           HE1      TYR  11  -0.140  10.426   5.937
   63    HE2  TYR  11           HE2      TYR  11  -2.298  12.281   2.758
   64    HH   TYR  11           HH       TYR  11  -2.152  13.120   4.826
   65    H    THR  12           H        THR  12  -0.430   8.263  -0.758
   66    HA   THR  12           HA       THR  12  -0.787   5.729  -2.204
   67    HB   THR  12           HB       THR  12   0.113   7.168  -4.169
   68    HG1  THR  12           HG1      THR  12   0.096   9.308  -3.889
   69   HG21  THR  12          HG21      THR  12  -2.283   6.345  -3.685
   70   HG22  THR  12          HG22      THR  12  -2.591   8.003  -3.169
   71   HG23  THR  12          HG23      THR  12  -2.073   7.676  -4.822
   72    H    CYS  13           H        CYS  13   0.964   4.664  -3.132
   73    HA   CYS  13           HA       CYS  13   3.464   5.010  -1.743
   74    HB2  CYS  13           HB2      CYS  13   2.637   3.068  -3.910
   75    HB3  CYS  13           HB3      CYS  13   4.171   3.013  -3.047
   76    H    CYS  14           H        CYS  14   4.587   6.769  -2.379
   77    HA   CYS  14           HA       CYS  14   5.358   6.894  -5.216
   78    HB2  CYS  14           HB2      CYS  14   5.263   9.309  -5.178
   79    HB3  CYS  14           HB3      CYS  14   3.702   8.671  -4.672
   80    H    ARG  15           H        ARG  15   7.404   8.056  -5.587
   81    HA   ARG  15           HA       ARG  15   9.314   7.394  -3.480
   82    HB2  ARG  15           HB2      ARG  15   9.727   8.172  -6.372
   83    HB3  ARG  15           HB3      ARG  15  11.019   7.765  -5.250
   84    HG2  ARG  15           HG2      ARG  15  10.504   5.533  -5.247
   85    HG3  ARG  15           HG3      ARG  15   8.813   5.813  -5.666
   86    HD2  ARG  15           HD2      ARG  15  10.244   4.795  -7.478
   87    HD3  ARG  15           HD3      ARG  15   9.348   6.245  -7.928
   88    HE   ARG  15           HE       ARG  15  11.337   7.346  -8.225
   89   HH11  ARG  15          HH11      ARG  15  11.905   4.384  -6.486
   90   HH12  ARG  15          HH12      ARG  15  13.631   4.502  -6.590
   91   HH21  ARG  15          HH21      ARG  15  13.607   7.512  -8.368
   92   HH22  ARG  15          HH22      ARG  15  14.598   6.282  -7.659
   93    H    LEU  16           H        LEU  16  10.821   8.863  -2.662
   94    HA   LEU  16           HA       LEU  16   9.971  11.659  -2.836
   95    HB2  LEU  16           HB2      LEU  16  11.583  10.102  -0.844
   96    HB3  LEU  16           HB3      LEU  16  11.591  11.865  -0.853
   97    HG   LEU  16           HG       LEU  16   8.998  11.595  -0.693
   98   HD11  LEU  16          HD11      LEU  16   8.863   9.222  -1.016
   99   HD12  LEU  16          HD12      LEU  16   9.987   8.932   0.312
  100   HD13  LEU  16          HD13      LEU  16   8.386   9.594   0.641
  101   HD21  LEU  16          HD21      LEU  16   9.189  11.533   1.774
  102   HD22  LEU  16          HD22      LEU  16  10.882  11.070   1.603
  103   HD23  LEU  16          HD23      LEU  16  10.334  12.641   1.019
  104    H    GLN  17           H        GLN  17  11.905  13.241  -2.475
  105    HA   GLN  17           HA       GLN  17  13.422  13.332  -4.778
  106    HB2  GLN  17           HB2      GLN  17  12.977  15.135  -2.950
  107    HB3  GLN  17           HB3      GLN  17  14.462  14.526  -2.230
  108    HG2  GLN  17           HG2      GLN  17  15.664  15.020  -4.302
  109    HG3  GLN  17           HG3      GLN  17  14.176  15.646  -5.009
  110   HE21  GLN  17          HE21      GLN  17  16.962  16.647  -3.873
  111   HE22  GLN  17          HE22      GLN  17  16.514  18.138  -3.124
  112    H    SER  18           H        SER  18  14.411  12.178  -1.565
  113    HA   SER  18           HA       SER  18  17.058  11.590  -2.080
  114    HB2  SER  18           HB2      SER  18  15.064  10.181  -0.300
  115    HB3  SER  18           HB3      SER  18  16.784   9.794  -0.311
  116    HG   SER  18           HG       SER  18  17.223  11.638   0.661
  117    H    GLY  19           H        GLY  19  14.178   9.755  -2.916
  118    HA2  GLY  19           HA2      GLY  19  14.394   8.463  -5.023
  119    HA3  GLY  19           HA3      GLY  19  15.911   7.857  -4.375
  120    H    ALA  20           H        ALA  20  14.796   7.573  -1.664
  121    HA   ALA  20           HA       ALA  20  13.975   4.896  -1.812
  122    HB1  ALA  20           HB1      ALA  20  13.414   5.151   0.589
  123    HB2  ALA  20           HB2      ALA  20  15.020   5.754   0.178
  124    HB3  ALA  20           HB3      ALA  20  13.692   6.886   0.435
  125    H    TRP  21           H        TRP  21  11.883   4.139  -0.686
  126    HA   TRP  21           HA       TRP  21   9.670   5.338  -2.146
  127    HB2  TRP  21           HB2      TRP  21   8.431   3.324  -1.543
  128    HB3  TRP  21           HB3      TRP  21   9.997   2.895  -2.225
  129    HD1  TRP  21           HD1      TRP  21  11.758   1.716  -0.619
  130    HE1  TRP  21           HE1      TRP  21  11.524   0.583   1.680
  131    HE3  TRP  21           HE3      TRP  21   7.141   3.480   0.689
  132    HZ2  TRP  21           HZ2      TRP  21   9.633   0.454   3.772
  133    HZ3  TRP  21           HZ3      TRP  21   6.191   2.804   2.855
  134    HH2  TRP  21           HH2      TRP  21   7.412   1.322   4.363
  135    H    GLY  22           H        GLY  22   7.494   5.349  -0.953
  136    HA2  GLY  22           HA2      GLY  22   7.286   5.610   1.814
  137    HA3  GLY  22           HA3      GLY  22   7.672   7.202   1.178
  138    H    CYS  23           H        CYS  23   5.319   6.774   2.527
  139    HA   CYS  23           HA       CYS  23   3.265   6.600   0.434
  140    HB2  CYS  23           HB2      CYS  23   3.325   6.022   3.335
  141    HB3  CYS  23           HB3      CYS  23   1.845   6.763   2.734
  142    H    CYS  24           H        CYS  24   2.458   8.417  -0.355
  143    HA   CYS  24           HA       CYS  24   2.533  10.838   1.326
  144    HB2  CYS  24           HB2      CYS  24   2.623  12.094  -0.871
  145    HB3  CYS  24           HB3      CYS  24   4.071  11.181  -0.459
  Start of MODEL   16
    1    H1   CYS   1           H        CYS   1   6.117   0.167  -2.694
    2    HA   CYS   1           HA       CYS   1   4.301  -0.379  -0.444
    3    HB2  CYS   1           HB2      CYS   1   3.549  -0.094  -3.359
    4    HB3  CYS   1           HB3      CYS   1   2.475  -0.729  -2.117
    5    H    ASP   2           H        ASP   2   3.880  -2.490  -0.040
    6    HA   ASP   2           HA       ASP   2   4.120  -4.591  -1.897
    7    HB2  ASP   2           HB2      ASP   2   6.587  -3.792  -1.371
    8    HB3  ASP   2           HB3      ASP   2   6.356  -4.769   0.076
    9    H    MET   3           H        MET   3   4.345  -6.786  -0.631
   10    HA   MET   3           HA       MET   3   2.178  -6.961   1.118
   11    HB2  MET   3           HB2      MET   3   4.490  -8.881   0.792
   12    HB3  MET   3           HB3      MET   3   2.960  -9.257   1.573
   13    HG2  MET   3           HG2      MET   3   1.791  -8.862  -0.538
   14    HG3  MET   3           HG3      MET   3   3.330  -8.505  -1.317
   15    HE1  MET   3           HE1      MET   3   5.207 -10.028  -1.584
   16    HE2  MET   3           HE2      MET   3   5.319 -10.964  -0.094
   17    HE3  MET   3           HE3      MET   3   5.124 -11.788  -1.641
