*HEADER    TOXIN                                   06-NOV-19   6UX5              
*TITLE     STRUCTURE OF ACRORHAGIN I FROM THE SEA ANEMONE ACTINIA EQUINA         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: U-ACTITOXIN-AEQ5A;                                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: U-AITX-AEQ5A,ACRORHAGIN I,ACRORHAGIN-1;                     
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ACTINIA EQUINA;                                 
*SOURCE   3 ORGANISM_COMMON: BEADLET ANEMONE;                                    
*SOURCE   4 ORGANISM_TAXID: 6106;                                                
*SOURCE   5 TISSUE: ACRORHAGI;                                                   
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)                                  
*KEYWDS    TOXIN                                                                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    B.KRISHNARJUNA,P.SUNANDA,R.S.NORTON                                   
*REVDAT   1   18-NOV-20 6UX5    0                                                
# Restraints file 1: acro1chi.tbl
! From DANGLE:

assign ( resid 7  and name c ) ( resid 8  and name n )

       ( resid 8  and name ca) ( resid 8  and name c )    1.0 -90 -40 2
       
assign ( resid 8  and name c ) ( resid 9  and name n )

       ( resid 9  and name ca) ( resid 9  and name c )    1.0 -90 -40 2

assign ( resid 9 and name c )   (resid 10 and name n )

       ( resid 10 and name ca)   (resid 10 and name c )  1.0 -90 -40 2

assign (resid   10 and name c )   (resid  11 and name n )

       (resid   11 and name ca)   (resid  11 and name c )  1.0 -90 -40 2

assign (resid   11 and name c )   (resid  12 and name n ) 

       (resid   12 and name ca)   (resid  12 and name c )  1.0 -90 -40 2
       
assign (resid   12 and name c )   (resid  13 and name n ) 

       (resid   13 and name ca)   (resid  13 and name c )  1.0 -90 -40 2
       
assign (resid   13 and name c )   (resid  14 and name n ) 

       (resid   14 and name ca)   (resid  14 and name c )  1.0 -90 -40 2
       
assign (resid   14 and name c )   (resid  15 and name n )

       (resid   15 and name ca)   (resid  15 and name c )  1.0 -100 -40 2

assign (resid   15 and name c )   (resid  16 and name n )

       (resid   16 and name ca)   (resid  16 and name c )  1.0 -80 -40 2
       
assign (resid   16 and name c )   (resid 17 and name n )

       (resid   17 and name ca)   (resid  17 and name c )  1.0 -90 -40 2
       
assign (resid   17 and name c )   (resid  18 and name n )

       (resid   18 and name ca)   (resid  18 and name c )  1.0 -80 -40 2
      
assign (resid   18 and name c )   (resid  19 and name n ) 

       (resid   19 and name ca)   (resid  19 and name c )  1.0 -90 -40 2
       
assign (resid   19 and name c )   (resid  20 and name n ) 

       (resid   20 and name ca)   (resid  20 and name c )  1.0 -90 -40 2
       
assign (resid   20 and name c )   (resid  21 and name n ) 

       (resid   21 and name ca)   (resid  21 and name c )  1.0 -90 -40 2
       
assign (resid   21 and name c )   (resid  22 and name n ) 

       (resid   22 and name ca)   (resid  22 and name c )  1.0 -90 -40 2
       
assign (resid   22 and name c )   (resid  23 and name n ) 

       (resid   23 and name ca)   (resid  23 and name c )  1.0 -90 -40 2
       
assign (resid   25 and name c )   (resid  26 and name n ) 

       (resid   26 and name ca)   (resid  26 and name c )  1.0 -100 -30 2

assign (resid   29 and name c )   (resid  30 and name n ) 

       (resid   30 and name ca)   (resid  30 and name c )  1.0 -110 -40 2
       
assign (resid   30 and name c )   (resid  31 and name n ) 

       (resid   31 and name ca)   (resid  31 and name c )  1.0 -80 -40 2
       
assign (resid   31 and name c )   (resid  32 and name n ) 

       (resid   32 and name ca)   (resid  32 and name c )  1.0 -90 -40 2
       
assign (resid   32 and name c )   (resid  33 and name n ) 

       (resid   33 and name ca)   (resid  33 and name c )  1.0 -90 -40 2
       
assign (resid   33 and name c )   (resid  34 and name n ) 

       (resid   34 and name ca)   (resid  34 and name c )  1.0 -90 -40 2

assign (resid   34 and name c )   (resid  35 and name n ) 

       (resid   35 and name ca)   (resid  35 and name c )  1.0 -90 -40 2
      
assign (resid   35 and name c )   (resid  36 and name n ) 

       (resid   36 and name ca)   (resid  36 and name c )  1.0 -90 -40 2
       
assign (resid   36 and name c )   (resid  37 and name n ) 

       (resid   37 and name ca)   (resid  37 and name c )  1.0 -100 -40 2
       
assign (resid   37 and name c )   (resid  38 and name n ) 

       (resid   38 and name ca)   (resid  38 and name c )  1.0 -80 -40 2
       
assign (resid   38 and name c )   (resid  39 and name n ) 

       (resid   39 and name ca)   (resid  39 and name c )  1.0 -80 -40 2
       
assign (resid   39 and name c )   (resid  40 and name n ) 

       (resid   40 and name ca)   (resid  40 and name c )  1.0 -80 -40 2
       
assign (resid   40 and name c )   (resid  41 and name n ) 

       (resid   41 and name ca)   (resid  41 and name c )  1.0 -90 -40 2
       
assign (resid   41 and name c )   (resid  42 and name n ) 

       (resid   42 and name ca)   (resid  42 and name c )  1.0 -90 -40 2
       
assign (resid   42 and name c )   (resid  43 and name n ) 

       (resid   43 and name ca)   (resid  43 and name c )  1.0 -80 -40 2
       
assign (resid   43 and name c )   (resid  44 and name n ) 

       (resid   44 and name ca)   (resid  44 and name c )  1.0 -90 -40 2
       
assign (resid   44 and name c )   (resid  45 and name n ) 

       (resid   45 and name ca)   (resid  45 and name c )  1.0 -90 -40 2
       
assign (resid   45 and name c )   (resid  46 and name n ) 