   18    H    GLU   4           H        GLU   4   5.622  -6.609   1.751
   19    HA   GLU   4           HA       GLU   4   5.595  -7.128   4.506
   20    HB2  GLU   4           HB2      GLU   4   7.396  -5.502   2.734
   21    HB3  GLU   4           HB3      GLU   4   7.648  -5.548   4.473
   22    HG2  GLU   4           HG2      GLU   4   7.646  -7.921   2.622
   23    HG3  GLU   4           HG3      GLU   4   9.065  -7.155   3.332
   24    H    VAL   5           H        VAL   5   5.488  -3.991   2.812
   25    HA   VAL   5           HA       VAL   5   4.106  -2.879   5.165
   26    HB   VAL   5           HB       VAL   5   6.397  -2.021   5.094
   27   HG11  VAL   5          HG11      VAL   5   6.155  -2.140   2.378
   28   HG12  VAL   5          HG12      VAL   5   6.026  -0.408   2.681
   29   HG13  VAL   5          HG13      VAL   5   7.439  -1.299   3.246
   30   HG21  VAL   5          HG21      VAL   5   4.010  -0.457   5.066
   31   HG22  VAL   5          HG22      VAL   5   5.504  -0.182   5.962
   32   HG23  VAL   5          HG23      VAL   5   5.316   0.477   4.337
   33    H    SER   6           H        SER   6   2.221  -1.915   4.756
   34    HA   SER   6           HA       SER   6   1.559  -1.317   1.947
   35    HB2  SER   6           HB2      SER   6   0.254  -3.168   3.079
   36    HB3  SER   6           HB3      SER   6  -0.416  -1.937   4.150
   37    HG   SER   6           HG       SER   6  -0.615  -1.949   1.317
   38    H    CYS   7           H        CYS   7  -0.606   0.204   2.114
   39    HA   CYS   7           HA       CYS   7   0.273   2.549   3.667
   40    HB2  CYS   7           HB2      CYS   7   0.228   2.511   1.027
   41    HB3  CYS   7           HB3      CYS   7  -1.490   2.815   1.266
   42    HA   PRO   8           HA       PRO   8  -3.870   1.249   5.314
   43    HB2  PRO   8           HB2      PRO   8  -3.190   1.559   7.924
   44    HB3  PRO   8           HB3      PRO   8  -2.901   0.063   7.026
   45    HG2  PRO   8           HG2      PRO   8  -1.000   2.287   7.665
   46    HG3  PRO   8           HG3      PRO   8  -0.737   0.534   7.737
   47    HD2  PRO   8           HD2      PRO   8   0.132   2.055   5.672
   48    HD3  PRO   8           HD3      PRO   8  -0.382   0.368   5.465
   49    H    ASP   9           H        ASP   9  -1.700   3.908   6.134
   50    HA   ASP   9           HA       ASP   9  -3.410   5.594   7.493
   51    HB2  ASP   9           HB2      ASP   9  -1.104   6.103   5.639
   52    HB3  ASP   9           HB3      ASP   9  -2.023   7.452   6.302
   53    H    GLY  10           H        GLY  10  -3.294   4.856   4.081
   54    HA2  GLY  10           HA2      GLY  10  -5.217   5.092   2.693
   55    HA3  GLY  10           HA3      GLY  10  -5.767   6.401   3.730
   56    H    TYR  11           H        TYR  11  -2.561   5.981   2.298
   57    HA   TYR  11           HA       TYR  11  -3.025   8.455   0.763
   58    HB2  TYR  11           HB2      TYR  11  -0.709   7.560   2.416
   59    HB3  TYR  11           HB3      TYR  11  -0.379   8.524   0.981
   60    HD1  TYR  11           HD1      TYR  11  -2.205  10.594   0.810
   61    HD2  TYR  11           HD2      TYR  11  -0.741   8.774   4.367
   62    HE1  TYR  11           HE1      TYR  11  -2.719  12.646   2.064
   63    HE2  TYR  11           HE2      TYR  11  -1.252  10.821   5.631
   64    HH   TYR  11           HH       TYR  11  -1.575  13.204   5.222
   65    H    THR  12           H        THR  12  -1.206   8.639  -1.008
   66    HA   THR  12           HA       THR  12  -1.470   6.237  -2.639
   67    HB   THR  12           HB       THR  12  -0.153   8.746  -3.613
   68    HG1  THR  12           HG1      THR  12  -2.966   8.338  -3.362
   69   HG21  THR  12          HG21      THR  12  -1.607   6.419  -4.772
   70   HG22  THR  12          HG22      THR  12  -1.692   7.965  -5.616
   71   HG23  THR  12          HG23      THR  12  -0.127   7.209  -5.316
   72    H    CYS  13           H        CYS  13   0.369   5.452  -3.895
   73    HA   CYS  13           HA       CYS  13   2.699   5.166  -2.226
   74    HB2  CYS  13           HB2      CYS  13   1.501   3.443  -3.864
   75    HB3  CYS  13           HB3      CYS  13   2.649   4.118  -5.015
   76    H    CYS  14           H        CYS  14   4.562   6.238  -2.374
   77    HA   CYS  14           HA       CYS  14   5.339   7.513  -4.871
   78    HB2  CYS  14           HB2      CYS  14   4.742   9.016  -2.331
   79    HB3  CYS  14           HB3      CYS  14   5.856   9.653  -3.536
   80    H    ARG  15           H        ARG  15   7.534   8.742  -4.416
   81    HA   ARG  15           HA       ARG  15   9.169   7.059  -2.638
   82    HB2  ARG  15           HB2      ARG  15  10.956   7.069  -4.298
   83    HB3  ARG  15           HB3      ARG  15   9.489   6.375  -4.976
   84    HG2  ARG  15           HG2      ARG  15   9.952   9.274  -5.385
   85    HG3  ARG  15           HG3      ARG  15  10.957   8.140  -6.289
   86    HD2  ARG  15           HD2      ARG  15   9.203   7.349  -7.515
   87    HD3  ARG  15           HD3      ARG  15   8.033   7.642  -6.229
   88    HE   ARG  15           HE       ARG  15   8.860  10.129  -7.077
   89   HH11  ARG  15          HH11      ARG  15   7.315   7.350  -8.495
   90   HH12  ARG  15          HH12      ARG  15   6.431   8.275  -9.663
   91   HH21  ARG  15          HH21      ARG  15   7.702  11.357  -8.611
   92   HH22  ARG  15          HH22      ARG  15   6.653  10.554  -9.729
   93    H    LEU  16           H        LEU  16  10.963   8.049  -1.672
   94    HA   LEU  16           HA       LEU  16  10.805  10.979  -1.608
   95    HB2  LEU  16           HB2      LEU  16  11.673   8.898   0.344
   96    HB3  LEU  16           HB3      LEU  16  12.342  10.524   0.469
   97    HG   LEU  16           HG       LEU  16  10.438  10.157   1.983
   98   HD11  LEU  16          HD11      LEU  16  10.564  12.241  -0.076
   99   HD12  LEU  16          HD12      LEU  16   9.002  12.088   0.730
  100   HD13  LEU  16          HD13      LEU  16  10.460  12.378   1.680
  101   HD21  LEU  16          HD21      LEU  16   9.287   8.585   0.319
  102   HD22  LEU  16          HD22      LEU  16   8.271   9.691   1.244
  103   HD23  LEU  16          HD23      LEU  16   8.666  10.053  -0.436
  104    H    GLN  17           H        GLN  17  12.927  12.108  -1.196
  105    HA   GLN  17           HA       GLN  17  14.652  11.801  -3.326
  106    HB2  GLN  17           HB2      GLN  17  14.379  13.697  -1.496
  107    HB3  GLN  17           HB3      GLN  17  15.748  12.870  -0.765
  108    HG2  GLN  17           HG2      GLN  17  16.420  14.748  -2.193
  109    HG3  GLN  17           HG3      GLN  17  17.071  13.205  -2.745
  110   HE21  GLN  17          HE21      GLN  17  13.870  14.651  -3.170
  111   HE22  GLN  17          HE22      GLN  17  13.907  14.653  -4.897
  112    H    SER  18           H        SER  18  14.947  10.498  -0.048
  113    HA   SER  18           HA       SER  18  17.499   9.452  -0.159
  114    HB2  SER  18           HB2      SER  18  15.089   8.182   1.163
  115    HB3  SER  18           HB3      SER  18  16.777   7.855   1.553
  116    HG   SER  18           HG       SER  18  15.239   9.723   2.571
  117    H    GLY  19           H        GLY  19  14.526   8.191  -1.542
  118    HA2  GLY  19           HA2      GLY  19  14.867   6.912  -3.641
  119    HA3  GLY  19           HA3      GLY  19  16.113   6.024  -2.776
  120    H    ALA  20           H        ALA  20  14.510   5.915  -0.308
  121    HA   ALA  20           HA       ALA  20  13.222   3.450  -0.759
  122    HB1  ALA  20           HB1      ALA  20  12.321   4.867   1.624
  123    HB2  ALA  20           HB2      ALA  20  13.164   3.325   1.471
  124    HB3  ALA  20           HB3      ALA  20  14.076   4.834   1.451
  125    H    TRP  21           H        TRP  21  10.915   3.006  -0.192
  126    HA   TRP  21           HA       TRP  21   9.215   4.842  -1.677
  127    HB2  TRP  21           HB2      TRP  21   8.676   2.082  -0.563
  128    HB3  TRP  21           HB3      TRP  21   7.533   3.018  -1.523
  129    HD1  TRP  21           HD1      TRP  21  11.181   1.735  -1.965
  130    HE1  TRP  21           HE1      TRP  21  11.449   0.963  -4.406
  131    HE3  TRP  21           HE3      TRP  21   6.516   2.900  -3.701
  132    HZ2  TRP  21           HZ2      TRP  21   9.889   0.862  -6.756
  133    HZ3  TRP  21           HZ3      TRP  21   5.985   2.435  -6.058
  134    HH2  TRP  21           HH2      TRP  21   7.638   1.437  -7.553
  135    H    GLY  22           H        GLY  22   7.261   5.698  -0.873
  136    HA2  GLY  22           HA2      GLY  22   6.698   5.420   1.973
  137    HA3  GLY  22           HA3      GLY  22   7.182   7.021   1.433
  138    H    CYS  23           H        CYS  23   4.834   7.003   2.569
  139    HA   CYS  23           HA       CYS  23   2.813   6.727   0.455
  140    HB2  CYS  23           HB2      CYS  23   2.677   6.744   3.452
  141    HB3  CYS  23           HB3      CYS  23   1.252   7.162   2.507
  142    H    CYS  24           H        CYS  24   2.579   8.536  -0.687
  143    HA   CYS  24           HA       CYS  24   2.929  11.133   0.597
  144    HB2  CYS  24           HB2      CYS  24   2.876  12.047  -1.669
  145    HB3  CYS  24           HB3      CYS  24   4.037  10.728  -1.564
  Start of MODEL   17
    1    H1   CYS   1           H        CYS   1   4.326   1.855  -1.398
    2    HA   CYS   1           HA       CYS   1   2.042   0.230  -0.527
    3    HB2  CYS   1           HB2      CYS   1   2.781   1.264  -3.273
    4    HB3  CYS   1           HB3      CYS   1   1.360   0.290  -2.910
    5    H    ASP   2           H        ASP   2   4.540  -0.846  -0.018
    6    HA   ASP   2           HA       ASP   2   4.968  -2.829  -2.137
    7    HB2  ASP   2           HB2      ASP   2   6.844  -1.412  -0.943
    8    HB3  ASP   2           HB3      ASP   2   6.699  -2.655   0.296
    9    H    MET   3           H        MET   3   5.711  -5.046  -1.140
   10    HA   MET   3           HA       MET   3   3.436  -6.181   0.085
   11    HB2  MET   3           HB2      MET   3   4.767  -8.244   0.197
   12    HB3  MET   3           HB3      MET   3   4.890  -7.478  -1.381
   13    HG2  MET   3           HG2      MET   3   7.039  -6.409  -0.448
   14    HG3  MET   3           HG3      MET   3   6.937  -7.661   0.788
   15    HE1  MET   3           HE1      MET   3   9.507  -8.874  -0.211
   16    HE2  MET   3           HE2      MET   3   8.142  -9.452   0.745
   17    HE3  MET   3           HE3      MET   3   8.747 -10.416  -0.603
   18    H    GLU   4           H        GLU   4   6.543  -5.109   1.342
   19    HA   GLU   4           HA       GLU   4   5.969  -6.110   4.000
   20    HB2  GLU   4           HB2      GLU   4   8.292  -5.870   2.804
   21    HB3  GLU   4           HB3      GLU   4   8.207  -4.217   3.395
   22    HG2  GLU   4           HG2      GLU   4   9.459  -5.577   4.934
   23    HG3  GLU   4           HG3      GLU   4   7.949  -5.062   5.683
   24    H    VAL   5           H        VAL   5   6.295  -2.953   2.410
   25    HA   VAL   5           HA       VAL   5   5.217  -1.646   4.800
   26    HB   VAL   5           HB       VAL   5   6.340  -0.378   2.299
   27   HG11  VAL   5          HG11      VAL   5   4.938   0.669   4.600
   28   HG12  VAL   5          HG12      VAL   5   6.546   1.376   4.447
   29   HG13  VAL   5          HG13      VAL   5   5.407   1.476   3.104
   30   HG21  VAL   5          HG21      VAL   5   8.216  -1.354   3.198
   31   HG22  VAL   5          HG22      VAL   5   8.206   0.187   4.055
   32   HG23  VAL   5          HG23      VAL   5   7.603  -1.267   4.850
   33    H    SER   6           H        SER   6   3.055  -1.704   4.845
   34    HA   SER   6           HA       SER   6   1.542  -1.370   2.367
   35    HB2  SER   6           HB2      SER   6   0.696  -2.146   5.165
   36    HB3  SER   6           HB3      SER   6  -0.430  -1.932   3.825
   37    HG   SER   6           HG       SER   6   0.180  -3.783   3.017
   38    H    CYS   7           H        CYS   7  -0.525  -0.024   2.611
   39    HA   CYS   7           HA       CYS   7   0.117   2.480   4.029
   40    HB2  CYS   7           HB2      CYS   7   0.180   2.353   1.394
   41    HB3  CYS   7           HB3      CYS   7  -1.568   2.486   1.558
   42    HA   PRO   8           HA       PRO   8  -3.944   0.832   5.571
   43    HB2  PRO   8           HB2      PRO   8  -3.393   1.271   8.193
   44    HB3  PRO   8           HB3      PRO   8  -2.933  -0.213   7.351
   45    HG2  PRO   8           HG2      PRO   8  -1.273   2.194   7.990
   46    HG3  PRO   8           HG3      PRO   8  -0.851   0.477   8.122
   47    HD2  PRO   8           HD2      PRO   8  -0.050   2.019   6.045
   48    HD3  PRO   8           HD3      PRO   8  -0.396   0.287   5.870
   49    H    ASP   9           H        ASP   9  -2.062   3.700   6.404
   50    HA   ASP   9           HA       ASP   9  -3.982   5.250   7.642
   51    HB2  ASP   9           HB2      ASP   9  -1.493   5.758   7.168
   52    HB3  ASP   9           HB3      ASP   9  -2.067   6.429   5.644
   53    H    GLY  10           H        GLY  10  -3.635   4.452   4.259
   54    HA2  GLY  10           HA2      GLY  10  -5.452   4.496   2.741
   55    HA3  GLY  10           HA3      GLY  10  -6.238   5.697   3.755
   56    H    TYR  11           H        TYR  11  -2.911   5.780   2.578
   57    HA   TYR  11           HA       TYR  11  -3.561   8.289   1.192
   58    HB2  TYR  11           HB2      TYR  11  -1.047   7.245   2.464
   59    HB3  TYR  11           HB3      TYR  11  -0.978   8.529   1.262
   60    HD1  TYR  11           HD1      TYR  11  -3.109   7.754   4.243
   61    HD2  TYR  11           HD2      TYR  11  -0.756  10.629   2.170
   62    HE1  TYR  11           HE1      TYR  11  -3.600   9.410   5.994
   63    HE2  TYR  11           HE2      TYR  11  -1.239  12.292   3.916
   64    HH   TYR  11           HH       TYR  11  -2.541  11.499   6.901
   65    H    THR  12           H        THR  12  -1.843   8.695  -0.652
   66    HA   THR  12           HA       THR  12  -2.200   6.492  -2.524
   67    HB   THR  12           HB       THR  12  -0.926   9.100  -3.272
   68    HG1  THR  12           HG1      THR  12  -3.740   8.758  -3.236
   69   HG21  THR  12          HG21      THR  12  -2.630   7.036  -4.647
   70   HG22  THR  12          HG22      THR  12  -2.354   8.635  -5.337
   71   HG23  THR  12          HG23      THR  12  -0.992   7.552  -5.049
   72    H    CYS  13           H        CYS  13  -0.410   5.948  -4.020
   73    HA   CYS  13           HA       CYS  13   1.980   5.389  -2.513
   74    HB2  CYS  13           HB2      CYS  13   1.417   4.805  -5.426
   75    HB3  CYS  13           HB3      CYS  13   2.653   4.060  -4.418