       (resid   46 and name ca)   (resid  46 and name c )  1.0 -90 -40 2
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           HT1      SER   1  12.383 -30.313   7.751
    2    H2   SER   1           HT2      SER   1  12.534 -29.480   9.224
    3    H3   SER   1           HT3      SER   1  12.931 -28.704   7.765
    4    HA   SER   1           HA       SER   1  10.598 -28.992   7.060
    5    HB2  SER   1           HB2      SER   1  10.186 -30.826   8.874
    6    HB3  SER   1           HB1      SER   1  10.074 -29.455  10.049
    7    HG   SER   1           HG       SER   1   8.192 -29.027   9.320
    8    H    SER   2           HN       SER   2  11.302 -26.765   6.647
    9    HA   SER   2           HA       SER   2  10.149 -24.992   8.584
   10    HB2  SER   2           HB2      SER   2  12.140 -23.519   8.840
   11    HB3  SER   2           HB1      SER   2  12.558 -25.176   9.436
   12    HG   SER   2           HG       SER   2  13.274 -23.865   7.047
   13    H    THR   3           HN       THR   3  10.120 -22.686   7.628
   14    HA   THR   3           HA       THR   3   9.504 -22.982   4.870
   15    HB   THR   3           HB       THR   3   9.069 -20.521   4.959
   16    HG1  THR   3           HG1      THR   3  10.790 -20.421   6.704
   17   HG21  THR   3          HG21      THR   3   7.374 -22.307   5.690
   18   HG22  THR   3          HG22      THR   3   7.122 -20.670   6.406
   19   HG23  THR   3          HG23      THR   3   7.884 -21.978   7.389
   20    HA   PRO   4           HA       PRO   4  13.375 -21.996   3.148
   21    HB2  PRO   4           HB2      PRO   4  12.580 -20.428   0.979
   22    HB3  PRO   4           HB1      PRO   4  12.498 -22.240   1.016
   23    HG2  PRO   4           HG2      PRO   4  10.302 -20.187   1.527
   24    HG3  PRO   4           HG1      PRO   4  10.221 -21.769   0.647
   25    HD2  PRO   4           HD2      PRO   4   9.294 -21.460   3.215
   26    HD3  PRO   4           HD1      PRO   4  10.031 -23.008   2.629
   27    H    ASP   5           HN       ASP   5  11.296 -19.055   2.759
   28    HA   ASP   5           HA       ASP   5  12.967 -17.614   4.514
   29    HB2  ASP   5           HB2      ASP   5  14.200 -17.691   2.175
   30    HB3  ASP   5           HB1      ASP   5  12.892 -16.576   1.667
   31    H    GLY   6           HN       GLY   6  12.083 -15.235   2.548
   32    HA2  GLY   6           HA2      GLY   6   9.271 -15.332   2.670
   33    HA3  GLY   6           HA1      GLY   6  10.008 -14.318   3.990
   34    H    THR   7           HN       THR   7  12.403 -13.630   2.361
   35    HA   THR   7           HA       THR   7  11.046 -11.625   0.693
   36    HB   THR   7           HB       THR   7  13.916 -11.798   1.748
   37    HG1  THR   7           HG1      THR   7  12.725  -9.538   2.292
   38   HG21  THR   7          HG21      THR   7  14.113 -10.842  -0.445
   39   HG22  THR   7          HG22      THR   7  14.005  -9.419   0.660
   40   HG23  THR   7          HG23      THR   7  12.560  -9.938  -0.288
   41    H    TRP   8           HN       TRP   8  13.322 -14.315   0.780
   42    HA   TRP   8           HA       TRP   8  14.298 -14.042  -1.798
   43    HB2  TRP   8           HB2      TRP   8  15.514 -15.709  -0.759
   44    HB3  TRP   8           HB1      TRP   8  14.156 -16.165   0.284
   45    HD1  TRP   8           HD1      TRP   8  15.869 -17.195  -2.985
   46    HE1  TRP   8           HE1      TRP   8  14.725 -19.296  -3.854
   47    HE3  TRP   8           HE3      TRP   8  11.892 -17.320   0.165
   48    HZ2  TRP   8           HZ2      TRP   8  12.423 -20.799  -3.262
   49    HZ3  TRP   8           HZ3      TRP   8  10.252 -19.119  -0.048
   50    HH2  TRP   8           HH2      TRP   8  10.519 -20.844  -1.753
   51    H    VAL   9           HN       VAL   9  11.287 -15.473  -0.448
   52    HA   VAL   9           HA       VAL   9  10.541 -16.708  -2.891
   53    HB   VAL   9           HB       VAL   9   9.572 -17.345  -0.657
   54   HG11  VAL   9          HG11      VAL   9   9.385 -14.690  -0.184
   55   HG12  VAL   9          HG12      VAL   9   8.241 -15.857   0.570
   56   HG13  VAL   9          HG13      VAL   9   7.745 -14.921  -0.890
   57   HG21  VAL   9          HG21      VAL   9   8.523 -17.940  -2.844
   58   HG22  VAL   9          HG22      VAL   9   7.606 -16.374  -2.822
   59   HG23  VAL   9          HG23      VAL   9   7.284 -17.635  -1.567
   60    H    LYS  10           HN       LYS  10  10.354 -13.421  -1.583
   61    HA   LYS  10           HA       LYS  10   8.219 -12.575  -3.205
   62    HB2  LYS  10           HB2      LYS  10  10.636 -11.034  -2.087
   63    HB3  LYS  10           HB1      LYS  10   9.328 -10.244  -3.032
   64    HG2  LYS  10           HG2      LYS  10   7.650 -10.843  -1.357
   65    HG3  LYS  10           HG1      LYS  10   8.835 -11.852  -0.460
   66    HD2  LYS  10           HD2      LYS  10   8.588  -9.738   0.720
   67    HD3  LYS  10           HD1      LYS  10  10.220  -9.772  -0.032
   68    HE2  LYS  10           HE2      LYS  10   9.432  -8.304  -1.886
   69    HE3  LYS  10           HE1      LYS  10   7.748  -8.325  -1.213
   70    HZ1  LYS  10           HZ1      LYS  10   9.911  -6.677  -0.534
   71    HZ2  LYS  10           HZ2      LYS  10   9.511  -7.603   0.832
   72    HZ3  LYS  10           HZ3      LYS  10   8.322  -6.664   0.065
   73    H    CYS  11           HN       CYS  11  11.590 -13.393  -3.807
   74    HA   CYS  11           HA       CYS  11  11.739 -11.945  -6.252
   75    HB2  CYS  11           HB2      CYS  11  13.921 -12.433  -5.492
   76    HB3  CYS  11           HB1      CYS  11  13.430 -14.018  -4.853
   77    H    ARG  12           HN       ARG  12  11.001 -15.288  -5.165
   78    HA   ARG  12           HA       ARG  12  10.783 -16.420  -7.658
   79    HB2  ARG  12           HB2      ARG  12   9.080 -16.924  -5.167
   80    HB3  ARG  12           HB1      ARG  12   9.158 -17.989  -6.582
   81    HG2  ARG  12           HG2      ARG  12  11.701 -17.262  -5.139
   82    HG3  ARG  12           HG1      ARG  12  10.600 -18.500  -4.451
   83    HD2  ARG  12           HD2      ARG  12  10.716 -19.768  -6.654
   84    HD3  ARG  12           HD1      ARG  12  11.955 -18.560  -7.214
   85    HE   ARG  12           HE       ARG  12  12.967 -19.380  -4.789
   86   HH11  ARG  12          HH11      ARG  12  11.668 -21.071  -7.643
   87   HH12  ARG  12          HH12      ARG  12  12.696 -22.456  -7.486
   88   HH21  ARG  12          HH21      ARG  12  14.372 -21.278  -4.576
   89   HH22  ARG  12          HH22      ARG  12  14.257 -22.574  -5.716
   90    H    HIS  13           HN       HIS  13   8.456 -14.622  -5.617
   91    HA   HIS  13           HA       HIS  13   6.346 -14.922  -7.512
   92    HB2  HIS  13           HB2      HIS  13   5.710 -14.401  -5.215
   93    HB3  HIS  13           HB1      HIS  13   6.791 -12.964  -5.193
   94    HD2  HIS  13           HD2      HIS  13   5.560 -10.610  -5.902
   95    HE1  HIS  13           HE1      HIS  13   2.042 -12.339  -7.492
   96    HE2  HIS  13           HE2      HIS  13   3.224 -10.175  -6.864
   97    H    ASP  14           HN       ASP  14   8.885 -12.441  -6.882
   98    HA   ASP  14           HA       ASP  14   7.827 -10.482  -8.568
   99    HB2  ASP  14           HB2      ASP  14   9.910 -10.290  -6.993
  100    HB3  ASP  14           HB1      ASP  14  10.829 -11.037  -8.340
  101    H    CYS  15           HN       CYS  15  10.240 -13.131  -9.300
  102    HA   CYS  15           HA       CYS  15  10.266 -12.387 -12.057
  103    HB2  CYS  15           HB2      CYS  15  11.067 -15.032 -10.690
  104    HB3  CYS  15           HB1      CYS  15  11.335 -14.670 -12.424
  105    H    PHE  16           HN       PHE  16   8.234 -14.368  -9.976
  106    HA   PHE  16           HA       PHE  16   7.178 -15.991 -11.994
  107    HB2  PHE  16           HB2      PHE  16   6.730 -16.375  -9.567
  108    HB3  PHE  16           HB1      PHE  16   5.748 -14.876  -9.536
  109    HD1  PHE  16           HD1      PHE  16   6.023 -17.946 -11.658
  110    HD2  PHE  16           HD2      PHE  16   3.541 -15.205  -9.557
  111    HE1  PHE  16           HE1      PHE  16   4.042 -19.241 -12.284
  112    HE2  PHE  16           HE2      PHE  16   1.568 -16.512 -10.192
  113    HZ   PHE  16           HZ       PHE  16   1.818 -18.529 -11.554
  114    H    THR  17           HN       THR  17   6.155 -12.775 -10.671
  115    HA   THR  17           HA       THR  17   3.927 -12.594 -12.392
  116    HB   THR  17           HB       THR  17   4.063 -10.130 -12.021
  117    HG1  THR  17           HG1      THR  17   6.547 -10.913 -10.943
  118   HG21  THR  17          HG21      THR  17   4.695 -11.110  -9.290
  119   HG22  THR  17          HG22      THR  17   3.540 -12.172 -10.181
  120   HG23  THR  17          HG23      THR  17   3.163 -10.423  -9.945
  121    H    LYS  18           HN       LYS  18   7.413 -11.727 -12.752
  122    HA   LYS  18           HA       LYS  18   7.062 -10.432 -15.219
  123    HB2  LYS  18           HB2      LYS  18   9.428 -11.838 -13.921
  124    HB3  LYS  18           HB1      LYS  18   9.534 -11.267 -15.622
  125    HG2  LYS  18           HG2      LYS  18  10.355  -9.722 -13.628
  126    HG3  LYS  18           HG1      LYS  18   9.493  -9.017 -15.037
  127    HD2  LYS  18           HD2      LYS  18   7.480  -8.728 -13.825
  128    HD3  LYS  18           HD1      LYS  18   7.938  -9.931 -12.579
  129    HE2  LYS  18           HE2      LYS  18   9.647  -8.393 -11.668
  130    HE3  LYS  18           HE1      LYS  18   9.287  -7.190 -12.971
  131    HZ1  LYS  18           HZ1      LYS  18   7.500  -6.510 -11.902
  132    HZ2  LYS  18           HZ2      LYS  18   8.125  -7.310 -10.539
  133    HZ3  LYS  18           HZ3      LYS  18   6.965  -8.076 -11.519
  134    H    TYR  19           HN       TYR  19   7.245 -13.813 -14.189
  135    HA   TYR  19           HA       TYR  19   7.722 -14.772 -16.829
  136    HB2  TYR  19           HB2      TYR  19   8.330 -16.362 -15.213
  137    HB3  TYR  19           HB1      TYR  19   6.911 -16.007 -14.184
  138    HD1  TYR  19           HD1      TYR  19   7.907 -17.496 -17.439
  139    HD2  TYR  19           HD2      TYR  19   5.071 -17.308 -14.293
  140    HE1  TYR  19           HE1      TYR  19   6.733 -19.414 -18.398
  141    HE2  TYR  19           HE2      TYR  19   3.896 -19.224 -15.251
  142    HH   TYR  19           HH       TYR  19   3.627 -20.437 -17.244
  143    H    LYS  20           HN       LYS  20   4.862 -14.519 -14.626
  144    HA   LYS  20           HA       LYS  20   3.055 -15.596 -16.437
  145    HB2  LYS  20           HB2      LYS  20   2.577 -13.316 -14.445
  146    HB3  LYS  20           HB1      LYS  20   1.311 -14.326 -15.210
  147    HG2  LYS  20           HG2      LYS  20   3.525 -15.390 -13.408
  148    HG3  LYS  20           HG1      LYS  20   1.872 -15.001 -12.873
  149    HD2  LYS  20           HD2      LYS  20   2.098 -16.839 -15.245
  150    HD3  LYS  20           HD1      LYS  20   2.674 -17.495 -13.677
  151    HE2  LYS  20           HE2      LYS  20   0.440 -16.907 -12.644
  152    HE3  LYS  20           HE1      LYS  20  -0.131 -16.340 -14.267
  153    HZ1  LYS  20           HZ1      LYS  20   0.408 -19.043 -13.291
  154    HZ2  LYS  20           HZ2      LYS  20   0.742 -18.715 -14.925
  155    HZ3  LYS  20           HZ3      LYS  20  -0.820 -18.457 -14.307
  156    H    SER  21           HN       SER  21   4.446 -12.337 -16.010
  157    HA   SER  21           HA       SER  21   2.719 -11.080 -17.862
  158    HB2  SER  21           HB2      SER  21   4.291  -9.769 -16.340
  159    HB3  SER  21           HB1      SER  21   5.681 -10.407 -17.306
  160    HG   SER  21           HG       SER  21   4.349  -9.498 -19.145
  161    H    CYS  22           HN       CYS  22   5.668 -13.090 -18.158
  162    HA   CYS  22           HA       CYS  22   6.106 -12.483 -20.884
  163    HB2  CYS  22           HB2      CYS  22   7.722 -13.696 -19.197
  164    HB3  CYS  22           HB1      CYS  22   6.754 -15.156 -19.575
  165    H    GLN  23           HN       GLN  23   4.123 -14.888 -19.100
  166    HA   GLN  23           HA       GLN  23   3.434 -16.321 -21.450
  167    HB2  GLN  23           HB2      GLN  23   2.091 -16.109 -18.695
  168    HB3  GLN  23           HB1      GLN  23   1.408 -17.107 -20.027
  169    HG2  GLN  23           HG2      GLN  23   3.758 -18.278 -20.119
  170    HG3  GLN  23           HG1      GLN  23   4.037 -17.506 -18.506
  171   HE21  GLN  23          HE21      GLN  23   2.285 -19.990 -20.287
  172   HE22  GLN  23          HE22      GLN  23   1.456 -20.688 -18.937
  173    H    MET  24           HN       MET  24   2.398 -13.302 -19.929
  174    HA   MET  24           HA       MET  24  -0.098 -13.291 -21.361
  175    HB2  MET  24           HB2      MET  24   1.412 -11.098 -19.854
  176    HB3  MET  24           HB1      MET  24  -0.188 -10.872 -20.626
  177    HG2  MET  24           HG2      MET  24   0.373 -12.980 -18.495
  178    HG3  MET  24           HG1      MET  24  -0.203 -11.335 -18.129
  179    HE1  MET  24           HE1      MET  24  -1.057 -14.754 -20.107
  180    HE2  MET  24           HE2      MET  24  -2.480 -15.043 -19.047
  181    HE3  MET  24           HE3      MET  24  -0.875 -14.691 -18.319
  182    H    SER  25           HN       SER  25   3.242 -12.583 -21.913
  183    HA   SER  25           HA       SER  25   2.807 -10.570 -23.857
  184    HB2  SER  25           HB2      SER  25   5.172 -12.520 -23.550
  185    HB3  SER  25           HB1      SER  25   5.151 -11.078 -24.644
  186    HG   SER  25           HG       SER  25   4.542 -10.810 -21.906
  187    H    ASP  26           HN       ASP  26   3.348 -10.928 -26.245
  188    HA   ASP  26           HA       ASP  26   1.752 -13.154 -27.112
  189    HB2  ASP  26           HB2      ASP  26   3.264 -10.958 -28.619
  190    HB3  ASP  26           HB1      ASP  26   2.351 -12.269 -29.446
  191    H    SER  27           HN       SER  27   4.734 -13.058 -25.879
  192    HA   SER  27           HA       SER  27   6.163 -14.325 -28.014
  193    HB2  SER  27           HB2      SER  27   6.814 -14.134 -25.003
  194    HB3  SER  27           HB1      SER  27   7.932 -14.792 -26.265
  195    HG   SER  27           HG       SER  27   8.505 -12.752 -26.113
  196    H    CYS  28           HN       CYS  28   3.771 -15.141 -25.695
  197    HA   CYS  28           HA       CYS  28   4.662 -17.895 -25.550
  198    HB2  CYS  28           HB2      CYS  28   3.564 -16.759 -23.548
  199    HB3  CYS  28           HB1      CYS  28   2.076 -16.602 -24.540
  200    H    HIS  29           HN       HIS  29   4.570 -17.832 -28.068
  201    HA   HIS  29           HA       HIS  29   1.789 -18.227 -28.899
  202    HB2  HIS  29           HB2      HIS  29   2.653 -18.056 -31.247
  203    HB3  HIS  29           HB1      HIS  29   3.021 -16.570 -30.308
  204    HD2  HIS  29           HD2      HIS  29   5.789 -16.162 -29.728
  205    HE1  HIS  29           HE1      HIS  29   7.101 -19.295 -32.240
  206    HE2  HIS  29           HE2      HIS  29   7.794 -17.267 -30.873
  207    H    ASP  30           HN       ASP  30   4.992 -19.670 -28.482
  208    HA   ASP  30           HA       ASP  30   3.834 -22.162 -29.471
  209    HB2  ASP  30           HB2      ASP  30   6.270 -20.943 -30.302
  210    HB3  ASP  30           HB1      ASP  30   6.771 -22.196 -29.113
  211    H    GLU  31           HN       GLU  31   4.748 -24.123 -28.259
  212    HA   GLU  31           HA       GLU  31   4.387 -23.612 -25.495
  213    HB2  GLU  31           HB2      GLU  31   5.374 -26.113 -26.988
  214    HB3  GLU  31           HB1      GLU  31   5.113 -26.054 -25.206
  215    HG2  GLU  31           HG2      GLU  31   2.686 -25.563 -25.531
  216    HG3  GLU  31           HG1      GLU  31   2.924 -25.542 -27.326
  217    H    GLN  32           HN       GLN  32   7.194 -24.269 -27.670
  218    HA   GLN  32           HA       GLN  32   9.046 -24.430 -25.540
  219    HB2  GLN  32           HB2      GLN  32   9.505 -25.247 -27.894
  220    HB3  GLN  32           HB1      GLN  32   9.532 -23.538 -28.423
  221    HG2  GLN  32           HG2      GLN  32  11.475 -23.056 -26.961
  222    HG3  GLN  32           HG1      GLN  32  11.427 -24.747 -26.320
  223   HE21  GLN  32          HE21      GLN  32  13.785 -24.165 -27.406
  224   HE22  GLN  32          HE22      GLN  32  13.976 -24.824 -28.994
  225    H    SER  33           HN       SER  33   7.797 -21.804 -27.649
  226    HA   SER  33           HA       SER  33   9.591 -19.861 -26.739
  227    HB2  SER  33           HB2      SER  33   6.680 -19.505 -27.675
  228    HB3  SER  33           HB1      SER  33   7.873 -18.163 -27.466