   76    H    CYS  14           H        CYS  14   3.824   6.497  -2.531
   77    HA   CYS  14           HA       CYS  14   4.414   8.275  -4.783
   78    HB2  CYS  14           HB2      CYS  14   4.742   9.167  -1.917
   79    HB3  CYS  14           HB3      CYS  14   4.932  10.137  -3.374
   80    H    ARG  15           H        ARG  15   6.601   8.625  -5.170
   81    HA   ARG  15           HA       ARG  15   8.370   6.681  -3.892
   82    HB2  ARG  15           HB2      ARG  15   8.249   6.698  -6.348
   83    HB3  ARG  15           HB3      ARG  15   8.783   8.374  -6.363
   84    HG2  ARG  15           HG2      ARG  15  10.504   6.383  -4.994
   85    HG3  ARG  15           HG3      ARG  15  10.451   6.367  -6.758
   86    HD2  ARG  15           HD2      ARG  15  10.793   8.961  -6.451
   87    HD3  ARG  15           HD3      ARG  15  11.464   8.462  -4.899
   88    HE   ARG  15           HE       ARG  15  12.702   6.862  -6.736
   89   HH11  ARG  15          HH11      ARG  15  12.357  10.296  -6.281
   90   HH12  ARG  15          HH12      ARG  15  13.882  10.677  -7.008
   91   HH21  ARG  15          HH21      ARG  15  14.713   7.351  -7.696
   92   HH22  ARG  15          HH22      ARG  15  15.221   9.002  -7.814
   93    H    LEU  16           H        LEU  16  10.000   7.231  -2.577
   94    HA   LEU  16           HA       LEU  16  10.380  10.074  -1.997
   95    HB2  LEU  16           HB2      LEU  16  11.293   7.627  -0.490
   96    HB3  LEU  16           HB3      LEU  16  11.516   9.295   0.034
   97    HG   LEU  16           HG       LEU  16   8.785   8.122  -0.415
   98   HD11  LEU  16          HD11      LEU  16  10.513   7.064   1.399
   99   HD12  LEU  16          HD12      LEU  16   9.733   8.327   2.350
  100   HD13  LEU  16          HD13      LEU  16   8.758   7.082   1.569
  101   HD21  LEU  16          HD21      LEU  16   8.560   9.940   1.554
  102   HD22  LEU  16          HD22      LEU  16   9.918  10.624   0.661
  103   HD23  LEU  16          HD23      LEU  16   8.384  10.328  -0.157
  104    H    GLN  17           H        GLN  17  12.354  11.090  -2.108
  105    HA   GLN  17           HA       GLN  17  14.140  10.370  -4.089
  106    HB2  GLN  17           HB2      GLN  17  13.855  12.624  -2.898
  107    HB3  GLN  17           HB3      GLN  17  14.960  11.989  -1.687
  108    HG2  GLN  17           HG2      GLN  17  16.745  11.908  -3.179
  109    HG3  GLN  17           HG3      GLN  17  15.691  12.005  -4.588
  110   HE21  GLN  17          HE21      GLN  17  18.006  13.645  -3.483
  111   HE22  GLN  17          HE22      GLN  17  17.433  15.272  -3.567
  112    H    SER  18           H        SER  18  14.211   9.617  -0.651
  113    HA   SER  18           HA       SER  18  16.786   8.659  -0.373
  114    HB2  SER  18           HB2      SER  18  15.422   8.841   1.575
  115    HB3  SER  18           HB3      SER  18  14.206   7.751   0.910
  116    HG   SER  18           HG       SER  18  15.513   6.664   2.405
  117    H    GLY  19           H        GLY  19  13.975   7.091  -1.792
  118    HA2  GLY  19           HA2      GLY  19  14.396   5.520  -3.613
  119    HA3  GLY  19           HA3      GLY  19  15.757   4.911  -2.683
  120    H    ALA  20           H        ALA  20  12.419   5.605  -1.686
  121    HA   ALA  20           HA       ALA  20  11.963   2.744  -1.275
  122    HB1  ALA  20           HB1      ALA  20  11.272   4.658   0.925
  123    HB2  ALA  20           HB2      ALA  20  11.426   2.902   0.984
  124    HB3  ALA  20           HB3      ALA  20  12.866   3.908   0.835
  125    H    TRP  21           H        TRP  21   9.644   2.318  -0.660
  126    HA   TRP  21           HA       TRP  21   7.933   4.007  -2.319
  127    HB2  TRP  21           HB2      TRP  21   7.556   1.243  -1.158
  128    HB3  TRP  21           HB3      TRP  21   6.293   2.105  -2.031
  129    HD1  TRP  21           HD1      TRP  21   8.779  -0.427  -2.642
  130    HE1  TRP  21           HE1      TRP  21   9.401  -0.587  -5.134
  131    HE3  TRP  21           HE3      TRP  21   6.808   4.005  -4.256
  132    HZ2  TRP  21           HZ2      TRP  21   9.096   0.961  -7.475
  133    HZ3  TRP  21           HZ3      TRP  21   7.016   4.591  -6.636
  134    HH2  TRP  21           HH2      TRP  21   8.137   3.100  -8.211
  135    H    GLY  22           H        GLY  22   7.418   5.756  -1.050
  136    HA2  GLY  22           HA2      GLY  22   6.190   5.209   1.569
  137    HA3  GLY  22           HA3      GLY  22   6.834   6.760   1.050
  138    H    CYS  23           H        CYS  23   4.456   6.921   2.145
  139    HA   CYS  23           HA       CYS  23   2.575   7.111  -0.117
  140    HB2  CYS  23           HB2      CYS  23   2.192   6.220   2.701
  141    HB3  CYS  23           HB3      CYS  23   0.878   7.108   1.938
  142    H    CYS  24           H        CYS  24   1.507   9.009  -0.437
  143    HA   CYS  24           HA       CYS  24   1.744  11.139   1.543
  144    HB2  CYS  24           HB2      CYS  24   2.715  12.722   0.057
  145    HB3  CYS  24           HB3      CYS  24   3.709  11.273  -0.051
  Start of MODEL   18
    1    H1   CYS   1           H        CYS   1   8.690  -0.384  -0.507
    2    HA   CYS   1           HA       CYS   1   6.151  -0.074  -1.168
    3    HB2  CYS   1           HB2      CYS   1   8.205   1.096  -2.172
    4    HB3  CYS   1           HB3      CYS   1   8.160  -0.153  -3.413
    5    H    ASP   2           H        ASP   2   5.055  -2.082  -0.959
    6    HA   ASP   2           HA       ASP   2   4.514  -3.344  -3.455
    7    HB2  ASP   2           HB2      ASP   2   6.335  -4.678  -1.526
    8    HB3  ASP   2           HB3      ASP   2   5.087  -5.682  -2.259
    9    H    MET   3           H        MET   3   3.109  -5.456  -2.931
   10    HA   MET   3           HA       MET   3   0.757  -4.599  -1.770
   11    HB2  MET   3           HB2      MET   3   0.072  -6.964  -1.751
   12    HB3  MET   3           HB3      MET   3   0.852  -6.520  -3.263
   13    HG2  MET   3           HG2      MET   3   2.964  -7.504  -2.370
   14    HG3  MET   3           HG3      MET   3   2.037  -8.092  -0.992
   15    HE1  MET   3           HE1      MET   3   0.636  -8.580  -5.077
   16    HE2  MET   3           HE2      MET   3   2.095  -7.689  -4.645
   17    HE3  MET   3           HE3      MET   3   2.218  -9.339  -5.256
   18    H    GLU   4           H        GLU   4   3.441  -6.354  -0.296
   19    HA   GLU   4           HA       GLU   4   2.091  -6.608   2.241
   20    HB2  GLU   4           HB2      GLU   4   3.855  -8.204   1.243
   21    HB3  GLU   4           HB3      GLU   4   5.035  -7.021   1.788
   22    HG2  GLU   4           HG2      GLU   4   5.013  -8.434   3.573
   23    HG3  GLU   4           HG3      GLU   4   3.779  -7.278   4.072
   24    H    VAL   5           H        VAL   5   4.530  -4.528   0.800
   25    HA   VAL   5           HA       VAL   5   4.897  -3.084   3.309
   26    HB   VAL   5           HB       VAL   5   6.208  -2.663   0.619
   27   HG11  VAL   5          HG11      VAL   5   6.811  -0.684   1.443
   28   HG12  VAL   5          HG12      VAL   5   6.162  -1.072   3.036
   29   HG13  VAL   5          HG13      VAL   5   7.800  -1.564   2.608
   30   HG21  VAL   5          HG21      VAL   5   7.712  -4.214   1.165
   31   HG22  VAL   5          HG22      VAL   5   7.906  -3.554   2.789
   32   HG23  VAL   5          HG23      VAL   5   6.612  -4.704   2.453
   33    H    SER   6           H        SER   6   2.908  -2.057   3.566
   34    HA   SER   6           HA       SER   6   2.322   0.040   1.579
   35    HB2  SER   6           HB2      SER   6   0.403  -1.515   3.328
   36    HB3  SER   6           HB3      SER   6  -0.054  -0.110   2.365
   37    HG   SER   6           HG       SER   6  -0.482  -1.973   1.193
   38    H    CYS   7           H        CYS   7   0.642   1.646   2.854
   39    HA   CYS   7           HA       CYS   7   2.302   2.773   4.969
   40    HB2  CYS   7           HB2      CYS   7   0.191   3.822   3.142
   41    HB3  CYS   7           HB3      CYS   7   0.430   4.638   4.684
   42    HA   PRO   8           HA       PRO   8  -0.319   1.771   8.340
   43    HB2  PRO   8           HB2      PRO   8  -0.259   4.042   9.826
   44    HB3  PRO   8           HB3      PRO   8   1.122   2.947   9.689
   45    HG2  PRO   8           HG2      PRO   8   0.588   5.514   8.243
   46    HG3  PRO   8           HG3      PRO   8   2.100   4.927   8.960
   47    HD2  PRO   8           HD2      PRO   8   1.591   4.772   6.305
   48    HD3  PRO   8           HD3      PRO   8   2.572   3.566   7.161
   49    H    ASP   9           H        ASP   9  -0.986   5.078   7.176
   50    HA   ASP   9           HA       ASP   9  -3.688   5.071   8.070
   51    HB2  ASP   9           HB2      ASP   9  -2.138   6.844   6.188
   52    HB3  ASP   9           HB3      ASP   9  -3.852   7.095   6.507
   53    H    GLY  10           H        GLY  10  -2.087   4.126   5.113
   54    HA2  GLY  10           HA2      GLY  10  -3.179   2.446   3.739
   55    HA3  GLY  10           HA3      GLY  10  -4.705   3.254   4.066
   56    H    TYR  11           H        TYR  11  -1.693   4.864   3.214
   57    HA   TYR  11           HA       TYR  11  -3.037   6.049   0.913
   58    HB2  TYR  11           HB2      TYR  11  -0.637   6.738   2.550
   59    HB3  TYR  11           HB3      TYR  11  -0.714   7.326   0.893
   60    HD1  TYR  11           HD1      TYR  11  -1.065   9.623   1.125
   61    HD2  TYR  11           HD2      TYR  11  -3.479   6.918   3.352
   62    HE1  TYR  11           HE1      TYR  11  -2.481  11.497   1.854
   63    HE2  TYR  11           HE2      TYR  11  -4.902   8.785   4.087
   64    HH   TYR  11           HH       TYR  11  -4.691  11.257   4.377
   65    H    THR  12           H        THR  12  -1.290   6.555  -0.930
   66    HA   THR  12           HA       THR  12  -0.506   3.932  -1.915
   67    HB   THR  12           HB       THR  12  -0.013   5.189  -4.047
   68    HG1  THR  12           HG1      THR  12  -1.388   7.332  -2.783
   69   HG21  THR  12          HG21      THR  12  -2.217   4.060  -3.440
   70   HG22  THR  12          HG22      THR  12  -2.821   5.678  -3.081
   71   HG23  THR  12          HG23      THR  12  -2.276   5.282  -4.711
   72    H    CYS  13           H        CYS  13   1.580   3.508  -2.809
   73    HA   CYS  13           HA       CYS  13   3.709   4.638  -1.232
   74    HB2  CYS  13           HB2      CYS  13   3.613   2.221  -1.761
   75    HB3  CYS  13           HB3      CYS  13   3.832   2.601  -3.466
   76    H    CYS  14           H        CYS  14   5.330   5.970  -1.884
   77    HA   CYS  14           HA       CYS  14   5.278   6.900  -4.677
   78    HB2  CYS  14           HB2      CYS  14   4.897   8.427  -2.213
   79    HB3  CYS  14           HB3      CYS  14   6.174   9.081  -3.233
   80    H    ARG  15           H        ARG  15   7.363   8.411  -4.951
   81    HA   ARG  15           HA       ARG  15   9.641   6.853  -3.915
   82    HB2  ARG  15           HB2      ARG  15  10.789   7.627  -6.067
   83    HB3  ARG  15           HB3      ARG  15   9.556   6.382  -6.216
   84    HG2  ARG  15           HG2      ARG  15   7.976   7.918  -7.077
   85    HG3  ARG  15           HG3      ARG  15   8.988   9.300  -6.650
   86    HD2  ARG  15           HD2      ARG  15   9.442   9.132  -8.888
   87    HD3  ARG  15           HD3      ARG  15  10.718   8.110  -8.227
   88    HE   ARG  15           HE       ARG  15   8.488   6.506  -8.746
   89   HH11  ARG  15          HH11      ARG  15  10.862   8.379 -10.470
   90   HH12  ARG  15          HH12      ARG  15  10.801   7.390 -11.891
   91   HH21  ARG  15          HH21      ARG  15   8.398   5.196 -10.612
   92   HH22  ARG  15          HH22      ARG  15   9.398   5.581 -11.971
   93    H    LEU  16           H        LEU  16  10.791   7.984  -2.505
   94    HA   LEU  16           HA       LEU  16  10.739  10.892  -2.564
   95    HB2  LEU  16           HB2      LEU  16  11.559   8.816  -0.600
   96    HB3  LEU  16           HB3      LEU  16  12.288  10.416  -0.477
   97    HG   LEU  16           HG       LEU  16  10.391  10.185   1.034
   98   HD11  LEU  16          HD11      LEU  16  10.942  12.362  -0.090
   99   HD12  LEU  16          HD12      LEU  16   9.638  12.021  -1.228
  100   HD13  LEU  16          HD13      LEU  16   9.283  12.210   0.490
  101   HD21  LEU  16          HD21      LEU  16   9.244   8.584  -0.736
  102   HD22  LEU  16          HD22      LEU  16   8.299   9.508   0.432
  103   HD23  LEU  16          HD23      LEU  16   8.465  10.089  -1.225
  104    H    GLN  17           H        GLN  17  12.528  12.201  -2.830
  105    HA   GLN  17           HA       GLN  17  14.457  11.472  -4.663
  106    HB2  GLN  17           HB2      GLN  17  13.748  13.810  -3.668
  107    HB3  GLN  17           HB3      GLN  17  15.128  13.539  -2.612
  108    HG2  GLN  17           HG2      GLN  17  16.645  13.702  -4.318
  109    HG3  GLN  17           HG3      GLN  17  15.481  13.204  -5.546
  110   HE21  GLN  17          HE21      GLN  17  17.184  15.752  -4.347
  111   HE22  GLN  17          HE22      GLN  17  16.229  17.052  -4.965
  112    H    SER  18           H        SER  18  14.673  11.481  -1.128
  113    HA   SER  18           HA       SER  18  17.363  10.874  -0.835
  114    HB2  SER  18           HB2      SER  18  16.571   9.709   1.325
  115    HB3  SER  18           HB3      SER  18  16.201  11.423   1.138
  116    HG   SER  18           HG       SER  18  14.506   9.487   1.596
  117    H    GLY  19           H        GLY  19  14.644   8.765  -1.564
  118    HA2  GLY  19           HA2      GLY  19  15.121   6.816  -2.962
  119    HA3  GLY  19           HA3      GLY  19  16.579   6.578  -2.010
  120    H    ALA  20           H        ALA  20  13.196   7.181  -1.080
  121    HA   ALA  20           HA       ALA  20  13.088   4.531   0.152
  122    HB1  ALA  20           HB1      ALA  20  12.136   5.533   2.236
  123    HB2  ALA  20           HB2      ALA  20  13.846   5.873   1.972
  124    HB3  ALA  20           HB3      ALA  20  12.638   7.113   1.635
  125    H    TRP  21           H        TRP  21  10.737   4.463   1.314
  126    HA   TRP  21           HA       TRP  21   8.857   5.212  -0.820
  127    HB2  TRP  21           HB2      TRP  21   7.436   3.383   0.017
  128    HB3  TRP  21           HB3      TRP  21   9.037   2.805  -0.436
  129    HD1  TRP  21           HD1      TRP  21  10.698   2.099   1.588
  130    HE1  TRP  21           HE1      TRP  21  10.188   1.302   3.982
  131    HE3  TRP  21           HE3      TRP  21   5.840   3.650   1.942
  132    HZ2  TRP  21           HZ2      TRP  21   8.013   1.326   5.781