  229    HG   SER  33           HG       SER  33   7.909 -18.756 -29.560
  230    H    CYS  34           HN       CYS  34   6.395 -21.043 -25.506
  231    HA   CYS  34           HA       CYS  34   6.341 -19.057 -23.453
  232    HB2  CYS  34           HB2      CYS  34   4.456 -20.890 -24.438
  233    HB3  CYS  34           HB1      CYS  34   4.937 -21.630 -22.873
  234    H    HIS  35           HN       HIS  35   7.748 -22.307 -23.911
  235    HA   HIS  35           HA       HIS  35   8.183 -22.808 -21.163
  236    HB2  HIS  35           HB2      HIS  35   8.446 -24.641 -22.821
  237    HB3  HIS  35           HB1      HIS  35   9.780 -23.731 -23.615
  238    HD2  HIS  35           HD2      HIS  35  12.236 -24.531 -22.769
  239    HE1  HIS  35           HE1      HIS  35  11.043 -26.120 -19.038
  240    HE2  HIS  35           HE2      HIS  35  12.978 -25.763 -20.648
  241    H    GLN  36           HN       GLN  36   9.924 -20.989 -23.713
  242    HA   GLN  36           HA       GLN  36  12.310 -20.660 -22.299
  243    HB2  GLN  36           HB2      GLN  36  10.883 -18.807 -24.259
  244    HB3  GLN  36           HB1      GLN  36  12.511 -18.466 -23.599
  245    HG2  GLN  36           HG2      GLN  36  11.939 -21.136 -24.978
  246    HG3  GLN  36           HG1      GLN  36  12.315 -19.650 -25.940
  247   HE21  GLN  36          HE21      GLN  36  13.571 -22.077 -23.705
  248   HE22  GLN  36          HE22      GLN  36  15.216 -21.565 -23.740
  249    H    CYS  37           HN       CYS  37   9.147 -19.021 -22.150
  250    HA   CYS  37           HA       CYS  37  10.013 -16.869 -20.564
  251    HB2  CYS  37           HB2      CYS  37   7.320 -18.314 -20.667
  252    HB3  CYS  37           HB1      CYS  37   7.612 -16.842 -19.708
  253    H    HIS  38           HN       HIS  38   8.973 -20.189 -19.866
  254    HA   HIS  38           HA       HIS  38   8.973 -19.796 -17.060
  255    HB2  HIS  38           HB2      HIS  38   7.723 -21.685 -18.207
  256    HB3  HIS  38           HB1      HIS  38   9.325 -22.412 -18.603
  257    HD2  HIS  38           HD2      HIS  38  10.803 -23.330 -16.309
  258    HE1  HIS  38           HE1      HIS  38   7.371 -23.297 -13.832
  259    HE2  HIS  38           HE2      HIS  38   9.781 -24.083 -14.075
  260    H    VAL  39           HN       VAL  39  11.270 -20.910 -19.529
  261    HA   VAL  39           HA       VAL  39  13.210 -21.748 -17.667
  262    HB   VAL  39           HB       VAL  39  13.437 -20.719 -20.523
  263   HG11  VAL  39          HG11      VAL  39  15.765 -21.890 -20.290
  264   HG12  VAL  39          HG12      VAL  39  15.511 -21.749 -18.508
  265   HG13  VAL  39          HG13      VAL  39  15.569 -20.265 -19.534
  266   HG21  VAL  39          HG21      VAL  39  14.116 -23.438 -20.376
  267   HG22  VAL  39          HG22      VAL  39  12.518 -22.775 -20.887
  268   HG23  VAL  39          HG23      VAL  39  12.777 -23.292 -19.173
  269    H    LYS  40           HN       LYS  40  12.341 -18.606 -19.193
  270    HA   LYS  40           HA       LYS  40  14.667 -17.274 -18.284
  271    HB2  LYS  40           HB2      LYS  40  11.838 -16.262 -18.918
  272    HB3  LYS  40           HB1      LYS  40  13.162 -15.166 -18.390
  273    HG2  LYS  40           HG2      LYS  40  14.232 -15.239 -20.412
  274    HG3  LYS  40           HG1      LYS  40  13.891 -16.988 -20.654
  275    HD2  LYS  40           HD2      LYS  40  11.984 -16.583 -21.846
  276    HD3  LYS  40           HD1      LYS  40  11.462 -15.251 -20.765
  277    HE2  LYS  40           HE2      LYS  40  13.767 -14.897 -22.774
  278    HE3  LYS  40           HE1      LYS  40  12.036 -14.609 -23.223
  279    HZ1  LYS  40           HZ1      LYS  40  13.739 -12.844 -22.049
  280    HZ2  LYS  40           HZ2      LYS  40  12.771 -13.360 -20.753
  281    HZ3  LYS  40           HZ3      LYS  40  12.050 -12.710 -22.146
  282    H    HIS  41           HN       HIS  41  11.473 -18.066 -16.920
  283    HA   HIS  41           HA       HIS  41  11.766 -16.497 -14.616
  284    HB2  HIS  41           HB2      HIS  41   9.584 -17.483 -15.200
  285    HB3  HIS  41           HB1      HIS  41  10.271 -19.126 -15.065
  286    HD2  HIS  41           HD2      HIS  41   9.188 -16.133 -12.669
  287    HE1  HIS  41           HE1      HIS  41   9.666 -19.668 -10.433
  288    HE2  HIS  41           HE2      HIS  41   8.912 -17.245 -10.386
  289    H    THR  42           HN       THR  42  12.691 -19.847 -15.516
  290    HA   THR  42           HA       THR  42  13.524 -20.598 -12.973
  291    HB   THR  42           HB       THR  42  14.540 -21.441 -15.735
  292    HG1  THR  42           HG1      THR  42  12.336 -21.873 -15.073
  293   HG21  THR  42          HG21      THR  42  15.325 -22.197 -12.916
  294   HG22  THR  42          HG22      THR  42  16.307 -22.150 -14.425
  295   HG23  THR  42          HG23      THR  42  15.178 -23.521 -14.125
  296    H    ASP  43           HN       ASP  43  15.294 -19.011 -15.730
  297    HA   ASP  43           HA       ASP  43  17.738 -18.939 -14.264
  298    HB2  ASP  43           HB2      ASP  43  16.755 -17.321 -16.680
  299    HB3  ASP  43           HB1      ASP  43  18.407 -17.139 -15.980
  300    H    CYS  44           HN       CYS  44  14.893 -16.824 -14.574
  301    HA   CYS  44           HA       CYS  44  16.112 -14.537 -13.436
  302    HB2  CYS  44           HB2      CYS  44  13.846 -14.563 -14.699
  303    HB3  CYS  44           HB1      CYS  44  13.153 -15.330 -13.234
  304    H    VAL  45           HN       VAL  45  14.428 -17.405 -12.239
  305    HA   VAL  45           HA       VAL  45  14.388 -16.417  -9.583
  306    HB   VAL  45           HB       VAL  45  13.738 -18.984 -10.978
  307   HG11  VAL  45          HG11      VAL  45  13.530 -20.088  -8.673
  308   HG12  VAL  45          HG12      VAL  45  14.454 -18.706  -7.983
  309   HG13  VAL  45          HG13      VAL  45  15.231 -19.797  -9.204
  310   HG21  VAL  45          HG21      VAL  45  12.385 -17.088  -8.964
  311   HG22  VAL  45          HG22      VAL  45  11.669 -18.665  -9.472
  312   HG23  VAL  45          HG23      VAL  45  11.955 -17.365 -10.696
  313    H    ASN  46           HN       ASN  46  16.445 -18.515 -11.565
  314    HA   ASN  46           HA       ASN  46  17.984 -19.451  -9.424
  315    HB2  ASN  46           HB2      ASN  46  18.466 -19.083 -12.388
  316    HB3  ASN  46           HB1      ASN  46  19.807 -19.583 -11.304
  317   HD21  ASN  46          HD21      ASN  46  18.219 -20.975 -13.528
  318   HD22  ASN  46          HD22      ASN  46  17.727 -22.472 -12.829
  319    H    THR  47           HN       THR  47  18.038 -16.409 -11.274
  320    HA   THR  47           HA       THR  47  20.583 -15.758 -10.028
  321    HB   THR  47           HB       THR  47  18.823 -14.073 -11.865
  322    HG1  THR  47           HG1      THR  47  19.664 -15.882 -12.892
  323   HG21  THR  47          HG21      THR  47  20.191 -12.569 -10.606
  324   HG22  THR  47          HG22      THR  47  21.145 -12.862 -12.110
  325   HG23  THR  47          HG23      THR  47  21.587 -13.712 -10.581
  326    H    GLY  48           HN       GLY  48  17.145 -14.630 -10.097
  327    HA2  GLY  48           HA2      GLY  48  17.692 -12.576  -8.207
  328    HA3  GLY  48           HA1      GLY  48  16.076 -13.227  -8.719
  329    H    CYS  49           HN       CYS  49  16.507 -16.011  -7.956
  330    HA   CYS  49           HA       CYS  49  17.110 -15.827  -5.116
  331    HB2  CYS  49           HB2      CYS  49  14.833 -17.252  -4.844
  332    HB3  CYS  49           HB1      CYS  49  14.862 -15.477  -4.658
  333    HA   PRO  50           HA       PRO  50  18.607 -19.536  -7.528
  334    HB2  PRO  50           HB2      PRO  50  20.750 -19.673  -5.603
  335    HB3  PRO  50           HB1      PRO  50  20.858 -19.087  -7.317
  336    HG2  PRO  50           HG2      PRO  50  20.551 -17.505  -4.742
  337    HG3  PRO  50           HG1      PRO  50  21.354 -17.040  -6.298
  338    HD2  PRO  50           HD2      PRO  50  18.936 -16.015  -5.587
  339    HD3  PRO  50           HD1      PRO  50  19.325 -16.395  -7.308
  Start of MODEL    2
    1    H1   SER   1           HT1      SER   1   9.777 -29.054   4.953
    2    H2   SER   1           HT2      SER   1   8.762 -30.300   5.503
    3    H3   SER   1           HT3      SER   1   9.482 -29.238   6.617
    4    HA   SER   1           HA       SER   1   7.683 -28.263   4.514
    5    HB2  SER   1           HB2      SER   1   6.543 -30.082   5.965
    6    HB3  SER   1           HB1      SER   1   6.816 -28.981   7.375
    7    HG   SER   1           HG       SER   1   5.469 -27.538   6.527
    8    H    SER   2           HN       SER   2   9.426 -26.504   4.637
    9    HA   SER   2           HA       SER   2   8.526 -24.597   6.603
   10    HB2  SER   2           HB2      SER   2  10.472 -25.725   7.807
   11    HB3  SER   2           HB1      SER   2  11.516 -25.328   6.383
   12    HG   SER   2           HG       SER   2  11.456 -23.271   6.887
   13    H    THR   3           HN       THR   3   8.942 -22.409   5.876
   14    HA   THR   3           HA       THR   3   9.362 -22.337   3.053
   15    HB   THR   3           HB       THR   3   9.188 -19.992   4.995
   16    HG1  THR   3           HG1      THR   3   6.977 -20.218   3.713
   17   HG21  THR   3          HG21      THR   3  10.122 -19.467   2.745
   18   HG22  THR   3          HG22      THR   3   8.476 -18.760   2.935
   19   HG23  THR   3          HG23      THR   3   8.707 -20.262   1.963
   20    HA   PRO   4           HA       PRO   4  13.750 -22.090   3.177
   21    HB2  PRO   4           HB2      PRO   4  13.285 -20.340   0.764
   22    HB3  PRO   4           HB1      PRO   4  14.369 -21.773   0.953
   23    HG2  PRO   4           HG2      PRO   4  12.038 -22.000  -0.372
   24    HG3  PRO   4           HG1      PRO   4  12.599 -23.315   0.721
   25    HD2  PRO   4           HD2      PRO   4  10.449 -21.208   1.174
   26    HD3  PRO   4           HD1      PRO   4  10.499 -22.940   1.699
   27    H    ASP   5           HN       ASP   5  11.911 -19.069   2.455
   28    HA   ASP   5           HA       ASP   5  13.442 -17.759   4.468
   29    HB2  ASP   5           HB2      ASP   5  14.739 -17.567   2.172
   30    HB3  ASP   5           HB1      ASP   5  13.398 -16.467   1.721
   31    H    GLY   6           HN       GLY   6  12.504 -15.252   2.680
   32    HA2  GLY   6           HA2      GLY   6   9.687 -15.484   2.811
   33    HA3  GLY   6           HA1      GLY   6  10.413 -14.480   4.145
   34    H    THR   7           HN       THR   7  12.745 -13.644   2.499
   35    HA   THR   7           HA       THR   7  11.272 -11.657   0.904
   36    HB   THR   7           HB       THR   7  14.167 -11.713   1.906
   37    HG1  THR   7           HG1      THR   7  13.060  -9.587   2.693
   38   HG21  THR   7          HG21      THR   7  14.263 -10.644  -0.235
   39   HG22  THR   7          HG22      THR   7  14.072  -9.278   0.929
   40   HG23  THR   7          HG23      THR   7  12.652  -9.861  -0.018
   41    H    TRP   8           HN       TRP   8  13.698 -14.219   0.896
   42    HA   TRP   8           HA       TRP   8  14.619 -13.825  -1.690
   43    HB2  TRP   8           HB2      TRP   8  15.954 -15.436  -0.718
   44    HB3  TRP   8           HB1      TRP   8  14.654 -15.987   0.354
   45    HD1  TRP   8           HD1      TRP   8  16.343 -16.872  -2.972
   46    HE1  TRP   8           HE1      TRP   8  15.305 -19.029  -3.841
   47    HE3  TRP   8           HE3      TRP   8  12.457 -17.277   0.270
   48    HZ2  TRP   8           HZ2      TRP   8  13.119 -20.676  -3.218
   49    HZ3  TRP   8           HZ3      TRP   8  10.925 -19.171   0.073
   50    HH2  TRP   8           HH2      TRP   8  11.260 -20.851  -1.666
   51    H    VAL   9           HN       VAL   9  11.723 -15.463  -0.328
   52    HA   VAL   9           HA       VAL   9  11.019 -16.701  -2.782
   53    HB   VAL   9           HB       VAL   9  10.122 -17.429  -0.547
   54   HG11  VAL   9          HG11      VAL   9   8.151 -15.114  -0.715
   55   HG12  VAL   9          HG12      VAL   9   9.784 -14.798  -0.026
   56   HG13  VAL   9          HG13      VAL   9   8.718 -16.043   0.722
   57   HG21  VAL   9          HG21      VAL   9   9.079 -18.047  -2.732
   58   HG22  VAL   9          HG22      VAL   9   8.067 -16.542  -2.665
   59   HG23  VAL   9          HG23      VAL   9   7.845 -17.844  -1.431
   60    H    LYS  10           HN       LYS  10  10.678 -13.446  -1.439
   61    HA   LYS  10           HA       LYS  10   8.456 -12.703  -2.997
   62    HB2  LYS  10           HB2      LYS  10  10.821 -11.017  -1.975
   63    HB3  LYS  10           HB1      LYS  10   9.389 -10.320  -2.808
   64    HG2  LYS  10           HG2      LYS  10   7.897 -11.218  -1.024
   65    HG3  LYS  10           HG1      LYS  10   9.320 -11.926  -0.188
   66    HD2  LYS  10           HD2      LYS  10  10.293  -9.638   0.096
   67    HD3  LYS  10           HD1      LYS  10   8.873  -8.928  -0.746
   68    HE2  LYS  10           HE2      LYS  10   7.361  -9.787   1.065
   69    HE3  LYS  10           HE1      LYS  10   8.789 -10.517   1.911
   70    HZ1  LYS  10           HZ1      LYS  10   7.926  -8.196   2.556
   71    HZ2  LYS  10           HZ2      LYS  10   8.790  -7.656   1.197
   72    HZ3  LYS  10           HZ3      LYS  10   9.598  -8.472   2.448
   73    H    CYS  11           HN       CYS  11  11.846 -13.336  -3.696
   74    HA   CYS  11           HA       CYS  11  11.852 -11.858  -6.128
   75    HB2  CYS  11           HB2      CYS  11  14.077 -12.233  -5.442
   76    HB3  CYS  11           HB1      CYS  11  13.688 -13.840  -4.787
   77    H    ARG  12           HN       ARG  12  11.315 -15.239  -5.052
   78    HA   ARG  12           HA       ARG  12  11.097 -16.369  -7.546
   79    HB2  ARG  12           HB2      ARG  12   9.475 -16.973  -5.024
   80    HB3  ARG  12           HB1      ARG  12   9.584 -18.026  -6.447
   81    HG2  ARG  12           HG2      ARG  12  12.113 -17.172  -5.052
   82    HG3  ARG  12           HG1      ARG  12  11.091 -18.464  -4.340
   83    HD2  ARG  12           HD2      ARG  12  11.230 -19.734  -6.535
   84    HD3  ARG  12           HD1      ARG  12  12.379 -18.459  -7.137
   85    HE   ARG  12           HE       ARG  12  13.516 -19.197  -4.746
   86   HH11  ARG  12          HH11      ARG  12  12.206 -21.002  -7.525
   87   HH12  ARG  12          HH12      ARG  12  13.310 -22.328  -7.384
   88   HH21  ARG  12          HH21      ARG  12  15.026 -21.013  -4.557
   89   HH22  ARG  12          HH22      ARG  12  14.938 -22.334  -5.671
   90    H    HIS  13           HN       HIS  13   8.734 -14.698  -5.446
   91    HA   HIS  13           HA       HIS  13   6.599 -15.094  -7.294
   92    HB2  HIS  13           HB2      HIS  13   5.991 -14.620  -4.979
   93    HB3  HIS  13           HB1      HIS  13   6.999 -13.129  -4.973
   94    HD2  HIS  13           HD2      HIS  13   5.638 -10.838  -5.642
   95    HE1  HIS  13           HE1      HIS  13   2.172 -12.736  -7.153
   96    HE2  HIS  13           HE2      HIS  13   3.260 -10.518  -6.546
   97    H    ASP  14           HN       ASP  14   9.028 -12.497  -6.701
   98    HA   ASP  14           HA       ASP  14   7.845 -10.578  -8.348
   99    HB2  ASP  14           HB2      ASP  14   9.932 -10.268  -6.827
  100    HB3  ASP  14           HB1      ASP  14  10.872 -11.021  -8.154
  101    H    CYS  15           HN       CYS  15  10.363 -13.106  -9.157
  102    HA   CYS  15           HA       CYS  15  10.288 -12.347 -11.911
  103    HB2  CYS  15           HB2      CYS  15  11.254 -14.952 -10.573
  104    HB3  CYS  15           HB1      CYS  15  11.451 -14.584 -12.314
  105    H    PHE  16           HN       PHE  16   8.405 -14.441  -9.797
  106    HA   PHE  16           HA       PHE  16   7.383 -16.099 -11.805
  107    HB2  PHE  16           HB2      PHE  16   7.010 -16.524  -9.373
  108    HB3  PHE  16           HB1      PHE  16   5.958 -15.073  -9.305
  109    HD1  PHE  16           HD1      PHE  16   6.329 -18.104 -11.468
  110    HD2  PHE  16           HD2      PHE  16   3.770 -15.512  -9.273
  111    HE1  PHE  16           HE1      PHE  16   4.399 -19.488 -12.063
  112    HE2  PHE  16           HE2      PHE  16   1.847 -16.907  -9.877
  113    HZ   PHE  16           HZ       PHE  16   2.161 -18.894 -11.270
  114    H    THR  17           HN       THR  17   6.233 -12.950 -10.428
  115    HA   THR  17           HA       THR  17   3.963 -12.866 -12.105
  116    HB   THR  17           HB       THR  17   3.967 -10.410 -11.691
  117    HG1  THR  17           HG1      THR  17   6.527 -11.062 -10.720
  118   HG21  THR  17          HG21      THR  17   4.724 -11.361  -8.990