  133    HZ3  TRP  21           HZ3      TRP  21   4.615   3.223   4.033
  134    HH2  TRP  21           HH2      TRP  21   5.681   2.085   5.911
  135    H    GLY  22           H        GLY  22   7.188   6.540  -0.410
  136    HA2  GLY  22           HA2      GLY  22   6.614   7.187   2.414
  137    HA3  GLY  22           HA3      GLY  22   6.779   8.447   1.200
  138    H    CYS  23           H        CYS  23   4.516   8.484   2.589
  139    HA   CYS  23           HA       CYS  23   2.468   6.980   1.172
  140    HB2  CYS  23           HB2      CYS  23   2.218   8.972   3.436
  141    HB3  CYS  23           HB3      CYS  23   0.916   7.973   2.800
  142    H    CYS  24           H        CYS  24   1.119   7.788  -0.330
  143    HA   CYS  24           HA       CYS  24   1.165  10.686  -0.830
  144    HB2  CYS  24           HB2      CYS  24   1.818   8.464  -2.693
  145    HB3  CYS  24           HB3      CYS  24   0.865   9.795  -3.341
  Start of MODEL   19
    1    H1   CYS   1           H        CYS   1   6.855   2.532  -0.181
    2    HA   CYS   1           HA       CYS   1   4.754   0.924   0.847
    3    HB2  CYS   1           HB2      CYS   1   4.576   2.965  -0.696
    4    HB3  CYS   1           HB3      CYS   1   4.972   1.861  -2.009
    5    H    ASP   2           H        ASP   2   3.772  -0.921  -0.205
    6    HA   ASP   2           HA       ASP   2   5.073  -2.409  -2.222
    7    HB2  ASP   2           HB2      ASP   2   6.642  -2.670  -0.202
    8    HB3  ASP   2           HB3      ASP   2   5.370  -3.667   0.498
    9    H    MET   3           H        MET   3   4.152  -4.685  -2.358
   10    HA   MET   3           HA       MET   3   1.350  -4.553  -2.321
   11    HB2  MET   3           HB2      MET   3   3.374  -6.656  -2.860
   12    HB3  MET   3           HB3      MET   3   1.743  -7.202  -2.498
   13    HG2  MET   3           HG2      MET   3   0.980  -5.565  -4.296
   14    HG3  MET   3           HG3      MET   3   2.677  -5.482  -4.765
   15    HE1  MET   3           HE1      MET   3   3.548  -9.086  -5.645
   16    HE2  MET   3           HE2      MET   3   3.969  -7.803  -4.511
   17    HE3  MET   3           HE3      MET   3   2.977  -9.160  -3.978
   18    H    GLU   4           H        GLU   4   3.639  -6.122  -0.119
   19    HA   GLU   4           HA       GLU   4   1.448  -6.951   1.621
   20    HB2  GLU   4           HB2      GLU   4   3.385  -8.476   1.066
   21    HB3  GLU   4           HB3      GLU   4   4.404  -7.410   2.023
   22    HG2  GLU   4           HG2      GLU   4   3.053  -7.865   3.995
   23    HG3  GLU   4           HG3      GLU   4   2.004  -8.913   3.042
   24    H    VAL   5           H        VAL   5   4.261  -4.820   1.615
   25    HA   VAL   5           HA       VAL   5   3.649  -3.862   4.295
   26    HB   VAL   5           HB       VAL   5   5.817  -2.928   2.410
   27   HG11  VAL   5          HG11      VAL   5   5.515  -2.588   5.393
   28   HG12  VAL   5          HG12      VAL   5   6.850  -1.998   4.403
   29   HG13  VAL   5          HG13      VAL   5   5.231  -1.335   4.185
   30   HG21  VAL   5          HG21      VAL   5   6.448  -5.110   2.757
   31   HG22  VAL   5          HG22      VAL   5   7.209  -4.325   4.141
   32   HG23  VAL   5          HG23      VAL   5   5.687  -5.193   4.346
   33    H    SER   6           H        SER   6   2.347  -2.202   4.660
   34    HA   SER   6           HA       SER   6   2.207  -0.014   2.728
   35    HB2  SER   6           HB2      SER   6  -0.330  -1.195   3.851
   36    HB3  SER   6           HB3      SER   6  -0.152  -0.044   2.527
   37    HG   SER   6           HG       SER   6   0.638  -1.658   1.237
   38    H    CYS   7           H        CYS   7   0.771   1.799   3.670
   39    HA   CYS   7           HA       CYS   7   1.708   2.273   6.385
   40    HB2  CYS   7           HB2      CYS   7   0.696   3.974   4.155
   41    HB3  CYS   7           HB3      CYS   7   0.507   4.573   5.800
   42    HA   PRO   8           HA       PRO   8  -2.117   1.711   8.456
   43    HB2  PRO   8           HB2      PRO   8  -2.130   3.763  10.233
   44    HB3  PRO   8           HB3      PRO   8  -1.060   2.365  10.388
   45    HG2  PRO   8           HG2      PRO   8  -0.470   5.090   9.299
   46    HG3  PRO   8           HG3      PRO   8   0.511   4.079  10.375
   47    HD2  PRO   8           HD2      PRO   8   0.994   4.275   7.718
   48    HD3  PRO   8           HD3      PRO   8   1.314   2.791   8.640
   49    H    ASP   9           H        ASP   9  -1.590   5.155   7.686
   50    HA   ASP   9           HA       ASP   9  -4.210   6.023   7.767
   51    HB2  ASP   9           HB2      ASP   9  -1.863   6.902   6.098
   52    HB3  ASP   9           HB3      ASP   9  -3.426   7.705   5.981
   53    H    GLY  10           H        GLY  10  -2.572   4.168   5.302
   54    HA2  GLY  10           HA2      GLY  10  -3.618   2.814   3.704
   55    HA3  GLY  10           HA3      GLY  10  -5.132   3.648   4.021
   56    H    TYR  11           H        TYR  11  -2.009   5.082   3.184
   57    HA   TYR  11           HA       TYR  11  -3.290   6.495   0.988
   58    HB2  TYR  11           HB2      TYR  11  -0.863   6.864   2.627
   59    HB3  TYR  11           HB3      TYR  11  -0.710   7.347   0.941
   60    HD1  TYR  11           HD1      TYR  11  -3.120   8.588   0.189
   61    HD2  TYR  11           HD2      TYR  11  -1.231   8.672   4.001
   62    HE1  TYR  11           HE1      TYR  11  -4.244  10.717   0.693
   63    HE2  TYR  11           HE2      TYR  11  -2.351  10.800   4.516
   64    HH   TYR  11           HH       TYR  11  -3.692  12.752   2.306
   65    H    THR  12           H        THR  12  -1.600   6.856  -0.934
   66    HA   THR  12           HA       THR  12  -1.200   4.200  -2.054
   67    HB   THR  12           HB       THR  12  -2.342   5.984  -3.376
   68    HG1  THR  12           HG1      THR  12  -1.432   5.256  -5.223
   69   HG21  THR  12          HG21      THR  12  -1.441   8.003  -3.672
   70   HG22  THR  12          HG22      THR  12  -0.156   7.535  -2.558
   71   HG23  THR  12          HG23      THR  12   0.053   7.299  -4.293
   72    H    CYS  13           H        CYS  13   0.797   4.042  -3.572
   73    HA   CYS  13           HA       CYS  13   3.118   4.344  -1.892
   74    HB2  CYS  13           HB2      CYS  13   3.018   3.332  -4.737
   75    HB3  CYS  13           HB3      CYS  13   4.274   3.033  -3.540
   76    H    CYS  14           H        CYS  14   4.634   5.876  -1.995
   77    HA   CYS  14           HA       CYS  14   4.635   7.675  -4.329
   78    HB2  CYS  14           HB2      CYS  14   3.858   8.416  -1.823
   79    HB3  CYS  14           HB3      CYS  14   5.575   8.805  -1.774
   80    H    ARG  15           H        ARG  15   6.778   9.093  -4.161
   81    HA   ARG  15           HA       ARG  15   9.019   7.274  -3.586
   82    HB2  ARG  15           HB2      ARG  15   8.356   8.737  -6.096
   83    HB3  ARG  15           HB3      ARG  15  10.051   8.589  -5.652
   84    HG2  ARG  15           HG2      ARG  15   9.681   6.110  -5.476
   85    HG3  ARG  15           HG3      ARG  15   8.091   6.377  -6.193
   86    HD2  ARG  15           HD2      ARG  15   8.970   6.994  -8.236
   87    HD3  ARG  15           HD3      ARG  15  10.515   7.481  -7.539
   88    HE   ARG  15           HE       ARG  15  11.263   5.332  -7.785