  119   HG22  THR  17          HG22      THR  17   3.642 -12.514  -9.859
  120   HG23  THR  17          HG23      THR  17   3.127 -10.803  -9.610
  121    H    LYS  18           HN       LYS  18   7.393 -11.841 -12.517
  122    HA   LYS  18           HA       LYS  18   6.941 -10.515 -14.951
  123    HB2  LYS  18           HB2      LYS  18   9.388 -11.824 -13.703
  124    HB3  LYS  18           HB1      LYS  18   9.445 -11.259 -15.407
  125    HG2  LYS  18           HG2      LYS  18  10.229  -9.672 -13.429
  126    HG3  LYS  18           HG1      LYS  18   9.329  -9.011 -14.833
  127    HD2  LYS  18           HD2      LYS  18   7.323  -8.779 -13.606
  128    HD3  LYS  18           HD1      LYS  18   7.824  -9.970 -12.365
  129    HE2  LYS  18           HE2      LYS  18   7.887  -7.654 -11.457
  130    HE3  LYS  18           HE1      LYS  18   9.554  -8.354 -11.521
  131    HZ1  LYS  18           HZ1      LYS  18   8.634  -6.012 -12.662
  132    HZ2  LYS  18           HZ2      LYS  18   8.928  -7.068 -13.958
  133    HZ3  LYS  18           HZ3      LYS  18  10.159  -6.735 -12.838
  134    H    TYR  19           HN       TYR  19   7.292 -13.899 -13.977
  135    HA   TYR  19           HA       TYR  19   7.755 -14.801 -16.640
  136    HB2  TYR  19           HB2      TYR  19   8.461 -16.398 -15.080
  137    HB3  TYR  19           HB1      TYR  19   7.080 -16.097 -13.988
  138    HD1  TYR  19           HD1      TYR  19   7.981 -17.532 -17.298
  139    HD2  TYR  19           HD2      TYR  19   5.275 -17.458 -14.032
  140    HE1  TYR  19           HE1      TYR  19   6.826 -19.480 -18.225
  141    HE2  TYR  19           HE2      TYR  19   4.121 -19.404 -14.957
  142    HH   TYR  19           HH       TYR  19   5.119 -21.472 -16.776
  143    H    LYS  20           HN       LYS  20   4.936 -14.678 -14.378
  144    HA   LYS  20           HA       LYS  20   3.137 -15.825 -16.153
  145    HB2  LYS  20           HB2      LYS  20   2.602 -13.568 -14.153
  146    HB3  LYS  20           HB1      LYS  20   1.367 -14.635 -14.890
  147    HG2  LYS  20           HG2      LYS  20   3.665 -15.607 -13.143
  148    HG3  LYS  20           HG1      LYS  20   2.017 -15.272 -12.558
  149    HD2  LYS  20           HD2      LYS  20   2.236 -17.112 -14.932
  150    HD3  LYS  20           HD1      LYS  20   2.876 -17.742 -13.377
  151    HE2  LYS  20           HE2      LYS  20   0.658 -17.248 -12.283
  152    HE3  LYS  20           HE1      LYS  20   0.020 -16.667 -13.876
  153    HZ1  LYS  20           HZ1      LYS  20   1.279 -19.287 -13.869
  154    HZ2  LYS  20           HZ2      LYS  20  -0.129 -18.735 -14.642
  155    HZ3  LYS  20           HZ3      LYS  20  -0.172 -19.158 -12.998
  156    H    SER  21           HN       SER  21   4.420 -12.521 -15.773
  157    HA   SER  21           HA       SER  21   2.594 -11.332 -17.579
  158    HB2  SER  21           HB2      SER  21   5.522 -10.578 -16.965
  159    HB3  SER  21           HB1      SER  21   4.383  -9.549 -17.923
  160    HG   SER  21           HG       SER  21   4.134 -10.398 -15.219
  161    H    CYS  22           HN       CYS  22   5.609 -13.227 -17.949
  162    HA   CYS  22           HA       CYS  22   5.924 -12.621 -20.702
  163    HB2  CYS  22           HB2      CYS  22   7.679 -13.698 -19.068
  164    HB3  CYS  22           HB1      CYS  22   6.783 -15.221 -19.365
  165    H    GLN  23           HN       GLN  23   4.144 -15.068 -18.799
  166    HA   GLN  23           HA       GLN  23   3.465 -16.631 -21.060
  167    HB2  GLN  23           HB2      GLN  23   2.114 -16.342 -18.312
  168    HB3  GLN  23           HB1      GLN  23   1.570 -17.510 -19.565
  169    HG2  GLN  23           HG2      GLN  23   4.424 -17.471 -18.378
  170    HG3  GLN  23           HG1      GLN  23   3.081 -18.535 -17.793
  171   HE21  GLN  23          HE21      GLN  23   1.973 -19.925 -19.475
  172   HE22  GLN  23          HE22      GLN  23   2.936 -20.582 -20.753
  173    H    MET  24           HN       MET  24   2.340 -13.578 -19.688
  174    HA   MET  24           HA       MET  24  -0.187 -13.767 -21.072
  175    HB2  MET  24           HB2      MET  24   1.187 -11.452 -19.622
  176    HB3  MET  24           HB1      MET  24  -0.434 -11.357 -20.374
  177    HG2  MET  24           HG2      MET  24   0.300 -13.382 -18.219
  178    HG3  MET  24           HG1      MET  24  -0.374 -11.772 -17.867
  179    HE1  MET  24           HE1      MET  24  -0.999 -15.260 -19.743
  180    HE2  MET  24           HE2      MET  24  -2.430 -15.630 -18.720
  181    HE3  MET  24           HE3      MET  24  -0.872 -15.168 -17.952
  182    H    SER  25           HN       SER  25   3.094 -12.940 -21.701
  183    HA   SER  25           HA       SER  25   2.591 -10.921 -23.613
  184    HB2  SER  25           HB2      SER  25   4.951 -12.892 -23.435
  185    HB3  SER  25           HB1      SER  25   4.894 -11.437 -24.510
  186    HG   SER  25           HG       SER  25   4.368 -11.146 -21.770
  187    H    ASP  26           HN       ASP  26   2.914 -11.193 -26.014
  188    HA   ASP  26           HA       ASP  26   1.314 -13.419 -26.851
  189    HB2  ASP  26           HB2      ASP  26   2.739 -11.184 -28.386
  190    HB3  ASP  26           HB1      ASP  26   1.791 -12.483 -29.195
  191    H    SER  27           HN       SER  27   4.458 -13.198 -25.885
  192    HA   SER  27           HA       SER  27   5.632 -14.586 -28.112
  193    HB2  SER  27           HB2      SER  27   6.693 -14.123 -25.252
  194    HB3  SER  27           HB1      SER  27   7.645 -14.858 -26.605
  195    HG   SER  27           HG       SER  27   8.162 -12.854 -26.861
  196    H    CYS  28           HN       CYS  28   3.535 -15.289 -25.535
  197    HA   CYS  28           HA       CYS  28   4.571 -17.984 -25.230
  198    HB2  CYS  28           HB2      CYS  28   3.629 -16.634 -23.236
  199    HB3  CYS  28           HB1      CYS  28   2.032 -16.739 -24.045
  200    H    HIS  29           HN       HIS  29   4.208 -18.224 -27.683
  201    HA   HIS  29           HA       HIS  29   1.375 -18.861 -28.116
  202    HB2  HIS  29           HB2      HIS  29   1.931 -18.712 -30.600
  203    HB3  HIS  29           HB1      HIS  29   2.048 -17.136 -29.743
  204    HD2  HIS  29           HD2      HIS  29   4.743 -16.179 -29.366
  205    HE1  HIS  29           HE1      HIS  29   6.395 -18.949 -32.090
  206    HE2  HIS  29           HE2      HIS  29   6.802 -16.839 -30.733
  207    H    ASP  30           HN       ASP  30   4.791 -19.832 -28.318
  208    HA   ASP  30           HA       ASP  30   3.873 -22.468 -29.162
  209    HB2  ASP  30           HB2      ASP  30   6.617 -21.102 -29.269
  210    HB3  ASP  30           HB1      ASP  30   6.458 -22.891 -29.383
  211    H    GLU  31           HN       GLU  31   4.624 -24.318 -27.922
  212    HA   GLU  31           HA       GLU  31   4.533 -23.806 -25.169
  213    HB2  GLU  31           HB2      GLU  31   5.481 -26.288 -26.716
  214    HB3  GLU  31           HB1      GLU  31   5.341 -26.229 -24.921
  215    HG2  GLU  31           HG2      GLU  31   2.885 -25.802 -25.077
  216    HG3  GLU  31           HG1      GLU  31   2.997 -25.773 -26.883
  217    H    GLN  32           HN       GLN  32   7.212 -24.353 -27.519
  218    HA   GLN  32           HA       GLN  32   9.207 -24.515 -25.527
  219    HB2  GLN  32           HB2      GLN  32   9.522 -25.224 -27.941
  220    HB3  GLN  32           HB1      GLN  32   9.475 -23.493 -28.394
  221    HG2  GLN  32           HG2      GLN  32  11.500 -23.025 -27.042
  222    HG3  GLN  32           HG1      GLN  32  11.533 -24.744 -26.478
  223   HE21  GLN  32          HE21      GLN  32  13.800 -24.066 -27.687
  224   HE22  GLN  32          HE22      GLN  32  13.898 -24.644 -29.314
  225    H    SER  33           HN       SER  33   7.828 -21.820 -27.514
  226    HA   SER  33           HA       SER  33   9.613 -19.883 -26.531
  227    HB2  SER  33           HB2      SER  33   6.705 -19.535 -27.490
  228    HB3  SER  33           HB1      SER  33   7.858 -18.174 -27.191
  229    HG   SER  33           HG       SER  33   8.228 -18.530 -29.216
  230    H    CYS  34           HN       CYS  34   6.412 -21.114 -25.391
  231    HA   CYS  34           HA       CYS  34   6.244 -19.227 -23.285
  232    HB2  CYS  34           HB2      CYS  34   5.049 -22.056 -23.525
  233    HB3  CYS  34           HB1      CYS  34   4.632 -20.881 -22.230
  234    H    HIS  35           HN       HIS  35   7.776 -22.453 -23.724
  235    HA   HIS  35           HA       HIS  35   8.329 -22.864 -20.989
  236    HB2  HIS  35           HB2      HIS  35   8.619 -24.719 -22.614
  237    HB3  HIS  35           HB1      HIS  35   9.885 -23.772 -23.474
  238    HD2  HIS  35           HD2      HIS  35  12.400 -24.457 -22.708
  239    HE1  HIS  35           HE1      HIS  35  11.408 -26.026 -18.908
  240    HE2  HIS  35           HE2      HIS  35  13.266 -25.623 -20.595
  241    H    GLN  36           HN       GLN  36   9.935 -21.009 -23.606
  242    HA   GLN  36           HA       GLN  36  12.350 -20.582 -22.266
  243    HB2  GLN  36           HB2      GLN  36  10.804 -18.784 -24.187
  244    HB3  GLN  36           HB1      GLN  36  12.444 -18.398 -23.588
  245    HG2  GLN  36           HG2      GLN  36  11.902 -21.091 -24.929
  246    HG3  GLN  36           HG1      GLN  36  12.186 -19.602 -25.916
  247   HE21  GLN  36          HE21      GLN  36  13.613 -21.955 -23.702
  248   HE22  GLN  36          HE22      GLN  36  15.238 -21.392 -23.816
  249    H    CYS  37           HN       CYS  37   9.139 -19.040 -22.033
  250    HA   CYS  37           HA       CYS  37   9.985 -16.854 -20.484
  251    HB2  CYS  37           HB2      CYS  37   7.335 -18.379 -20.508
  252    HB3  CYS  37           HB1      CYS  37   7.609 -16.900 -19.554
  253    H    HIS  38           HN       HIS  38   9.072 -20.199 -19.734
  254    HA   HIS  38           HA       HIS  38   9.144 -19.784 -16.930
  255    HB2  HIS  38           HB2      HIS  38   7.919 -21.720 -18.022
  256    HB3  HIS  38           HB1      HIS  38   9.529 -22.400 -18.467
  257    HD2  HIS  38           HD2      HIS  38  11.119 -23.233 -16.208
  258    HE1  HIS  38           HE1      HIS  38   7.758 -23.328 -13.634
  259    HE2  HIS  38           HE2      HIS  38  10.192 -24.014 -13.942
  260    H    VAL  39           HN       VAL  39  11.401 -20.835 -19.461
  261    HA   VAL  39           HA       VAL  39  13.422 -21.613 -17.661
  262    HB   VAL  39           HB       VAL  39  13.529 -20.569 -20.519
  263   HG11  VAL  39          HG11      VAL  39  15.698 -21.531 -18.573
  264   HG12  VAL  39          HG12      VAL  39  15.673 -20.042 -19.591
  265   HG13  VAL  39          HG13      VAL  39  15.902 -21.659 -20.360
  266   HG21  VAL  39          HG21      VAL  39  14.304 -23.260 -20.405
  267   HG22  VAL  39          HG22      VAL  39  12.667 -22.654 -20.856
  268   HG23  VAL  39          HG23      VAL  39  13.005 -23.167 -19.154
  269    H    LYS  40           HN       LYS  40  12.410 -18.495 -19.144
  270    HA   LYS  40           HA       LYS  40  14.721 -17.097 -18.298
  271    HB2  LYS  40           HB2      LYS  40  11.848 -16.175 -18.863
  272    HB3  LYS  40           HB1      LYS  40  13.143 -15.035 -18.351
  273    HG2  LYS  40           HG2      LYS  40  14.169 -15.051 -20.394
  274    HG3  LYS  40           HG1      LYS  40  13.904 -16.813 -20.635
  275    HD2  LYS  40           HD2      LYS  40  11.951 -16.499 -21.782
  276    HD3  LYS  40           HD1      LYS  40  11.402 -15.174 -20.704
  277    HE2  LYS  40           HE2      LYS  40  13.659 -14.752 -22.754
  278    HE3  LYS  40           HE1      LYS  40  11.910 -14.546 -23.184
  279    HZ1  LYS  40           HZ1      LYS  40  12.919 -13.226 -20.769
  280    HZ2  LYS  40           HZ2      LYS  40  11.731 -12.738 -21.879
  281    HZ3  LYS  40           HZ3      LYS  40  13.376 -12.597 -22.277
  282    H    HIS  41           HN       HIS  41  11.594 -17.990 -16.845
  283    HA   HIS  41           HA       HIS  41  11.895 -16.413 -14.547
  284    HB2  HIS  41           HB2      HIS  41   9.737 -17.479 -15.062
  285    HB3  HIS  41           HB1      HIS  41  10.487 -19.095 -14.957
  286    HD2  HIS  41           HD2      HIS  41   9.384 -16.148 -12.511
  287    HE1  HIS  41           HE1      HIS  41  10.038 -19.681 -10.313
  288    HE2  HIS  41           HE2      HIS  41   9.214 -17.282 -10.227
  289    H    THR  42           HN       THR  42  12.922 -19.724 -15.477
  290    HA   THR  42           HA       THR  42  13.853 -20.448 -12.961
  291    HB   THR  42           HB       THR  42  14.833 -21.239 -15.753
  292    HG1  THR  42           HG1      THR  42  12.655 -21.753 -14.983
  293   HG21  THR  42          HG21      THR  42  15.705 -21.990 -12.952
  294   HG22  THR  42          HG22      THR  42  16.662 -21.862 -14.473
  295   HG23  THR  42          HG23      THR  42  15.609 -23.295 -14.188
  296    H    ASP  43           HN       ASP  43  15.486 -18.773 -15.752
  297    HA   ASP  43           HA       ASP  43  17.962 -18.607 -14.349
  298    HB2  ASP  43           HB2      ASP  43  16.849 -17.020 -16.730
  299    HB3  ASP  43           HB1      ASP  43  18.506 -16.765 -16.068
  300    H    CYS  44           HN       CYS  44  15.024 -16.606 -14.572
  301    HA   CYS  44           HA       CYS  44  16.178 -14.279 -13.445
  302    HB2  CYS  44           HB2      CYS  44  13.879 -14.404 -14.655
  303    HB3  CYS  44           HB1      CYS  44  13.259 -15.181 -13.163
  304    H    VAL  45           HN       VAL  45  14.656 -17.225 -12.228
  305    HA   VAL  45           HA       VAL  45  14.634 -16.254  -9.563
  306    HB   VAL  45           HB       VAL  45  14.053 -18.832 -10.964
  307   HG11  VAL  45          HG11      VAL  45  13.959 -19.972  -8.670
  308   HG12  VAL  45          HG12      VAL  45  14.845 -18.561  -7.989
  309   HG13  VAL  45          HG13      VAL  45  15.631 -19.603  -9.246
  310   HG21  VAL  45          HG21      VAL  45  12.020 -18.616  -9.397
  311   HG22  VAL  45          HG22      VAL  45  12.215 -17.290 -10.609
  312   HG23  VAL  45          HG23      VAL  45  12.685 -17.019  -8.886
  313    H    ASN  46           HN       ASN  46  16.731 -18.247 -11.612
  314    HA   ASN  46           HA       ASN  46  18.364 -19.143  -9.526
  315    HB2  ASN  46           HB2      ASN  46  18.749 -18.714 -12.494
  316    HB3  ASN  46           HB1      ASN  46  20.144 -19.159 -11.456
  317   HD21  ASN  46          HD21      ASN  46  18.579 -20.604 -13.654
  318   HD22  ASN  46          HD22      ASN  46  18.175 -22.131 -12.961
  319    H    THR  47           HN       THR  47  18.250 -16.069 -11.323
  320    HA   THR  47           HA       THR  47  20.788 -15.338 -10.090
  321    HB   THR  47           HB       THR  47  18.986 -13.739 -11.965
  322    HG1  THR  47           HG1      THR  47  19.906 -15.483 -12.992
  323   HG21  THR  47          HG21      THR  47  20.268 -12.170 -10.683
  324   HG22  THR  47          HG22      THR  47  21.238 -12.416 -12.185
  325   HG23  THR  47          HG23      THR  47  21.719 -13.242 -10.656
  326    H    GLY  48           HN       GLY  48  17.305 -14.381 -10.151
  327    HA2  GLY  48           HA2      GLY  48  17.756 -12.259  -8.314
  328    HA3  GLY  48           HA1      GLY  48  16.174 -13.015  -8.787
  329    H    CYS  49           HN       CYS  49  16.782 -15.751  -7.984
  330    HA   CYS  49           HA       CYS  49  17.445 -15.496  -5.170
  331    HB2  CYS  49           HB2      CYS  49  15.227 -16.992  -4.805
  332    HB3  CYS  49           HB1      CYS  49  15.202 -15.213  -4.643
  333    HA   PRO  50           HA       PRO  50  19.023 -19.157  -7.607
  334    HB2  PRO  50           HB2      PRO  50  21.148 -19.218  -5.636
  335    HB3  PRO  50           HB1      PRO  50  21.266 -18.703  -7.372
  336    HG2  PRO  50           HG2      PRO  50  20.942 -17.020  -4.874
  337    HG3  PRO  50           HG1      PRO  50  21.687 -16.592  -6.468
  338    HD2  PRO  50           HD2      PRO  50  19.251 -15.623  -5.716
  339    HD3  PRO  50           HD1      PRO  50  19.616 -16.031  -7.436
  Start of MODEL    3
    1    H1   SER   1           HT1      SER   1   9.237 -30.260   5.531
    2    H2   SER   1           HT2      SER   1   9.532 -29.549   7.046
    3    H3   SER   1           HT3      SER   1  10.280 -28.924   5.654
    4    HA   SER   1           HA       SER   1   8.118 -28.325   4.766
    5    HB2  SER   1           HB2      SER   1   6.875 -30.091   6.205
    6    HB3  SER   1           HB1      SER   1   7.061 -28.935   7.585
    7    HG   SER   1           HG       SER   1   5.720 -27.584   6.660
    8    H    SER   2           HN       SER   2   9.705 -26.499   4.841
    9    HA   SER   2           HA       SER   2   8.803 -24.601   6.811
   10    HB2  SER   2           HB2      SER   2  10.806 -25.662   7.982
   11    HB3  SER   2           HB1      SER   2  11.807 -25.251   6.531
   12    HG   SER   2           HG       SER   2  11.682 -23.183   7.007
   13    H    THR   3           HN       THR   3   9.144 -22.409   6.054
   14    HA   THR   3           HA       THR   3   9.488 -22.352   3.222
   15    HB   THR   3           HB       THR   3   9.330 -19.992   5.147
   16    HG1  THR   3           HG1      THR   3   7.084 -20.315   3.903
   17   HG21  THR   3          HG21      THR   3   8.753 -20.306   2.135
   18   HG22  THR   3          HG22      THR   3  10.177 -19.472   2.861
   19   HG23  THR   3          HG23      THR   3   8.523 -18.799   3.097
   20    HA   PRO   4           HA       PRO   4  13.872 -22.020   3.213
   21    HB2  PRO   4           HB2      PRO   4  13.310 -20.292   0.805
   22    HB3  PRO   4           HB1      PRO   4  14.419 -21.708   0.970
   23    HG2  PRO   4           HG2      PRO   4  12.051 -21.970  -0.287
   24    HG3  PRO   4           HG1      PRO   4  12.669 -23.276   0.787
   25    HD2  PRO   4           HD2      PRO   4  10.495 -21.211   1.306
   26    HD3  PRO   4           HD1      PRO   4  10.597 -22.940   1.834
   27    H    ASP   5           HN       ASP   5  11.960 -19.039   2.522
   28    HA   ASP   5           HA       ASP   5  13.499 -17.688   4.494
   29    HB2  ASP   5           HB2      ASP   5  14.780 -17.505   2.193
   30    HB3  ASP   5           HB1      ASP   5  13.421 -16.431   1.733
   31    H    GLY   6           HN       GLY   6  12.515 -15.217   2.676
   32    HA2  GLY   6           HA2      GLY   6   9.705 -15.475   2.826
   33    HA3  GLY   6           HA1      GLY   6  10.423 -14.456   4.153
   34    H    THR   7           HN       THR   7  12.742 -13.604   2.495
   35    HA   THR   7           HA       THR   7  11.245 -11.639   0.897
   36    HB   THR   7           HB       THR   7  14.143 -11.664   1.889
   37    HG1  THR   7           HG1      THR   7  12.779  -9.512   2.540
   38   HG21  THR   7          HG21      THR   7  14.229 -10.604  -0.254
   39   HG22  THR   7          HG22      THR   7  14.018  -9.232   0.900
   40   HG23  THR   7          HG23      THR   7  12.606  -9.842  -0.045
   41    H    TRP   8           HN       TRP   8  13.689 -14.181   0.891
   42    HA   TRP   8           HA       TRP   8  14.600 -13.791  -1.698
   43    HB2  TRP   8           HB2      TRP   8  15.949 -15.390  -0.726
   44    HB3  TRP   8           HB1      TRP   8  14.657 -15.943   0.354
   45    HD1  TRP   8           HD1      TRP   8  16.334 -16.835  -2.976
   46    HE1  TRP   8           HE1      TRP   8  15.308 -19.004  -3.828
   47    HE3  TRP   8           HE3      TRP   8  12.469 -17.249   0.290
   48    HZ2  TRP   8           HZ2      TRP   8  13.136 -20.663  -3.184
   49    HZ3  TRP   8           HZ3      TRP   8  10.949 -19.156   0.112
   50    HH2  TRP   8           HH2      TRP   8  11.287 -20.844  -1.619
   51    H    VAL   9           HN       VAL   9  11.718 -15.439  -0.321
   52    HA   VAL   9           HA       VAL   9  11.017 -16.689  -2.769
   53    HB   VAL   9           HB       VAL   9  10.131 -17.417  -0.528
   54   HG11  VAL   9          HG11      VAL   9   8.142 -15.119  -0.702
   55   HG12  VAL   9          HG12      VAL   9   9.774 -14.789  -0.014
   56   HG13  VAL   9          HG13      VAL   9   8.718 -16.039   0.737
   57   HG21  VAL   9          HG21      VAL   9   8.070 -16.558  -2.648
   58   HG22  VAL   9          HG22      VAL   9   7.852 -17.851  -1.404
   59   HG23  VAL   9          HG23      VAL   9   9.088 -18.053  -2.706
   60    H    LYS  10           HN       LYS  10  10.660 -13.432  -1.432
   61    HA   LYS  10           HA       LYS  10   8.429 -12.704  -2.982
   62    HB2  LYS  10           HB2      LYS  10  10.792 -11.002  -1.982
   63    HB3  LYS  10           HB1      LYS  10   9.355 -10.315  -2.812
   64    HG2  LYS  10           HG2      LYS  10   7.876 -11.210  -1.012
   65    HG3  LYS  10           HG1      LYS  10   9.309 -11.902  -0.179
   66    HD2  LYS  10           HD2      LYS  10  10.269  -9.606   0.079
   67    HD3  LYS  10           HD1      LYS  10   8.841  -8.911  -0.761
   68    HE2  LYS  10           HE2      LYS  10   7.345  -9.763   1.067
   69    HE3  LYS  10           HE1      LYS  10   8.783 -10.474   1.912
   70    HZ1  LYS  10           HZ1      LYS  10   7.784  -7.891   2.071
   71    HZ2  LYS  10           HZ2      LYS  10   9.276  -7.772   1.269
   72    HZ3  LYS  10           HZ3      LYS  10   9.187  -8.526   2.787
   73    H    CYS  11           HN       CYS  11  11.819 -13.320  -3.695
   74    HA   CYS  11           HA       CYS  11  11.804 -11.856  -6.134
   75    HB2  CYS  11           HB2      CYS  11  14.035 -12.213  -5.455
   76    HB3  CYS  11           HB1      CYS  11  13.660 -13.820  -4.792
   77    H    ARG  12           HN       ARG  12  11.295 -15.236  -5.039
   78    HA   ARG  12           HA       ARG  12  11.075 -16.379  -7.526
   79    HB2  ARG  12           HB2      ARG  12   9.464 -16.981  -4.996
   80    HB3  ARG  12           HB1      ARG  12   9.575 -18.041  -6.413
   81    HG2  ARG  12           HG2      ARG  12  12.103 -17.162  -5.029
   82    HG3  ARG  12           HG1      ARG  12  11.091 -18.458  -4.309
   83    HD2  ARG  12           HD2      ARG  12  11.233 -19.735  -6.502
   84    HD3  ARG  12           HD1      ARG  12  12.376 -18.458  -7.107
   85    HE   ARG  12           HE       ARG  12  13.518 -19.181  -4.715
   86   HH11  ARG  12          HH11      ARG  12  12.210 -21.006  -7.483
   87   HH12  ARG  12          HH12      ARG  12  13.318 -22.328  -7.335
   88   HH21  ARG  12          HH21      ARG  12  15.033 -20.991  -4.517
   89   HH22  ARG  12          HH22      ARG  12  14.948 -22.319  -5.624
   90    H    HIS  13           HN       HIS  13   8.707 -14.713  -5.427
   91    HA   HIS  13           HA       HIS  13   6.570 -15.132  -7.268
   92    HB2  HIS  13           HB2      HIS  13   5.963 -14.652  -4.955
   93    HB3  HIS  13           HB1      HIS  13   6.963 -13.157  -4.955
   94    HD2  HIS  13           HD2      HIS  13   5.589 -10.874  -5.629
   95    HE1  HIS  13           HE1      HIS  13   2.132 -12.793  -7.129
   96    HE2  HIS  13           HE2      HIS  13   3.209 -10.568  -6.530
   97    H    ASP  14           HN       ASP  14   8.986 -12.520  -6.696
   98    HA   ASP  14           HA       ASP  14   7.787 -10.613  -8.346
   99    HB2  ASP  14           HB2      ASP  14   9.884 -10.295  -6.834
  100    HB3  ASP  14           HB1      ASP  14  10.817 -11.035  -8.173
  101    H    CYS  15           HN       CYS  15  10.319 -13.129  -9.159
  102    HA   CYS  15           HA       CYS  15  10.222 -12.382 -11.915
  103    HB2  CYS  15           HB2      CYS  15  11.219 -14.973 -10.570
  104    HB3  CYS  15           HB1      CYS  15  11.398 -14.616 -12.316
  105    H    PHE  16           HN       PHE  16   8.365 -14.476  -9.782
  106    HA   PHE  16           HA       PHE  16   7.346 -16.154 -11.775
  107    HB2  PHE  16           HB2      PHE  16   6.989 -16.567  -9.338
  108    HB3  PHE  16           HB1      PHE  16   5.926 -15.124  -9.274
  109    HD1  PHE  16           HD1      PHE  16   6.312 -18.165 -11.416
  110    HD2  PHE  16           HD2      PHE  16   3.741 -15.577  -9.231
  111    HE1  PHE  16           HE1      PHE  16   4.391 -19.570 -11.992
  112    HE2  PHE  16           HE2      PHE  16   1.826 -16.992  -9.816
  113    HZ   PHE  16           HZ       PHE  16   2.152 -18.987 -11.195
  114    H    THR  17           HN       THR  17   6.178 -13.005 -10.410
  115    HA   THR  17           HA       THR  17   3.900 -12.950 -12.078
  116    HB   THR  17           HB       THR  17   3.890 -10.488 -11.679
  117    HG1  THR  17           HG1      THR  17   6.454 -11.123 -10.710
  118   HG21  THR  17          HG21      THR  17   3.039 -10.885  -9.605
  119   HG22  THR  17          HG22      THR  17   4.643 -11.413  -8.970
  120   HG23  THR  17          HG23      THR  17   3.582 -12.589  -9.835
  121    H    LYS  18           HN       LYS  18   7.319 -11.891 -12.507
  122    HA   LYS  18           HA       LYS  18   6.842 -10.583 -14.947
  123    HB2  LYS  18           HB2      LYS  18   9.310 -11.851 -13.699
  124    HB3  LYS  18           HB1      LYS  18   9.355 -11.293 -15.405
  125    HG2  LYS  18           HG2      LYS  18  10.125  -9.686 -13.441
  126    HG3  LYS  18           HG1      LYS  18   9.202  -9.044 -14.840
  127    HD2  LYS  18           HD2      LYS  18   7.202  -8.842 -13.598
  128    HD3  LYS  18           HD1      LYS  18   7.733 -10.019 -12.356
  129    HE2  LYS  18           HE2      LYS  18   7.763  -7.695 -11.464
  130    HE3  LYS  18           HE1      LYS  18   9.440  -8.371 -11.530
  131    HZ1  LYS  18           HZ1      LYS  18   8.455  -6.057 -12.706
  132    HZ2  LYS  18           HZ2      LYS  18   8.820  -7.125 -13.974
  133    HZ3  LYS  18           HZ3      LYS  18  10.009  -6.728 -12.830
  134    H    TYR  19           HN       TYR  19   7.210 -13.954 -13.952
  135    HA   TYR  19           HA       TYR  19   7.695 -14.867 -16.610
  136    HB2  TYR  19           HB2      TYR  19   8.424 -16.447 -15.046
  137    HB3  TYR  19           HB1      TYR  19   7.043 -16.153 -13.949
  138    HD1  TYR  19           HD1      TYR  19   7.933 -17.590 -17.260
  139    HD2  TYR  19           HD2      TYR  19   5.264 -17.546 -13.966
  140    HE1  TYR  19           HE1      TYR  19   6.797 -19.557 -18.166
  141    HE2  TYR  19           HE2      TYR  19   4.129 -19.512 -14.872
  142    HH   TYR  19           HH       TYR  19   3.792 -20.597 -17.122
  143    H    LYS  20           HN       LYS  20   4.878 -14.779 -14.345
  144    HA   LYS  20           HA       LYS  20   3.095 -15.956 -16.117
  145    HB2  LYS  20           HB2      LYS  20   2.526 -13.702 -14.120
  146    HB3  LYS  20           HB1      LYS  20   1.308 -14.791 -14.852
  147    HG2  LYS  20           HG2      LYS  20   3.624 -15.727 -13.108
  148    HG3  LYS  20           HG1      LYS  20   1.975 -15.406 -12.516
  149    HD2  LYS  20           HD2      LYS  20   2.195 -17.252 -14.884
  150    HD3  LYS  20           HD1      LYS  20   2.859 -17.871 -13.333
  151    HE2  LYS  20           HE2      LYS  20   0.652 -17.423 -12.216
  152    HE3  LYS  20           HE1      LYS  20  -0.012 -16.812 -13.787
  153    HZ1  LYS  20           HZ1      LYS  20   1.170 -19.295 -14.248
  154    HZ2  LYS  20           HZ2      LYS  20  -0.473 -18.871 -14.299
  155    HZ3  LYS  20           HZ3      LYS  20   0.212 -19.448 -12.855
  156    H    SER  21           HN       SER  21   4.306 -12.624 -15.720
  157    HA   SER  21           HA       SER  21   2.469 -11.477 -17.541
  158    HB2  SER  21           HB2      SER  21   3.957 -10.065 -16.033
  159    HB3  SER  21           HB1      SER  21   5.382 -10.608 -17.005
  160    HG   SER  21           HG       SER  21   3.807  -9.797 -18.803
  161    H    CYS  22           HN       CYS  22   5.560 -13.259 -17.880
  162    HA   CYS  22           HA       CYS  22   5.927 -12.616 -20.606
  163    HB2  CYS  22           HB2      CYS  22   7.664 -13.695 -18.993
  164    HB3  CYS  22           HB1      CYS  22   6.766 -15.221 -19.259
  165    H    GLN  23           HN       GLN  23   4.135 -15.173 -18.833
  166    HA   GLN  23           HA       GLN  23   3.526 -16.624 -21.199
  167    HB2  GLN  23           HB2      GLN  23   2.497 -16.628 -18.338
  168    HB3  GLN  23           HB1      GLN  23   1.460 -17.370 -19.609
  169    HG2  GLN  23           HG2      GLN  23   3.667 -18.694 -20.299
  170    HG3  GLN  23           HG1      GLN  23   4.225 -18.242 -18.638
  171   HE21  GLN  23          HE21      GLN  23   2.066 -20.263 -20.528
  172   HE22  GLN  23          HE22      GLN  23   1.325 -21.101 -19.207
  173    H    MET  24           HN       MET  24   2.332 -13.677 -19.688
  174    HA   MET  24           HA       MET  24  -0.193 -13.864 -21.079
  175    HB2  MET  24           HB2      MET  24   1.126 -11.605 -19.496
  176    HB3  MET  24           HB1      MET  24  -0.483 -11.484 -20.272
  177    HG2  MET  24           HG2      MET  24   0.226 -13.629 -18.228
  178    HG3  MET  24           HG1      MET  24  -0.447 -12.042 -17.785
  179    HE1  MET  24           HE1      MET  24  -2.474 -15.815 -19.216
  180    HE2  MET  24           HE2      MET  24  -1.296 -15.501 -17.896
  181    HE3  MET  24           HE3      MET  24  -0.783 -15.352 -19.612
  182    H    SER  25           HN       SER  25   3.064 -12.948 -21.659
  183    HA   SER  25           HA       SER  25   2.501 -10.859 -23.487
  184    HB2  SER  25           HB2      SER  25   4.947 -12.722 -23.338
  185    HB3  SER  25           HB1      SER  25   4.840 -11.228 -24.356
  186    HG   SER  25           HG       SER  25   4.289 -11.121 -21.595
  187    H    ASP  26           HN       ASP  26   2.946 -11.049 -25.891
  188    HA   ASP  26           HA       ASP  26   1.531 -13.390 -26.819
  189    HB2  ASP  26           HB2      ASP  26   2.566 -10.879 -28.225
  190    HB3  ASP  26           HB1      ASP  26   1.783 -12.243 -29.096
  191    H    SER  27           HN       SER  27   4.486 -13.112 -25.743
  192    HA   SER  27           HA       SER  27   5.946 -13.864 -28.100
  193    HB2  SER  27           HB2      SER  27   6.758 -13.946 -25.127
  194    HB3  SER  27           HB1      SER  27   7.869 -14.287 -26.515
  195    HG   SER  27           HG       SER  27   7.980 -12.254 -26.930
  196    H    CYS  28           HN       CYS  28   3.729 -15.289 -25.993
  197    HA   CYS  28           HA       CYS  28   5.036 -17.865 -26.046
  198    HB2  CYS  28           HB2      CYS  28   3.596 -17.128 -24.069
  199    HB3  CYS  28           HB1      CYS  28   2.193 -17.134 -25.189
  200    H    HIS  29           HN       HIS  29   5.214 -17.925 -28.450
  201    HA   HIS  29           HA       HIS  29   2.673 -18.037 -29.832
  202    HB2  HIS  29           HB2      HIS  29   5.381 -18.821 -31.017
  203    HB3  HIS  29           HB1      HIS  29   3.920 -18.215 -31.886
  204    HD2  HIS  29           HD2      HIS  29   6.932 -16.806 -29.706
  205    HE1  HIS  29           HE1      HIS  29   4.955 -13.623 -31.665
  206    HE2  HIS  29           HE2      HIS  29   6.954 -14.301 -30.247
  207    H    ASP  30           HN       ASP  30   5.128 -20.148 -28.373
  208    HA   ASP  30           HA       ASP  30   3.388 -22.365 -29.076
  209    HB2  ASP  30           HB2      ASP  30   5.750 -22.071 -30.497
  210    HB3  ASP  30           HB1      ASP  30   6.335 -22.976 -29.055
  211    H    GLU  31           HN       GLU  31   4.305 -24.399 -27.717
  212    HA   GLU  31           HA       GLU  31   4.152 -23.547 -25.036
  213    HB2  GLU  31           HB2      GLU  31   5.017 -26.235 -26.252
  214    HB3  GLU  31           HB1      GLU  31   4.835 -25.953 -24.482
  215    HG2  GLU  31           HG2      GLU  31   2.406 -25.439 -24.766
  216    HG3  GLU  31           HG1      GLU  31   2.565 -25.645 -26.558
  217    H    GLN  32           HN       GLN  32   6.819 -24.445 -27.271
  218    HA   GLN  32           HA       GLN  32   8.813 -24.541 -25.299
  219    HB2  GLN  32           HB2      GLN  32   9.109 -25.323 -27.691
  220    HB3  GLN  32           HB1      GLN  32   9.084 -23.608 -28.197
  221    HG2  GLN  32           HG2      GLN  32  11.123 -23.127 -26.874
  222    HG3  GLN  32           HG1      GLN  32  11.134 -24.828 -26.254
  223   HE21  GLN  32          HE21      GLN  32  13.404 -24.226 -27.495
  224   HE22  GLN  32          HE22      GLN  32  13.485 -24.857 -29.104
  225    H    SER  33           HN       SER  33   7.392 -21.892 -27.280
  226    HA   SER  33           HA       SER  33   9.225 -19.943 -26.452
  227    HB2  SER  33           HB2      SER  33   6.254 -19.597 -27.178
  228    HB3  SER  33           HB1      SER  33   7.452 -18.253 -27.034
  229    HG   SER  33           HG       SER  33   8.521 -19.012 -28.756
  230    H    CYS  34           HN       CYS  34   6.116 -21.179 -25.055
  231    HA   CYS  34           HA       CYS  34   6.136 -19.257 -22.953
  232    HB2  CYS  34           HB2      CYS  34   4.542 -21.686 -23.663
  233    HB3  CYS  34           HB1      CYS  34   4.803 -21.496 -21.895
  234    H    HIS  35           HN       HIS  35   7.652 -22.433 -23.555
  235    HA   HIS  35           HA       HIS  35   8.308 -22.926 -20.850
  236    HB2  HIS  35           HB2      HIS  35   8.516 -24.743 -22.538
  237    HB3  HIS  35           HB1      HIS  35   9.754 -23.780 -23.420
  238    HD2  HIS  35           HD2      HIS  35  12.291 -24.497 -22.762