   89   HH11  ARG  15          HH11      ARG  15   7.797   5.379  -8.108
   90   HH12  ARG  15          HH12      ARG  15   7.692   3.725  -8.615
   91   HH21  ARG  15          HH21      ARG  15  11.137   3.154  -8.452
   92   HH22  ARG  15          HH22      ARG  15   9.592   2.461  -8.809
   93    H    LEU  16           H        LEU  16  10.649   8.139  -2.454
   94    HA   LEU  16           HA       LEU  16  10.443  10.934  -1.675
   95    HB2  LEU  16           HB2      LEU  16  11.777   8.515  -0.617
   96    HB3  LEU  16           HB3      LEU  16  12.566  10.058  -0.297
   97    HG   LEU  16           HG       LEU  16  10.073  10.662   0.497
   98   HD11  LEU  16          HD11      LEU  16   8.758   8.918   0.865
   99   HD12  LEU  16          HD12      LEU  16   9.962   7.879   0.102
  100   HD13  LEU  16          HD13      LEU  16  10.002   8.143   1.846
  101   HD21  LEU  16          HD21      LEU  16  10.846  10.326   2.755
  102   HD22  LEU  16          HD22      LEU  16  12.079   9.193   2.203
  103   HD23  LEU  16          HD23      LEU  16  12.187  10.897   1.762
  104    H    GLN  17           H        GLN  17  11.919  12.501  -2.131
  105    HA   GLN  17           HA       GLN  17  13.389  12.417  -4.465
  106    HB2  GLN  17           HB2      GLN  17  12.708  14.410  -2.900
  107    HB3  GLN  17           HB3      GLN  17  14.305  14.156  -2.207
  108    HG2  GLN  17           HG2      GLN  17  15.280  14.431  -4.463
  109    HG3  GLN  17           HG3      GLN  17  13.669  14.807  -5.075
  110   HE21  GLN  17          HE21      GLN  17  14.100  16.878  -5.687
  111   HE22  GLN  17          HE22      GLN  17  14.459  18.148  -4.573
  112    H    SER  18           H        SER  18  14.566  11.984  -1.137
  113    HA   SER  18           HA       SER  18  17.265  11.669  -1.669
  114    HB2  SER  18           HB2      SER  18  17.255  10.209   0.428
  115    HB3  SER  18           HB3      SER  18  16.602  11.838   0.604
  116    HG   SER  18           HG       SER  18  15.374   9.866   1.433
  117    H    GLY  19           H        GLY  19  14.639   9.346  -1.956
  118    HA2  GLY  19           HA2      GLY  19  14.955   7.689  -3.772
  119    HA3  GLY  19           HA3      GLY  19  16.570   7.437  -3.125
  120    H    ALA  20           H        ALA  20  13.684   7.827  -1.162
  121    HA   ALA  20           HA       ALA  20  13.980   5.020  -0.309
  122    HB1  ALA  20           HB1      ALA  20  12.970   5.792   1.854
  123    HB2  ALA  20           HB2      ALA  20  14.573   6.439   1.506
  124    HB3  ALA  20           HB3      ALA  20  13.144   7.446   1.267
  125    H    TRP  21           H        TRP  21  11.859   4.241   0.798
  126    HA   TRP  21           HA       TRP  21   9.692   4.756  -1.112
  127    HB2  TRP  21           HB2      TRP  21   9.980   2.465   0.842
  128    HB3  TRP  21           HB3      TRP  21   8.786   2.606  -0.446
  129    HD1  TRP  21           HD1      TRP  21  12.097   1.145   0.253
  130    HE1  TRP  21           HE1      TRP  21  13.204   0.320  -1.920
  131    HE3  TRP  21           HE3      TRP  21   9.020   3.417  -3.138
  132    HZ2  TRP  21           HZ2      TRP  21  12.823   0.597  -4.703
  133    HZ3  TRP  21           HZ3      TRP  21   9.460   3.087  -5.537
  134    HH2  TRP  21           HH2      TRP  21  11.323   1.707  -6.301
  135    H    GLY  22           H        GLY  22   7.669   5.392  -0.477
  136    HA2  GLY  22           HA2      GLY  22   7.047   5.597   2.362
  137    HA3  GLY  22           HA3      GLY  22   7.178   7.117   1.489
  138    H    CYS  23           H        CYS  23   4.880   7.144   2.386
  139    HA   CYS  23           HA       CYS  23   3.089   6.034   0.329
  140    HB2  CYS  23           HB2      CYS  23   1.347   5.902   2.180
  141    HB3  CYS  23           HB3      CYS  23   2.639   4.708   2.241
  142    H    CYS  24           H        CYS  24   2.082   7.579  -0.756
  143    HA   CYS  24           HA       CYS  24   1.938  10.268   0.373
  144    HB2  CYS  24           HB2      CYS  24   2.006   9.116  -2.332
  145    HB3  CYS  24           HB3      CYS  24   0.889  10.464  -2.149
  Start of MODEL   20
    1    H1   CYS   1           H        CYS   1   5.685   1.613  -0.696
    2    HA   CYS   1           HA       CYS   1   3.270   0.051  -0.677
    3    HB2  CYS   1           HB2      CYS   1   5.111   1.084  -2.811
    4    HB3  CYS   1           HB3      CYS   1   3.895  -0.127  -3.205
    5    H    ASP   2           H        ASP   2   4.607  -1.498   0.822
    6    HA   ASP   2           HA       ASP   2   5.710  -3.624  -0.895
    7    HB2  ASP   2           HB2      ASP   2   6.497  -3.085   1.974
    8    HB3  ASP   2           HB3      ASP   2   7.218  -4.261   0.878
    9    H    MET   3           H        MET   3   5.625  -5.814   0.291
   10    HA   MET   3           HA       MET   3   2.917  -6.441   0.763
   11    HB2  MET   3           HB2      MET   3   5.350  -8.093   1.458
   12    HB3  MET   3           HB3      MET   3   3.706  -8.687   1.271
   13    HG2  MET   3           HG2      MET   3   3.733  -8.391  -1.040
   14    HG3  MET   3           HG3      MET   3   5.122  -7.308  -0.976
   15    HE1  MET   3           HE1      MET   3   5.268 -11.653   0.232
   16    HE2  MET   3           HE2      MET   3   3.863 -10.590   0.156
   17    HE3  MET   3           HE3      MET   3   4.381 -11.471  -1.281
   18    H    GLU   4           H        GLU   4   5.697  -6.204   2.967
   19    HA   GLU   4           HA       GLU   4   4.199  -6.812   5.305
   20    HB2  GLU   4           HB2      GLU   4   6.855  -5.402   5.002
   21    HB3  GLU   4           HB3      GLU   4   6.190  -5.983   6.522
   22    HG2  GLU   4           HG2      GLU   4   6.244  -8.274   5.664
   23    HG3  GLU   4           HG3      GLU   4   6.933  -7.684   4.152
   24    H    VAL   5           H        VAL   5   5.637  -3.734   4.211
   25    HA   VAL   5           HA       VAL   5   3.891  -2.267   6.019
   26    HB   VAL   5           HB       VAL   5   5.945  -1.144   4.113
   27   HG11  VAL   5          HG11      VAL   5   5.276   0.844   4.836
   28   HG12  VAL   5          HG12      VAL   5   4.003   0.063   5.774
   29   HG13  VAL   5          HG13      VAL   5   5.579   0.362   6.505
   30   HG21  VAL   5          HG21      VAL   5   6.278  -1.911   7.013
   31   HG22  VAL   5          HG22      VAL   5   6.996  -2.744   5.634
   32   HG23  VAL   5          HG23      VAL   5   7.479  -1.091   6.015
   33    H    SER   6           H        SER   6   1.949  -1.623   5.391
   34    HA   SER   6           HA       SER   6   1.496  -1.091   2.527
   35    HB2  SER   6           HB2      SER   6   0.232  -3.018   3.704
   36    HB3  SER   6           HB3      SER   6  -0.700  -1.739   4.482
   37    HG   SER   6           HG       SER   6  -0.364  -1.895   1.676
   38    H    CYS   7           H        CYS   7  -0.653   0.342   2.368
   39    HA   CYS   7           HA       CYS   7  -0.231   2.665   4.132
   40    HB2  CYS   7           HB2      CYS   7  -1.067   2.685   1.224
   41    HB3  CYS   7           HB3      CYS   7  -0.840   4.103   2.244
   42    HA   PRO   8           HA       PRO   8  -4.602   1.177   4.628
   43    HB2  PRO   8           HB2      PRO   8  -4.613   1.386   7.334
   44    HB3  PRO   8           HB3      PRO   8  -4.051  -0.058   6.485