  239    HE1  HIS  35           HE1      HIS  35  11.431 -26.127 -18.955
  240    HE2  HIS  35           HE2      HIS  35  13.229 -25.703 -20.703
  241    H    GLN  36           HN       GLN  36   9.795 -21.047 -23.522
  242    HA   GLN  36           HA       GLN  36  12.255 -20.618 -22.266
  243    HB2  GLN  36           HB2      GLN  36  10.638 -18.820 -24.133
  244    HB3  GLN  36           HB1      GLN  36  12.303 -18.441 -23.598
  245    HG2  GLN  36           HG2      GLN  36  11.705 -21.134 -24.913
  246    HG3  GLN  36           HG1      GLN  36  11.944 -19.647 -25.916
  247   HE21  GLN  36          HE21      GLN  36  13.462 -21.948 -23.681
  248   HE22  GLN  36          HE22      GLN  36  15.082 -21.400 -23.896
  249    H    CYS  37           HN       CYS  37   9.051 -19.081 -21.956
  250    HA   CYS  37           HA       CYS  37   9.932 -16.906 -20.416
  251    HB2  CYS  37           HB2      CYS  37   7.277 -18.418 -20.410
  252    HB3  CYS  37           HB1      CYS  37   7.571 -16.942 -19.454
  253    H    HIS  38           HN       HIS  38   9.015 -20.250 -19.670
  254    HA   HIS  38           HA       HIS  38   9.121 -19.854 -16.865
  255    HB2  HIS  38           HB2      HIS  38   7.885 -21.784 -17.952
  256    HB3  HIS  38           HB1      HIS  38   9.490 -22.459 -18.424
  257    HD2  HIS  38           HD2      HIS  38  11.100 -23.335 -16.206
  258    HE1  HIS  38           HE1      HIS  38   7.791 -23.408 -13.567
  259    HE2  HIS  38           HE2      HIS  38  10.211 -24.120 -13.928
  260    H    VAL  39           HN       VAL  39  11.349 -20.894 -19.425
  261    HA   VAL  39           HA       VAL  39  13.391 -21.676 -17.648
  262    HB   VAL  39           HB       VAL  39  13.461 -20.631 -20.508
  263   HG11  VAL  39          HG11      VAL  39  15.837 -21.713 -20.382
  264   HG12  VAL  39          HG12      VAL  39  15.658 -21.592 -18.590
  265   HG13  VAL  39          HG13      VAL  39  15.616 -20.101 -19.606
  266   HG21  VAL  39          HG21      VAL  39  14.244 -23.321 -20.404
  267   HG22  VAL  39          HG22      VAL  39  12.599 -22.719 -20.832
  268   HG23  VAL  39          HG23      VAL  39  12.963 -23.231 -19.136
  269    H    LYS  40           HN       LYS  40  12.370 -18.554 -19.128
  270    HA   LYS  40           HA       LYS  40  14.690 -17.162 -18.287
  271    HB2  LYS  40           HB2      LYS  40  11.818 -16.207 -18.811
  272    HB3  LYS  40           HB1      LYS  40  13.159 -15.090 -18.370
  273    HG2  LYS  40           HG2      LYS  40  14.175 -15.245 -20.428
  274    HG3  LYS  40           HG1      LYS  40  13.714 -16.968 -20.656
  275    HD2  LYS  40           HD2      LYS  40  12.110 -16.268 -22.076
  276    HD3  LYS  40           HD1      LYS  40  11.250 -15.565 -20.667
  277    HE2  LYS  40           HE2      LYS  40  12.364 -13.384 -21.009
  278    HE3  LYS  40           HE1      LYS  40  13.380 -14.076 -22.340
  279    HZ1  LYS  40           HZ1      LYS  40  11.314 -12.800 -22.958
  280    HZ2  LYS  40           HZ2      LYS  40  10.418 -14.136 -22.415
  281    HZ3  LYS  40           HZ3      LYS  40  11.529 -14.318 -23.687
  282    H    HIS  41           HN       HIS  41  11.560 -18.044 -16.830
  283    HA   HIS  41           HA       HIS  41  11.866 -16.462 -14.537
  284    HB2  HIS  41           HB2      HIS  41   9.707 -17.531 -15.044
  285    HB3  HIS  41           HB1      HIS  41  10.459 -19.147 -14.936
  286    HD2  HIS  41           HD2      HIS  41   9.353 -16.195 -12.495
  287    HE1  HIS  41           HE1      HIS  41  10.025 -19.718 -10.287
  288    HE2  HIS  41           HE2      HIS  41   9.192 -17.322 -10.207
  289    H    THR  42           HN       THR  42  12.901 -19.771 -15.462
  290    HA   THR  42           HA       THR  42  13.837 -20.491 -12.946
  291    HB   THR  42           HB       THR  42  14.810 -21.280 -15.740
  292    HG1  THR  42           HG1      THR  42  12.645 -21.813 -14.974
  293   HG21  THR  42          HG21      THR  42  16.654 -21.873 -14.458
  294   HG22  THR  42          HG22      THR  42  15.624 -23.326 -14.194
  295   HG23  THR  42          HG23      THR  42  15.698 -22.032 -12.941
  296    H    ASP  43           HN       ASP  43  15.463 -18.812 -15.742
  297    HA   ASP  43           HA       ASP  43  17.936 -18.630 -14.332
  298    HB2  ASP  43           HB2      ASP  43  16.824 -17.064 -16.728
  299    HB3  ASP  43           HB1      ASP  43  18.478 -16.797 -16.063
  300    H    CYS  44           HN       CYS  44  14.987 -16.648 -14.572
  301    HA   CYS  44           HA       CYS  44  16.125 -14.303 -13.462
  302    HB2  CYS  44           HB2      CYS  44  13.823 -14.459 -14.669
  303    HB3  CYS  44           HB1      CYS  44  13.212 -15.220 -13.165
  304    H    VAL  45           HN       VAL  45  14.626 -17.253 -12.222
  305    HA   VAL  45           HA       VAL  45  14.603 -16.261  -9.564
  306    HB   VAL  45           HB       VAL  45  14.027 -18.851 -10.947
  307   HG11  VAL  45          HG11      VAL  45  13.947 -19.975  -8.644
  308   HG12  VAL  45          HG12      VAL  45  14.836 -18.560  -7.978
  309   HG13  VAL  45          HG13      VAL  45  15.613 -19.609  -9.234
  310   HG21  VAL  45          HG21      VAL  45  12.005 -18.632  -9.361
  311   HG22  VAL  45          HG22      VAL  45  12.182 -17.323 -10.593
  312   HG23  VAL  45          HG23      VAL  45  12.664 -17.026  -8.878
  313    H    ASN  46           HN       ASN  46  16.703 -18.264 -11.605
  314    HA   ASN  46           HA       ASN  46  18.346 -19.134  -9.517
  315    HB2  ASN  46           HB2      ASN  46  18.719 -18.729 -12.489
  316    HB3  ASN  46           HB1      ASN  46  20.122 -19.152 -11.454
  317   HD21  ASN  46          HD21      ASN  46  18.555 -20.630 -13.632
  318   HD22  ASN  46          HD22      ASN  46  18.169 -22.155 -12.923
  319    H    THR  47           HN       THR  47  18.211 -16.076 -11.337
  320    HA   THR  47           HA       THR  47  20.749 -15.320 -10.116
  321    HB   THR  47           HB       THR  47  18.933 -13.745 -11.998
  322    HG1  THR  47           HG1      THR  47  19.858 -15.491 -13.016
  323   HG21  THR  47          HG21      THR  47  21.182 -12.416 -12.235
  324   HG22  THR  47          HG22      THR  47  21.665 -13.227 -10.697
  325   HG23  THR  47          HG23      THR  47  20.210 -12.158 -10.736
  326    H    GLY  48           HN       GLY  48  17.261 -14.385 -10.172
  327    HA2  GLY  48           HA2      GLY  48  17.705 -12.247  -8.351
  328    HA3  GLY  48           HA1      GLY  48  16.126 -13.014  -8.816
  329    H    CYS  49           HN       CYS  49  16.749 -15.741  -7.995
  330    HA   CYS  49           HA       CYS  49  17.421 -15.467  -5.185
  331    HB2  CYS  49           HB2      CYS  49  15.207 -16.967  -4.804
  332    HB3  CYS  49           HB1      CYS  49  15.180 -15.188  -4.649
  333    HA   PRO  50           HA       PRO  50  19.005 -19.135  -7.609
  334    HB2  PRO  50           HB2      PRO  50  21.124 -19.185  -5.626
  335    HB3  PRO  50           HB1      PRO  50  21.248 -18.682  -7.366
  336    HG2  PRO  50           HG2      PRO  50  20.917 -16.981  -4.881
  337    HG3  PRO  50           HG1      PRO  50  21.661 -16.563  -6.478
  338    HD2  PRO  50           HD2      PRO  50  19.222 -15.593  -5.734
  339    HD3  PRO  50           HD1      PRO  50  19.589 -16.011  -7.450
  Start of MODEL    4
    1    H1   SER   1           HT1      SER   1  11.894 -29.193   5.517
    2    H2   SER   1           HT2      SER   1  10.623 -29.768   4.549
    3    H3   SER   1           HT3      SER   1  11.248 -30.740   5.793
    4    HA   SER   1           HA       SER   1   9.170 -28.890   5.898
    5    HB2  SER   1           HB2      SER   1   9.433 -31.192   7.068
    6    HB3  SER   1           HB1      SER   1  10.504 -30.343   8.253
    7    HG   SER   1           HG       SER   1   8.828 -29.099   8.874
    8    H    SER   2           HN       SER   2  10.812 -26.938   5.361
    9    HA   SER   2           HA       SER   2  11.064 -25.582   7.888
   10    HB2  SER   2           HB2      SER   2  13.362 -26.654   7.654
   11    HB3  SER   2           HB1      SER   2  13.509 -25.875   6.028
   12    HG   SER   2           HG       SER   2  13.646 -23.952   6.941
   13    H    THR   3           HN       THR   3  10.983 -23.270   7.586
   14    HA   THR   3           HA       THR   3   9.900 -22.595   5.030
   15    HB   THR   3           HB       THR   3  10.662 -20.775   7.361
   16    HG1  THR   3           HG1      THR   3   8.113 -20.943   7.174
   17   HG21  THR   3          HG21      THR   3  10.473 -19.629   5.140
   18   HG22  THR   3          HG22      THR   3   9.130 -19.158   6.245
   19   HG23  THR   3          HG23      THR   3   8.832 -20.343   4.919
   20    HA   PRO   4           HA       PRO   4  13.818 -21.684   3.256
   21    HB2  PRO   4           HB2      PRO   4  12.869 -20.167   1.122
   22    HB3  PRO   4           HB1      PRO   4  12.881 -21.981   1.158
   23    HG2  PRO   4           HG2      PRO   4  10.602 -20.042   1.743
   24    HG3  PRO   4           HG1      PRO   4  10.573 -21.625   0.864
   25    HD2  PRO   4           HD2      PRO   4   9.721 -21.363   3.467
   26    HD3  PRO   4           HD1      PRO   4  10.501 -22.873   2.846
   27    H    ASP   5           HN       ASP   5  11.568 -18.865   2.916
   28    HA   ASP   5           HA       ASP   5  13.173 -17.335   4.651
   29    HB2  ASP   5           HB2      ASP   5  14.413 -17.359   2.321
   30    HB3  ASP   5           HB1      ASP   5  13.048 -16.323   1.796
   31    H    GLY   6           HN       GLY   6  12.161 -15.028   2.644
   32    HA2  GLY   6           HA2      GLY   6   9.364 -15.251   2.779
   33    HA3  GLY   6           HA1      GLY   6  10.049 -14.201   4.099
   34    H    THR   7           HN       THR   7  12.419 -13.420   2.456
   35    HA   THR   7           HA       THR   7  10.978 -11.466   0.799
   36    HB   THR   7           HB       THR   7  13.862 -11.536   1.825
   37    HG1  THR   7           HG1      THR   7  12.473  -9.328   2.346
   38   HG21  THR   7          HG21      THR   7  12.411  -9.723  -0.186
   39   HG22  THR   7          HG22      THR   7  14.002 -10.556  -0.358
   40   HG23  THR   7          HG23      THR   7  13.839  -9.143   0.753
   41    H    TRP   8           HN       TRP   8  13.339 -14.079   0.867
   42    HA   TRP   8           HA       TRP   8  14.300 -13.775  -1.715
   43    HB2  TRP   8           HB2      TRP   8  15.569 -15.409  -0.695
   44    HB3  TRP   8           HB1      TRP   8  14.241 -15.888   0.377
   45    HD1  TRP   8           HD1      TRP   8  15.926 -16.912  -2.909
   46    HE1  TRP   8           HE1      TRP   8  14.825 -19.054  -3.734
   47    HE3  TRP   8           HE3      TRP   8  12.006 -17.107   0.310
   48    HZ2  TRP   8           HZ2      TRP   8  12.580 -20.612  -3.091
   49    HZ3  TRP   8           HZ3      TRP   8  10.413 -18.955   0.145
   50    HH2  TRP   8           HH2      TRP   8  10.701 -20.692  -1.549
   51    H    VAL   9           HN       VAL   9  11.339 -15.295  -0.357
   52    HA   VAL   9           HA       VAL   9  10.621 -16.562  -2.791
   53    HB   VAL   9           HB       VAL   9   9.670 -17.202  -0.551
   54   HG11  VAL   9          HG11      VAL   9   7.778 -14.834  -0.797
   55   HG12  VAL   9          HG12      VAL   9   9.416 -14.544  -0.110
   56   HG13  VAL   9          HG13      VAL   9   8.313 -15.735   0.669
   57   HG21  VAL   9          HG21      VAL   9   8.633 -17.840  -2.731
   58   HG22  VAL   9          HG22      VAL   9   7.678 -16.297  -2.721
   59   HG23  VAL   9          HG23      VAL   9   7.389 -17.554  -1.455
   60    H    LYS  10           HN       LYS  10  10.370 -13.267  -1.527
   61    HA   LYS  10           HA       LYS  10   8.200 -12.490  -3.141
   62    HB2  LYS  10           HB2      LYS  10  10.593 -10.855  -2.103
   63    HB3  LYS  10           HB1      LYS  10   9.198 -10.133  -2.974
   64    HG2  LYS  10           HG2      LYS  10   7.649 -10.959  -1.202
   65    HG3  LYS  10           HG1      LYS  10   9.037 -11.692  -0.328
   66    HD2  LYS  10           HD2      LYS  10  10.067  -9.428  -0.064
   67    HD3  LYS  10           HD1      LYS  10   8.684  -8.693  -0.946
   68    HE2  LYS  10           HE2      LYS  10   7.114  -9.478   0.850
   69    HE3  LYS  10           HE1      LYS  10   8.505 -10.232   1.735
   70    HZ1  LYS  10           HZ1      LYS  10   9.050  -7.527   1.060
   71    HZ2  LYS  10           HZ2      LYS  10   9.015  -8.291   2.576
   72    HZ3  LYS  10           HZ3      LYS  10   7.589  -7.647   1.915
   73    H    CYS  11           HN       CYS  11  11.580 -13.243  -3.759
   74    HA   CYS  11           HA       CYS  11  11.684 -11.811  -6.217
   75    HB2  CYS  11           HB2      CYS  11  13.881 -12.246  -5.474
   76    HB3  CYS  11           HB1      CYS  11  13.427 -13.830  -4.808
   77    H    ARG  12           HN       ARG  12  11.004 -15.150  -5.089
   78    HA   ARG  12           HA       ARG  12  10.804 -16.323  -7.565
   79    HB2  ARG  12           HB2      ARG  12   9.104 -16.816  -5.070
   80    HB3  ARG  12           HB1      ARG  12   9.206 -17.901  -6.468
   81    HG2  ARG  12           HG2      ARG  12  11.734 -17.110  -5.035
   82    HG3  ARG  12           HG1      ARG  12  10.648 -18.345  -4.316
   83    HD2  ARG  12           HD2      ARG  12  10.783 -19.668  -6.482
   84    HD3  ARG  12           HD1      ARG  12  11.998 -18.456  -7.081
   85    HE   ARG  12           HE       ARG  12  13.044 -19.187  -4.647
   86   HH11  ARG  12          HH11      ARG  12  11.731 -20.995  -7.423
   87   HH12  ARG  12          HH12      ARG  12  12.776 -22.361  -7.227
   88   HH21  ARG  12          HH21      ARG  12  14.471 -21.060  -4.382
   89   HH22  ARG  12          HH22      ARG  12  14.357 -22.399  -5.472
   90    H    HIS  13           HN       HIS  13   8.456 -14.525  -5.554
   91    HA   HIS  13           HA       HIS  13   6.351 -14.880  -7.445
   92    HB2  HIS  13           HB2      HIS  13   5.702 -14.343  -5.156
   93    HB3  HIS  13           HB1      HIS  13   6.768 -12.894  -5.144
   94    HD2  HIS  13           HD2      HIS  13   5.521 -10.559  -5.891
   95    HE1  HIS  13           HE1      HIS  13   2.014 -12.342  -7.449
   96    HE2  HIS  13           HE2      HIS  13   3.179 -10.159  -6.856
   97    H    ASP  14           HN       ASP  14   8.862 -12.366  -6.842
   98    HA   ASP  14           HA       ASP  14   7.787 -10.433  -8.545
   99    HB2  ASP  14           HB2      ASP  14   9.878 -10.220  -6.977
  100    HB3  ASP  14           HB1      ASP  14  10.794 -10.960  -8.329
  101    H    CYS  15           HN       CYS  15  10.225 -13.067  -9.261
  102    HA   CYS  15           HA       CYS  15  10.233 -12.353 -12.029
  103    HB2  CYS  15           HB2      CYS  15  11.071 -14.972 -10.632
  104    HB3  CYS  15           HB1      CYS  15  11.321 -14.636 -12.373
  105    H    PHE  16           HN       PHE  16   8.223 -14.329  -9.922
  106    HA   PHE  16           HA       PHE  16   7.181 -15.986 -11.920
  107    HB2  PHE  16           HB2      PHE  16   6.740 -16.352  -9.492
  108    HB3  PHE  16           HB1      PHE  16   5.745 -14.860  -9.471
  109    HD1  PHE  16           HD1      PHE  16   6.040 -17.944 -11.570
  110    HD2  PHE  16           HD2      PHE  16   3.541 -15.210  -9.482
  111    HE1  PHE  16           HE1      PHE  16   4.069 -19.262 -12.180
  112    HE2  PHE  16           HE2      PHE  16   1.577 -16.539 -10.102
  113    HZ   PHE  16           HZ       PHE  16   1.841 -18.563 -11.449
  114    H    THR  17           HN       THR  17   6.127 -12.767 -10.632
  115    HA   THR  17           HA       THR  17   3.894 -12.631 -12.354
  116    HB   THR  17           HB       THR  17   3.990 -10.168 -11.996
  117    HG1  THR  17           HG1      THR  17   6.505 -10.898 -10.964
  118   HG21  THR  17          HG21      THR  17   3.529 -12.207 -10.131
  119   HG22  THR  17          HG22      THR  17   3.106 -10.466  -9.915
  120   HG23  THR  17          HG23      THR  17   4.660 -11.104  -9.261
  121    H    LYS  18           HN       LYS  18   7.369 -11.723 -12.715
  122    HA   LYS  18           HA       LYS  18   7.013 -10.447 -15.190
  123    HB2  LYS  18           HB2      LYS  18   9.387 -11.833 -13.884
  124    HB3  LYS  18           HB1      LYS  18   9.490 -11.270 -15.587
  125    HG2  LYS  18           HG2      LYS  18  10.308  -9.710 -13.608
  126    HG3  LYS  18           HG1      LYS  18   9.435  -9.016 -15.015
  127    HD2  LYS  18           HD2      LYS  18   7.443  -8.699 -13.794
  128    HD3  LYS  18           HD1      LYS  18   7.873  -9.933 -12.569
  129    HE2  LYS  18           HE2      LYS  18   9.603  -8.442 -11.616
  130    HE3  LYS  18           HE1      LYS  18   9.266  -7.206 -12.894
  131    HZ1  LYS  18           HZ1      LYS  18   8.089  -7.366 -10.469
  132    HZ2  LYS  18           HZ2      LYS  18   6.922  -8.086 -11.477
  133    HZ3  LYS  18           HZ3      LYS  18   7.489  -6.520 -11.816
  134    H    TYR  19           HN       TYR  19   7.217 -13.820 -14.138
  135    HA   TYR  19           HA       TYR  19   7.705 -14.800 -16.768
  136    HB2  TYR  19           HB2      TYR  19   8.312 -16.381 -15.149
  137    HB3  TYR  19           HB1      TYR  19   6.910 -16.007 -14.107
  138    HD1  TYR  19           HD1      TYR  19   7.845 -17.532 -17.365
  139    HD2  TYR  19           HD2      TYR  19   5.073 -17.318 -14.165
  140    HE1  TYR  19           HE1      TYR  19   6.651 -19.460 -18.282
  141    HE2  TYR  19           HE2      TYR  19   3.881 -19.245 -15.081
  142    HH   TYR  19           HH       TYR  19   3.564 -20.375 -17.257
  143    H    LYS  20           HN       LYS  20   4.835 -14.548 -14.577
  144    HA   LYS  20           HA       LYS  20   3.042 -15.656 -16.384
  145    HB2  LYS  20           HB2      LYS  20   2.535 -13.359 -14.419
  146    HB3  LYS  20           HB1      LYS  20   1.283 -14.395 -15.172
  147    HG2  LYS  20           HG2      LYS  20   3.512 -15.432 -13.372
  148    HG3  LYS  20           HG1      LYS  20   1.871 -15.018 -12.812
  149    HD2  LYS  20           HD2      LYS  20   2.046 -16.899 -15.160
  150    HD3  LYS  20           HD1      LYS  20   2.631 -17.534 -13.585
  151    HE2  LYS  20           HE2      LYS  20   0.423 -16.941 -12.535
  152    HE3  LYS  20           HE1      LYS  20  -0.164 -16.327 -14.135
  153    HZ1  LYS  20           HZ1      LYS  20   0.907 -18.890 -14.488
  154    HZ2  LYS  20           HZ2      LYS  20  -0.701 -18.368 -14.648
  155    HZ3  LYS  20           HZ3      LYS  20  -0.140 -18.943 -13.152
  156    H    SER  21           HN       SER  21   4.405 -12.383 -15.987
  157    HA   SER  21           HA       SER  21   2.669 -11.161 -17.857
  158    HB2  SER  21           HB2      SER  21   4.203  -9.818 -16.330
  159    HB3  SER  21           HB1      SER  21   5.613 -10.438 -17.280
  160    HG   SER  21           HG       SER  21   4.222  -9.565 -19.128
  161    H    CYS  22           HN       CYS  22   5.657 -13.118 -18.119
  162    HA   CYS  22           HA       CYS  22   6.121 -12.516 -20.839
  163    HB2  CYS  22           HB2      CYS  22   7.751 -13.690 -19.174
  164    HB3  CYS  22           HB1      CYS  22   6.773 -15.161 -19.468
  165    H    GLN  23           HN       GLN  23   4.150 -14.964 -19.095
  166    HA   GLN  23           HA       GLN  23   3.501 -16.375 -21.473
  167    HB2  GLN  23           HB2      GLN  23   2.255 -16.268 -18.677
  168    HB3  GLN  23           HB1      GLN  23   1.438 -17.147 -20.018
  169    HG2  GLN  23           HG2      GLN  23   3.750 -18.393 -20.337
  170    HG3  GLN  23           HG1      GLN  23   4.117 -17.772 -18.675
  171   HE21  GLN  23          HE21      GLN  23   2.189 -20.017 -20.592
  172   HE22  GLN  23          HE22      GLN  23   1.387 -20.800 -19.274
  173    H    MET  24           HN       MET  24   2.434 -13.377 -19.957
  174    HA   MET  24           HA       MET  24  -0.075 -13.417 -21.385
  175    HB2  MET  24           HB2      MET  24   1.365 -11.225 -19.812
  176    HB3  MET  24           HB1      MET  24  -0.226 -11.013 -20.603
  177    HG2  MET  24           HG2      MET  24   0.327 -13.181 -18.534
  178    HG3  MET  24           HG1      MET  24  -0.243 -11.547 -18.107
  179    HE1  MET  24           HE1      MET  24  -1.577 -14.999 -18.176
  180    HE2  MET  24           HE2      MET  24  -0.633 -14.814 -19.694
  181    HE3  MET  24           HE3      MET  24  -2.393 -15.170 -19.769
  182    H    SER  25           HN       SER  25   3.244 -12.658 -21.917
  183    HA   SER  25           HA       SER  25   2.784 -10.593 -23.807
  184    HB2  SER  25           HB2      SER  25   5.182 -12.507 -23.544
  185    HB3  SER  25           HB1      SER  25   5.139 -11.029 -24.590
  186    HG   SER  25           HG       SER  25   4.544 -10.905 -21.831
  187    H    ASP  26           HN       ASP  26   3.330 -10.873 -26.194
  188    HA   ASP  26           HA       ASP  26   1.869 -13.195 -27.102
  189    HB2  ASP  26           HB2      ASP  26   3.036 -10.763 -28.544
  190    HB3  ASP  26           HB1      ASP  26   2.242 -12.129 -29.403
  191    H    SER  27           HN       SER  27   4.787 -12.980 -25.922
  192    HA   SER  27           HA       SER  27   6.324 -13.831 -28.190
  193    HB2  SER  27           HB2      SER  27   6.985 -13.912 -25.179
  194    HB3  SER  27           HB1      SER  27   8.150 -14.308 -26.507
  195    HG   SER  27           HG       SER  27   8.541 -12.269 -26.267
  196    H    CYS  28           HN       CYS  28   3.962 -15.137 -26.162
  197    HA   CYS  28           HA       CYS  28   5.156 -17.770 -26.150
  198    HB2  CYS  28           HB2      CYS  28   3.686 -16.955 -24.227
  199    HB3  CYS  28           HB1      CYS  28   2.322 -16.897 -25.392
  200    H    HIS  29           HN       HIS  29   5.413 -17.861 -28.543
  201    HA   HIS  29           HA       HIS  29   2.918 -17.858 -30.012
  202    HB2  HIS  29           HB2      HIS  29   5.630 -18.767 -31.094
  203    HB3  HIS  29           HB1      HIS  29   4.227 -18.115 -32.022
  204    HD2  HIS  29           HD2      HIS  29   7.230 -16.806 -29.775
  205    HE1  HIS  29           HE1      HIS  29   5.416 -13.558 -31.787
  206    HE2  HIS  29           HE2      HIS  29   7.359 -14.306 -30.326
  207    H    ASP  30           HN       ASP  30   5.265 -20.087 -28.518
  208    HA   ASP  30           HA       ASP  30   3.427 -22.219 -29.255
  209    HB2  ASP  30           HB2      ASP  30   5.849 -22.033 -30.600
  210    HB3  ASP  30           HB1      ASP  30   6.336 -22.977 -29.148
  211    H    GLU  31           HN       GLU  31   4.235 -24.300 -27.884
  212    HA   GLU  31           HA       GLU  31   4.020 -23.460 -25.204
  213    HB2  GLU  31           HB2      GLU  31   4.842 -26.167 -26.409
  214    HB3  GLU  31           HB1      GLU  31   4.608 -25.891 -24.644
  215    HG2  GLU  31           HG2      GLU  31   2.208 -25.320 -24.995
  216    HG3  GLU  31           HG1      GLU  31   2.418 -25.480 -26.786
  217    H    GLN  32           HN       GLN  32   6.738 -24.453 -27.344
  218    HA   GLN  32           HA       GLN  32   8.649 -24.604 -25.294
  219    HB2  GLN  32           HB2      GLN  32   9.006 -25.427 -27.666
  220    HB3  GLN  32           HB1      GLN  32   9.070 -23.718 -28.190
  221    HG2  GLN  32           HG2      GLN  32  11.073 -23.301 -26.793
  222    HG3  GLN  32           HG1      GLN  32  10.991 -24.992 -26.150
  223   HE21  GLN  32          HE21      GLN  32  13.332 -24.490 -27.308
  224   HE22  GLN  32          HE22      GLN  32  13.452 -25.151 -28.901
  225    H    SER  33           HN       SER  33   7.402 -21.932 -27.353
  226    HA   SER  33           HA       SER  33   9.279 -20.042 -26.490
  227    HB2  SER  33           HB2      SER  33   6.343 -19.590 -27.305
  228    HB3  SER  33           HB1      SER  33   7.589 -18.293 -27.145
  229    HG   SER  33           HG       SER  33   8.690 -19.143 -28.819
  230    H    CYS  34           HN       CYS  34   6.083 -21.142 -25.171
  231    HA   CYS  34           HA       CYS  34   6.121 -19.196 -23.090
  232    HB2  CYS  34           HB2      CYS  34   4.437 -21.543 -23.838
  233    HB3  CYS  34           HB1      CYS  34   4.672 -21.391 -22.063
  234    H    HIS  35           HN       HIS  35   7.508 -22.447 -23.611
  235    HA   HIS  35           HA       HIS  35   8.067 -22.931 -20.882
  236    HB2  HIS  35           HB2      HIS  35   8.243 -24.776 -22.543
  237    HB3  HIS  35           HB1      HIS  35   9.551 -23.879 -23.395
  238    HD2  HIS  35           HD2      HIS  35  12.030 -24.702 -22.649
  239    HE1  HIS  35           HE1      HIS  35  10.982 -26.239 -18.852
  240    HE2  HIS  35           HE2      HIS  35  12.850 -25.918 -20.547
  241    H    GLN  36           HN       GLN  36   9.713 -21.160 -23.533
  242    HA   GLN  36           HA       GLN  36  12.151 -20.819 -22.205
  243    HB2  GLN  36           HB2      GLN  36  10.676 -18.987 -24.154
  244    HB3  GLN  36           HB1      GLN  36  12.334 -18.664 -23.566
  245    HG2  GLN  36           HG2      GLN  36  11.665 -21.350 -24.866
  246    HG3  GLN  36           HG1      GLN  36  12.019 -19.889 -25.874
  247   HE21  GLN  36          HE21      GLN  36  13.332 -22.258 -23.592
  248   HE22  GLN  36          HE22      GLN  36  14.983 -21.784 -23.728
  249    H    CYS  37           HN       CYS  37   9.009 -19.142 -22.015
  250    HA   CYS  37           HA       CYS  37   9.938 -16.979 -20.484
  251    HB2  CYS  37           HB2      CYS  37   7.222 -18.379 -20.519
  252    HB3  CYS  37           HB1      CYS  37   7.553 -16.896 -19.591
  253    H    HIS  38           HN       HIS  38   8.859 -20.269 -19.711
  254    HA   HIS  38           HA       HIS  38   8.906 -19.832 -16.911
  255    HB2  HIS  38           HB2      HIS  38   7.615 -21.723 -18.003
  256    HB3  HIS  38           HB1      HIS  38   9.199 -22.475 -18.422
  257    HD2  HIS  38           HD2      HIS  38  10.711 -23.387 -16.147
  258    HE1  HIS  38           HE1      HIS  38   7.331 -23.280 -13.602
  259    HE2  HIS  38           HE2      HIS  38   9.725 -24.101 -13.884
  260    H    VAL  39           HN       VAL  39  11.156 -21.009 -19.392
  261    HA   VAL  39           HA       VAL  39  13.111 -21.850 -17.548
  262    HB   VAL  39           HB       VAL  39  13.305 -20.859 -20.420
  263   HG11  VAL  39          HG11      VAL  39  15.625 -22.044 -20.216
  264   HG12  VAL  39          HG12      VAL  39  15.403 -21.891 -18.431
  265   HG13  VAL  39          HG13      VAL  39  15.457 -20.413 -19.464
  266   HG21  VAL  39          HG21      VAL  39  12.635 -23.403 -19.027
  267   HG22  VAL  39          HG22      VAL  39  13.963 -23.584 -20.239
  268   HG23  VAL  39          HG23      VAL  39  12.369 -22.911 -20.744
  269    H    LYS  40           HN       LYS  40  12.274 -18.713 -19.108
  270    HA   LYS  40           HA       LYS  40  14.629 -17.410 -18.228
  271    HB2  LYS  40           HB2      LYS  40  11.818 -16.341 -18.847
  272    HB3  LYS  40           HB1      LYS  40  13.187 -15.273 -18.376
  273    HG2  LYS  40           HG2      LYS  40  14.251 -15.483 -20.402
  274    HG3  LYS  40           HG1      LYS  40  13.751 -17.197 -20.619
  275    HD2  LYS  40           HD2      LYS  40  12.189 -16.494 -22.081
  276    HD3  LYS  40           HD1      LYS  40  11.334 -15.695 -20.722
  277    HE2  LYS  40           HE2      LYS  40  12.557 -13.585 -21.125
  278    HE3  LYS  40           HE1      LYS  40  13.568 -14.378 -22.402
  279    HZ1  LYS  40           HZ1      LYS  40  10.608 -14.289 -22.540
  280    HZ2  LYS  40           HZ2      LYS  40  11.730 -14.599 -23.778
  281    HZ3  LYS  40           HZ3      LYS  40  11.589 -13.035 -23.130
  282    H    HIS  41           HN       HIS  41  11.428 -18.123 -16.838
  283    HA   HIS  41           HA       HIS  41  11.743 -16.521 -14.563
  284    HB2  HIS  41           HB2      HIS  41   9.555 -17.502 -15.105
  285    HB3  HIS  41           HB1      HIS  41  10.231 -19.147 -14.963
  286    HD2  HIS  41           HD2      HIS  41   9.197 -16.125 -12.582
  287    HE1  HIS  41           HE1      HIS  41   9.663 -19.648 -10.322
  288    HE2  HIS  41           HE2      HIS  41   8.932 -17.218 -10.287
  289    H    THR  42           HN       THR  42  12.642 -19.894 -15.399
  290    HA   THR  42           HA       THR  42  13.486 -20.601 -12.850
  291    HB   THR  42           HB       THR  42  14.486 -21.495 -15.603
  292    HG1  THR  42           HG1      THR  42  12.285 -21.910 -14.913
  293   HG21  THR  42          HG21      THR  42  16.261 -22.174 -14.282
  294   HG22  THR  42          HG22      THR  42  15.140 -23.548 -13.971
  295   HG23  THR  42          HG23      THR  42  15.282 -22.209 -12.773
  296    H    ASP  43           HN       ASP  43  15.250 -19.056 -15.636
  297    HA   ASP  43           HA       ASP  43  17.701 -18.967 -14.183
  298    HB2  ASP  43           HB2      ASP  43  16.707 -17.380 -16.617
  299    HB3  ASP  43           HB1      ASP  43  18.361 -17.187 -15.926
  300    H    CYS  44           HN       CYS  44  14.855 -16.849 -14.503
  301    HA   CYS  44           HA       CYS  44  16.083 -14.549 -13.400
  302    HB2  CYS  44           HB2      CYS  44  13.805 -14.602 -14.653
  303    HB3  CYS  44           HB1      CYS  44  13.123 -15.325 -13.161
  304    H    VAL  45           HN       VAL  45  14.417 -17.404 -12.156
  305    HA   VAL  45           HA       VAL  45  14.387 -16.376  -9.514
  306    HB   VAL  45           HB       VAL  45  13.724 -18.960 -10.871
  307   HG11  VAL  45          HG11      VAL  45  14.463 -18.649  -7.885
  308   HG12  VAL  45          HG12      VAL  45  15.233 -19.751  -9.099
  309   HG13  VAL  45          HG13      VAL  45  13.534 -20.041  -8.555
  310   HG21  VAL  45          HG21      VAL  45  11.661 -18.626  -9.385
  311   HG22  VAL  45          HG22      VAL  45  11.958 -17.305 -10.580
  312   HG23  VAL  45          HG23      VAL  45  12.385 -17.067  -8.841
  313    H    ASN  46           HN       ASN  46  16.434 -18.498 -11.481
  314    HA   ASN  46           HA       ASN  46  17.989 -19.419  -9.350
  315    HB2  ASN  46           HB2      ASN  46  18.446 -19.064 -12.317
  316    HB3  ASN  46           HB1      ASN  46  19.802 -19.545 -11.244
  317   HD21  ASN  46          HD21      ASN  46  18.194 -20.962 -13.443
  318   HD22  ASN  46          HD22      ASN  46  17.725 -22.460 -12.729
  319    H    THR  47           HN       THR  47  18.043 -16.378 -11.209
  320    HA   THR  47           HA       THR  47  20.583 -15.729  -9.929
  321    HB   THR  47           HB       THR  47  18.899 -14.094 -11.881
  322    HG1  THR  47           HG1      THR  47  19.775 -15.917 -12.829
  323   HG21  THR  47          HG21      THR  47  21.623 -13.691 -10.521
  324   HG22  THR  47          HG22      THR  47  20.219 -12.560 -10.592
  325   HG23  THR  47          HG23      THR  47  21.204 -12.869 -12.072
  326    H    GLY  48           HN       GLY  48  17.145 -14.632 -10.093
  327    HA2  GLY  48           HA2      GLY  48  17.640 -12.488  -8.292
  328    HA3  GLY  48           HA1      GLY  48  16.041 -13.191  -8.788
  329    H    CYS  49           HN       CYS  49  16.519 -15.930  -7.911
  330    HA   CYS  49           HA       CYS  49  17.125 -15.637  -5.089
  331    HB2  CYS  49           HB2      CYS  49  14.836 -17.033  -4.749
  332    HB3  CYS  49           HB1      CYS  49  14.886 -15.253  -4.618
  333    HA   PRO  50           HA       PRO  50  18.582 -19.433  -7.396
  334    HB2  PRO  50           HB2      PRO  50  20.699 -19.528  -5.426
  335    HB3  PRO  50           HB1      PRO  50  20.839 -19.039  -7.168
  336    HG2  PRO  50           HG2      PRO  50  20.551 -17.316  -4.688
  337    HG3  PRO  50           HG1      PRO  50  21.346 -16.940  -6.273
  338    HD2  PRO  50           HD2      PRO  50  18.941 -15.857  -5.589
  339    HD3  PRO  50           HD1      PRO  50  19.316 -16.316  -7.293
  Start of MODEL    5
    1    H1   SER   1           HT1      SER   1   9.161 -28.542   3.869
    2    H2   SER   1           HT2      SER   1   8.048 -27.263   3.768
    3    H3   SER   1           HT3      SER   1   7.508 -28.870   3.652
    4    HA   SER   1           HA       SER   1   6.998 -28.574   5.783
    5    HB2  SER   1           HB2      SER   1   9.101 -30.175   5.572
    6    HB3  SER   1           HB1      SER   1   9.996 -28.805   6.344
    7    HG   SER   1           HG       SER   1   9.275 -30.106   7.938
    8    H    SER   2           HN       SER   2   9.954 -26.621   5.029
    9    HA   SER   2           HA       SER   2   8.806 -24.584   6.793
   10    HB2  SER   2           HB2      SER   2  11.798 -25.296   6.549
   11    HB3  SER   2           HB1      SER   2  11.134 -23.881   7.462
   12    HG   SER   2           HG       SER   2   9.843 -26.090   8.202
   13    H    THR   3           HN       THR   3   9.191 -22.386   6.051
   14    HA   THR   3           HA       THR   3   9.520 -22.339   3.212
   15    HB   THR   3           HB       THR   3   9.367 -19.974   5.133
   16    HG1  THR   3           HG1      THR   3   7.121 -20.281   3.896
   17   HG21  THR   3          HG21      THR   3  10.218 -19.463   2.848
   18   HG22  THR   3          HG22      THR   3   8.566 -18.781   3.082