   45    HG2  PRO   8           HG2      PRO   8  -2.459   2.186   7.666
   46    HG3  PRO   8           HG3      PRO   8  -2.155   0.440   7.737
   47    HD2  PRO   8           HD2      PRO   8  -0.853   2.076   6.017
   48    HD3  PRO   8           HD3      PRO   8  -1.233   0.387   5.625
   49    H    ASP   9           H        ASP   9  -2.814   3.852   6.077
   50    HA   ASP   9           HA       ASP   9  -4.879   5.426   7.012
   51    HB2  ASP   9           HB2      ASP   9  -2.393   6.426   5.609
   52    HB3  ASP   9           HB3      ASP   9  -3.388   7.329   6.748
   53    H    GLY  10           H        GLY  10  -3.857   4.855   3.721
   54    HA2  GLY  10           HA2      GLY  10  -5.484   5.091   1.950
   55    HA3  GLY  10           HA3      GLY  10  -6.148   6.472   2.811
   56    H    TYR  11           H        TYR  11  -2.744   5.789   2.148
   57    HA   TYR  11           HA       TYR  11  -2.597   8.354   0.728
   58    HB2  TYR  11           HB2      TYR  11  -0.611   6.731   2.280
   59    HB3  TYR  11           HB3      TYR  11  -0.047   7.887   1.078
   60    HD1  TYR  11           HD1      TYR  11  -1.712  10.181   1.348
   61    HD2  TYR  11           HD2      TYR  11  -0.295   7.577   4.400
   62    HE1  TYR  11           HE1      TYR  11  -1.928  11.999   2.991
   63    HE2  TYR  11           HE2      TYR  11  -0.508   9.387   6.052
   64    HH   TYR  11           HH       TYR  11  -0.476  12.131   5.788
   65    H    THR  12           H        THR  12  -1.195   8.506  -1.153
   66    HA   THR  12           HA       THR  12  -1.532   6.189  -2.882
   67    HB   THR  12           HB       THR  12  -0.500   7.897  -4.590
   68    HG1  THR  12           HG1      THR  12  -0.069   9.376  -2.712
   69   HG21  THR  12          HG21      THR  12  -3.067   9.015  -4.077
   70   HG22  THR  12          HG22      THR  12  -2.607   7.837  -5.307
   71   HG23  THR  12          HG23      THR  12  -3.133   7.290  -3.715
   72    H    CYS  13           H        CYS  13   0.267   5.656  -4.417
   73    HA   CYS  13           HA       CYS  13   2.661   5.141  -2.901
   74    HB2  CYS  13           HB2      CYS  13   1.406   3.688  -4.752
   75    HB3  CYS  13           HB3      CYS  13   2.522   4.539  -5.814
   76    H    CYS  14           H        CYS  14   4.434   6.347  -2.869
   77    HA   CYS  14           HA       CYS  14   4.977   8.136  -5.140
   78    HB2  CYS  14           HB2      CYS  14   5.466   8.910  -2.263
   79    HB3  CYS  14           HB3      CYS  14   5.577   9.937  -3.688
   80    H    ARG  15           H        ARG  15   7.324   9.127  -4.711
   81    HA   ARG  15           HA       ARG  15   9.085   6.890  -3.954
   82    HB2  ARG  15           HB2      ARG  15  10.632   7.803  -5.776
   83    HB3  ARG  15           HB3      ARG  15   9.206   6.918  -6.301
   84    HG2  ARG  15           HG2      ARG  15   8.923   9.847  -6.037
   85    HG3  ARG  15           HG3      ARG  15   9.943   9.255  -7.351
   86    HD2  ARG  15           HD2      ARG  15   7.881   7.631  -7.717
   87    HD3  ARG  15           HD3      ARG  15   7.019   8.945  -6.916
   88    HE   ARG  15           HE       ARG  15   8.152   8.966  -9.566
   89   HH11  ARG  15          HH11      ARG  15   7.057  10.895  -6.882
   90   HH12  ARG  15          HH12      ARG  15   6.756  12.301  -7.848
   91   HH21  ARG  15          HH21      ARG  15   7.760  10.811 -10.847
   92   HH22  ARG  15          HH22      ARG  15   7.155  12.252 -10.103
   93    H    LEU  16           H        LEU  16  10.721   7.365  -2.612
   94    HA   LEU  16           HA       LEU  16  10.940  10.103  -1.652
   95    HB2  LEU  16           HB2      LEU  16  12.064   7.486  -0.683
   96    HB3  LEU  16           HB3      LEU  16  12.484   9.037   0.041
   97    HG   LEU  16           HG       LEU  16   9.637   8.094  -0.134
   98   HD11  LEU  16          HD11      LEU  16   9.937   7.349   2.233
   99   HD12  LEU  16          HD12      LEU  16  10.744   6.338   1.034
  100   HD13  LEU  16          HD13      LEU  16  11.678   7.486   1.993
  101   HD21  LEU  16          HD21      LEU  16   9.166   9.775   1.367
  102   HD22  LEU  16          HD22      LEU  16  10.816   9.831   1.988
  103   HD23  LEU  16          HD23      LEU  16  10.445  10.519   0.407
  104    H    GLN  17           H        GLN  17  12.641  11.422  -1.972
  105    HA   GLN  17           HA       GLN  17  14.378  11.084  -4.096
  106    HB2  GLN  17           HB2      GLN  17  15.622  12.986  -3.212
  107    HB3  GLN  17           HB3      GLN  17  13.892  13.259  -3.065
  108    HG2  GLN  17           HG2      GLN  17  14.336  12.209  -0.662
  109    HG3  GLN  17           HG3      GLN  17  15.940  12.873  -0.969
  110   HE21  GLN  17          HE21      GLN  17  13.157  13.523   0.509
  111   HE22  GLN  17          HE22      GLN  17  13.130  15.247   0.401
  112    H    SER  18           H        SER  18  14.793  10.212  -0.717
  113    HA   SER  18           HA       SER  18  17.507   9.729  -0.610
  114    HB2  SER  18           HB2      SER  18  16.510   9.459   1.450
  115    HB3  SER  18           HB3      SER  18  15.138   8.569   0.788
  116    HG   SER  18           HG       SER  18  16.464   7.158   1.929
  117    H    GLY  19           H        GLY  19  14.958   7.745  -2.001
  118    HA2  GLY  19           HA2      GLY  19  15.677   6.418  -3.968
  119    HA3  GLY  19           HA3      GLY  19  17.048   5.906  -2.995
  120    H    ALA  20           H        ALA  20  13.610   6.156  -2.146
  121    HA   ALA  20           HA       ALA  20  13.370   3.260  -2.061
  122    HB1  ALA  20           HB1      ALA  20  13.565   2.999   0.134
  123    HB2  ALA  20           HB2      ALA  20  14.042   4.692   0.264
  124    HB3  ALA  20           HB3      ALA  20  12.345   4.239   0.426
  125    H    TRP  21           H        TRP  21  11.111   2.606  -1.427
  126    HA   TRP  21           HA       TRP  21   9.230   4.447  -2.700
  127    HB2  TRP  21           HB2      TRP  21   8.885   1.531  -1.968
  128    HB3  TRP  21           HB3      TRP  21   7.754   2.504  -2.905
  129    HD1  TRP  21           HD1      TRP  21  11.116   0.712  -3.190
  130    HE1  TRP  21           HE1      TRP  21  11.748   0.532  -5.679
  131    HE3  TRP  21           HE3      TRP  21   7.427   3.641  -5.177
  132    HZ2  TRP  21           HZ2      TRP  21  10.807   1.503  -8.156
  133    HZ3  TRP  21           HZ3      TRP  21   7.364   3.965  -7.615
  134    HH2  TRP  21           HH2      TRP  21   9.020   2.918  -9.072
  135    H    GLY  22           H        GLY  22   7.409   5.230  -1.712
  136    HA2  GLY  22           HA2      GLY  22   6.734   4.336   0.978
  137    HA3  GLY  22           HA3      GLY  22   7.286   5.998   0.832
  138    H    CYS  23           H        CYS  23   5.199   6.610   1.664
  139    HA   CYS  23           HA       CYS  23   3.187   6.736  -0.472
  140    HB2  CYS  23           HB2      CYS  23   2.909   5.503   2.173
  141    HB3  CYS  23           HB3      CYS  23   1.653   6.684   1.814
  142    H    CYS  24           H        CYS  24   2.170   8.669  -0.687
  143    HA   CYS  24           HA       CYS  24   2.433  10.677   1.412
  144    HB2  CYS  24           HB2      CYS  24   3.443  12.326   0.028
  145    HB3  CYS  24           HB3      CYS  24   4.412  10.868  -0.160