   19   HG23  THR   3          HG23      THR   3   8.792 -20.292   2.122
   20    HA   PRO   4           HA       PRO   4  13.905 -22.021   3.206
   21    HB2  PRO   4           HB2      PRO   4  13.342 -20.292   0.797
   22    HB3  PRO   4           HB1      PRO   4  14.455 -21.706   0.963
   23    HG2  PRO   4           HG2      PRO   4  12.087 -21.976  -0.293
   24    HG3  PRO   4           HG1      PRO   4  12.706 -23.277   0.785
   25    HD2  PRO   4           HD2      PRO   4  10.529 -21.213   1.297
   26    HD3  PRO   4           HD1      PRO   4  10.632 -22.939   1.830
   27    H    ASP   5           HN       ASP   5  11.994 -19.037   2.521
   28    HA   ASP   5           HA       ASP   5  13.546 -17.689   4.489
   29    HB2  ASP   5           HB2      ASP   5  14.809 -17.496   2.179
   30    HB3  ASP   5           HB1      ASP   5  13.441 -16.428   1.729
   31    H    GLY   6           HN       GLY   6  12.536 -15.221   2.673
   32    HA2  GLY   6           HA2      GLY   6   9.729 -15.485   2.860
   33    HA3  GLY   6           HA1      GLY   6  10.461 -14.462   4.177
   34    H    THR   7           HN       THR   7  12.758 -13.610   2.491
   35    HA   THR   7           HA       THR   7  11.237 -11.654   0.902
   36    HB   THR   7           HB       THR   7  14.142 -11.660   1.871
   37    HG1  THR   7           HG1      THR   7  12.614  -9.532   2.468
   38   HG21  THR   7          HG21      THR   7  14.009  -9.239   0.876
   39   HG22  THR   7          HG22      THR   7  12.580  -9.841  -0.047
   40   HG23  THR   7          HG23      THR   7  14.196 -10.611  -0.282
   41    H    TRP   8           HN       TRP   8  13.701 -14.180   0.882
   42    HA   TRP   8           HA       TRP   8  14.590 -13.792  -1.714
   43    HB2  TRP   8           HB2      TRP   8  15.952 -15.384  -0.746
   44    HB3  TRP   8           HB1      TRP   8  14.666 -15.945   0.338
   45    HD1  TRP   8           HD1      TRP   8  16.334 -16.822  -3.002
   46    HE1  TRP   8           HE1      TRP   8  15.316 -18.995  -3.852
   47    HE3  TRP   8           HE3      TRP   8  12.490 -17.265   0.282
   48    HZ2  TRP   8           HZ2      TRP   8  13.157 -20.669  -3.200
   49    HZ3  TRP   8           HZ3      TRP   8  10.979 -19.180   0.109
   50    HH2  TRP   8           HH2      TRP   8  11.317 -20.862  -1.628
   51    H    VAL   9           HN       VAL   9  11.729 -15.470  -0.320
   52    HA   VAL   9           HA       VAL   9  11.018 -16.720  -2.763
   53    HB   VAL   9           HB       VAL   9  10.146 -17.451  -0.520
   54   HG11  VAL   9          HG11      VAL   9   8.164 -15.144  -0.676
   55   HG12  VAL   9          HG12      VAL   9   9.797 -14.832   0.013
   56   HG13  VAL   9          HG13      VAL   9   8.732 -16.078   0.756
   57   HG21  VAL   9          HG21      VAL   9   8.067 -16.589  -2.623
   58   HG22  VAL   9          HG22      VAL   9   7.857 -17.883  -1.377
   59   HG23  VAL   9          HG23      VAL   9   9.084 -18.085  -2.689
   60    H    LYS  10           HN       LYS  10  10.654 -13.464  -1.431
   61    HA   LYS  10           HA       LYS  10   8.414 -12.751  -2.979
   62    HB2  LYS  10           HB2      LYS  10  10.767 -11.016  -2.011
   63    HB3  LYS  10           HB1      LYS  10   9.281 -10.361  -2.779
   64    HG2  LYS  10           HG2      LYS  10   9.273 -12.050  -0.215
   65    HG3  LYS  10           HG1      LYS  10   9.332 -10.255  -0.230
   66    HD2  LYS  10           HD2      LYS  10   7.170 -10.240  -1.546
   67    HD3  LYS  10           HD1      LYS  10   7.104 -12.031  -1.407
   68    HE2  LYS  10           HE2      LYS  10   7.018 -11.834   1.099
   69    HE3  LYS  10           HE1      LYS  10   7.084 -10.028   0.955
   70    HZ1  LYS  10           HZ1      LYS  10   5.009 -11.677  -0.378
   71    HZ2  LYS  10           HZ2      LYS  10   5.019 -10.003  -0.092
   72    HZ3  LYS  10           HZ3      LYS  10   4.844 -11.086   1.204
   73    H    CYS  11           HN       CYS  11  11.812 -13.339  -3.688
   74    HA   CYS  11           HA       CYS  11  11.788 -11.868  -6.124
   75    HB2  CYS  11           HB2      CYS  11  14.020 -12.212  -5.436
   76    HB3  CYS  11           HB1      CYS  11  13.656 -13.829  -4.792
   77    H    ARG  12           HN       ARG  12  11.300 -15.255  -5.039
   78    HA   ARG  12           HA       ARG  12  11.092 -16.394  -7.529
   79    HB2  ARG  12           HB2      ARG  12   9.478 -17.006  -5.004
   80    HB3  ARG  12           HB1      ARG  12   9.592 -18.062  -6.424
   81    HG2  ARG  12           HG2      ARG  12  12.115 -17.181  -5.033
   82    HG3  ARG  12           HG1      ARG  12  11.107 -18.484  -4.321
   83    HD2  ARG  12           HD2      ARG  12  11.255 -19.749  -6.520
   84    HD3  ARG  12           HD1      ARG  12  12.396 -18.466  -7.117
   85    HE   ARG  12           HE       ARG  12  13.534 -19.200  -4.725
   86   HH11  ARG  12          HH11      ARG  12  12.240 -21.010  -7.509
   87   HH12  ARG  12          HH12      ARG  12  13.353 -22.329  -7.369
   88   HH21  ARG  12          HH21      ARG  12  15.055 -21.006  -4.538
   89   HH22  ARG  12          HH22      ARG  12  14.978 -22.326  -5.654
   90    H    HIS  13           HN       HIS  13   8.710 -14.746  -5.430
   91    HA   HIS  13           HA       HIS  13   6.580 -15.166  -7.279
   92    HB2  HIS  13           HB2      HIS  13   5.969 -14.693  -4.964
   93    HB3  HIS  13           HB1      HIS  13   6.960 -13.192  -4.961
   94    HD2  HIS  13           HD2      HIS  13   5.575 -10.917  -5.641
   95    HE1  HIS  13           HE1      HIS  13   2.127 -12.856  -7.138
   96    HE2  HIS  13           HE2      HIS  13   3.194 -10.624  -6.542
   97    H    ASP  14           HN       ASP  14   8.986 -12.550  -6.693
   98    HA   ASP  14           HA       ASP  14   7.791 -10.638  -8.337
   99    HB2  ASP  14           HB2      ASP  14   9.886 -10.324  -6.823
  100    HB3  ASP  14           HB1      ASP  14  10.821 -11.067  -8.160
  101    H    CYS  15           HN       CYS  15  10.323 -13.147  -9.162
  102    HA   CYS  15           HA       CYS  15  10.220 -12.390 -11.917
  103    HB2  CYS  15           HB2      CYS  15  11.226 -14.984 -10.585
  104    HB3  CYS  15           HB1      CYS  15  11.410 -14.612 -12.327
  105    H    PHE  16           HN       PHE  16   8.370 -14.494  -9.787
  106    HA   PHE  16           HA       PHE  16   7.356 -16.173 -11.785
  107    HB2  PHE  16           HB2      PHE  16   7.008 -16.591  -9.346
  108    HB3  PHE  16           HB1      PHE  16   5.933 -15.157  -9.280
  109    HD1  PHE  16           HD1      PHE  16   6.339 -18.191 -11.432
  110    HD2  PHE  16           HD2      PHE  16   3.754 -15.633  -9.228
  111    HE1  PHE  16           HE1      PHE  16   4.429 -19.610 -12.006
  112    HE2  PHE  16           HE2      PHE  16   1.851 -17.064  -9.811
  113    HZ   PHE  16           HZ       PHE  16   2.188 -19.051 -11.199
  114    H    THR  17           HN       THR  17   6.179 -13.033 -10.408
  115    HA   THR  17           HA       THR  17   3.893 -12.982 -12.064
  116    HB   THR  17           HB       THR  17   3.881 -10.520 -11.664
  117    HG1  THR  17           HG1      THR  17   6.451 -11.153 -10.709
  118   HG21  THR  17          HG21      THR  17   3.054 -10.906  -9.574
  119   HG22  THR  17          HG22      THR  17   4.654 -11.472  -8.963
  120   HG23  THR  17          HG23      THR  17   3.562 -12.617  -9.830
  121    H    LYS  18           HN       LYS  18   7.308 -11.907 -12.510
  122    HA   LYS  18           HA       LYS  18   6.808 -10.604 -14.950
  123    HB2  LYS  18           HB2      LYS  18   9.293 -11.853 -13.717
  124    HB3  LYS  18           HB1      LYS  18   9.322 -11.283 -15.421
  125    HG2  LYS  18           HG2      LYS  18  10.079  -9.683 -13.438
  126    HG3  LYS  18           HG1      LYS  18   9.162  -9.043 -14.842
  127    HD2  LYS  18           HD2      LYS  18   7.126  -8.922 -13.609
  128    HD3  LYS  18           HD1      LYS  18   7.728 -10.022 -12.329
  129    HE2  LYS  18           HE2      LYS  18   7.672  -7.687 -11.505
  130    HE3  LYS  18           HE1      LYS  18   9.387  -8.252 -11.626
  131    HZ1  LYS  18           HZ1      LYS  18   8.797  -7.187 -14.077
  132    HZ2  LYS  18           HZ2      LYS  18   9.715  -6.474 -12.840
  133    HZ3  LYS  18           HZ3      LYS  18   8.058  -6.128 -12.976
  134    H    TYR  19           HN       TYR  19   7.201 -13.970 -13.957
  135    HA   TYR  19           HA       TYR  19   7.687 -14.878 -16.618
  136    HB2  TYR  19           HB2      TYR  19   8.432 -16.452 -15.052
  137    HB3  TYR  19           HB1      TYR  19   7.047 -16.173 -13.956
  138    HD1  TYR  19           HD1      TYR  19   7.974 -17.616 -17.252
  139    HD2  TYR  19           HD2      TYR  19   5.260 -17.562 -13.996
  140    HE1  TYR  19           HE1      TYR  19   6.855 -19.588 -18.164
  141    HE2  TYR  19           HE2      TYR  19   4.143 -19.534 -14.908
  142    HH   TYR  19           HH       TYR  19   3.836 -20.652 -17.097
  143    H    LYS  20           HN       LYS  20   4.875 -14.803 -14.346
  144    HA   LYS  20           HA       LYS  20   3.092 -15.992 -16.114
  145    HB2  LYS  20           HB2      LYS  20   2.520 -13.754 -14.102
  146    HB3  LYS  20           HB1      LYS  20   1.304 -14.845 -14.835
  147    HG2  LYS  20           HG2      LYS  20   3.637 -15.783 -13.116
  148    HG3  LYS  20           HG1      LYS  20   1.993 -15.468 -12.505
  149    HD2  LYS  20           HD2      LYS  20   2.196 -17.301 -14.887
  150    HD3  LYS  20           HD1      LYS  20   2.870 -17.927 -13.344
  151    HE2  LYS  20           HE2      LYS  20   0.669 -17.477 -12.209
  152    HE3  LYS  20           HE1      LYS  20  -0.006 -16.873 -13.778
  153    HZ1  LYS  20           HZ1      LYS  20   1.163 -19.339 -14.274
  154    HZ2  LYS  20           HZ2      LYS  20  -0.487 -18.938 -14.245
  155    HZ3  LYS  20           HZ3      LYS  20   0.271 -19.515 -12.840
  156    H    SER  21           HN       SER  21   4.277 -12.647 -15.714
  157    HA   SER  21           HA       SER  21   2.408 -11.535 -17.542
  158    HB2  SER  21           HB2      SER  21   5.261 -10.614 -16.816
  159    HB3  SER  21           HB1      SER  21   4.097  -9.642 -17.805
  160    HG   SER  21           HG       SER  21   3.847 -10.512 -15.112
  161    H    CYS  22           HN       CYS  22   5.405 -13.409 -17.858
  162    HA   CYS  22           HA       CYS  22   5.878 -12.649 -20.557
  163    HB2  CYS  22           HB2      CYS  22   7.570 -13.786 -18.925
  164    HB3  CYS  22           HB1      CYS  22   6.675 -15.298 -19.274
  165    H    GLN  23           HN       GLN  23   4.044 -15.239 -18.875
  166    HA   GLN  23           HA       GLN  23   3.456 -16.612 -21.290
  167    HB2  GLN  23           HB2      GLN  23   2.171 -16.640 -18.502
  168    HB3  GLN  23           HB1      GLN  23   1.470 -17.570 -19.874
  169    HG2  GLN  23           HG2      GLN  23   3.865 -18.635 -20.139
  170    HG3  GLN  23           HG1      GLN  23   4.170 -17.975 -18.481
  171   HE21  GLN  23          HE21      GLN  23   2.341 -20.323 -20.408
  172   HE22  GLN  23          HE22      GLN  23   1.631 -21.178 -19.083
  173    H    MET  24           HN       MET  24   2.267 -13.712 -19.686
  174    HA   MET  24           HA       MET  24  -0.251 -13.825 -21.086
  175    HB2  MET  24           HB2      MET  24   1.118 -11.603 -19.490
  176    HB3  MET  24           HB1      MET  24  -0.497 -11.450 -20.250
  177    HG2  MET  24           HG2      MET  24   0.204 -13.616 -18.222
  178    HG3  MET  24           HG1      MET  24  -0.460 -12.025 -17.771
  179    HE1  MET  24           HE1      MET  24  -2.257 -15.701 -19.680
  180    HE2  MET  24           HE2      MET  24  -1.808 -15.629 -17.941
  181    HE3  MET  24           HE3      MET  24  -0.580 -15.264 -19.201
  182    H    SER  25           HN       SER  25   3.028 -12.916 -21.643
  183    HA   SER  25           HA       SER  25   2.468 -10.829 -23.477
  184    HB2  SER  25           HB2      SER  25   4.928 -12.671 -23.297
  185    HB3  SER  25           HB1      SER  25   4.820 -11.183 -24.323
  186    HG   SER  25           HG       SER  25   4.273 -11.111 -21.551
  187    H    ASP  26           HN       ASP  26   2.963 -11.027 -25.881
  188    HA   ASP  26           HA       ASP  26   1.557 -13.371 -26.820
  189    HB2  ASP  26           HB2      ASP  26   2.617 -10.867 -28.220
  190    HB3  ASP  26           HB1      ASP  26   1.848 -12.234 -29.100
  191    H    SER  27           HN       SER  27   4.499 -13.086 -25.702
  192    HA   SER  27           HA       SER  27   5.992 -13.853 -28.035
  193    HB2  SER  27           HB2      SER  27   6.767 -13.929 -25.052
  194    HB3  SER  27           HB1      SER  27   7.896 -14.257 -26.427
  195    HG   SER  27           HG       SER  27   8.191 -12.192 -26.066
  196    H    CYS  28           HN       CYS  28   3.751 -15.262 -25.937
  197    HA   CYS  28           HA       CYS  28   5.054 -17.845 -25.985
  198    HB2  CYS  28           HB2      CYS  28   3.635 -17.101 -23.995
  199    HB3  CYS  28           HB1      CYS  28   2.221 -17.097 -25.102
  200    H    HIS  29           HN       HIS  29   5.213 -17.926 -28.384
  201    HA   HIS  29           HA       HIS  29   2.661 -18.008 -29.750
  202    HB2  HIS  29           HB2      HIS  29   5.361 -18.821 -30.939
  203    HB3  HIS  29           HB1      HIS  29   3.898 -18.226 -31.812
  204    HD2  HIS  29           HD2      HIS  29   6.920 -16.792 -29.662
  205    HE1  HIS  29           HE1      HIS  29   4.932 -13.631 -31.647
  206    HE2  HIS  29           HE2      HIS  29   6.939 -14.293 -30.233
  207    H    ASP  30           HN       ASP  30   5.126 -20.155 -28.336
  208    HA   ASP  30           HA       ASP  30   3.337 -22.349 -29.001
  209    HB2  ASP  30           HB2      ASP  30   5.677 -22.088 -30.463
  210    HB3  ASP  30           HB1      ASP  30   6.276 -22.999 -29.031
  211    H    GLU  31           HN       GLU  31   4.280 -24.402 -27.672
  212    HA   GLU  31           HA       GLU  31   4.157 -23.569 -24.984
  213    HB2  GLU  31           HB2      GLU  31   5.019 -26.244 -26.231
  214    HB3  GLU  31           HB1      GLU  31   4.860 -25.977 -24.456
  215    HG2  GLU  31           HG2      GLU  31   2.427 -25.488 -24.692
  216    HG3  GLU  31           HG1      GLU  31   2.557 -25.647 -26.491
  217    H    GLN  32           HN       GLN  32   6.809 -24.454 -27.250
  218    HA   GLN  32           HA       GLN  32   8.819 -24.544 -25.292
  219    HB2  GLN  32           HB2      GLN  32   9.098 -25.332 -27.684
  220    HB3  GLN  32           HB1      GLN  32   9.067 -23.616 -28.193
  221    HG2  GLN  32           HG2      GLN  32  11.115 -23.129 -26.892
  222    HG3  GLN  32           HG1      GLN  32  11.132 -24.824 -26.258
  223   HE21  GLN  32          HE21      GLN  32  13.394 -24.234 -27.517
  224   HE22  GLN  32          HE22      GLN  32  13.465 -24.878 -29.121
  225    H    SER  33           HN       SER  33   7.374 -21.904 -27.262
  226    HA   SER  33           HA       SER  33   9.213 -19.951 -26.461
  227    HB2  SER  33           HB2      SER  33   6.232 -19.609 -27.146
  228    HB3  SER  33           HB1      SER  33   7.431 -18.265 -27.024
  229    HG   SER  33           HG       SER  33   8.495 -19.058 -28.750
  230    H    CYS  34           HN       CYS  34   6.120 -21.182 -25.021
  231    HA   CYS  34           HA       CYS  34   6.177 -19.257 -22.921
  232    HB2  CYS  34           HB2      CYS  34   4.555 -21.669 -23.613
  233    HB3  CYS  34           HB1      CYS  34   4.841 -21.487 -21.847
  234    H    HIS  35           HN       HIS  35   7.675 -22.436 -23.546
  235    HA   HIS  35           HA       HIS  35   8.352 -22.944 -20.849
  236    HB2  HIS  35           HB2      HIS  35   8.548 -24.750 -22.551
  237    HB3  HIS  35           HB1      HIS  35   9.783 -23.781 -23.431
  238    HD2  HIS  35           HD2      HIS  35  12.322 -24.506 -22.790
  239    HE1  HIS  35           HE1      HIS  35  11.482 -26.156 -18.990
  240    HE2  HIS  35           HE2      HIS  35  13.271 -25.724 -20.744
  241    H    GLN  36           HN       GLN  36   9.821 -21.058 -23.523
  242    HA   GLN  36           HA       GLN  36  12.286 -20.632 -22.274
  243    HB2  GLN  36           HB2      GLN  36  10.666 -18.833 -24.138
  244    HB3  GLN  36           HB1      GLN  36  12.332 -18.453 -23.605
  245    HG2  GLN  36           HG2      GLN  36  11.729 -21.146 -24.922
  246    HG3  GLN  36           HG1      GLN  36  11.971 -19.659 -25.923
  247   HE21  GLN  36          HE21      GLN  36  13.488 -21.962 -23.689
  248   HE22  GLN  36          HE22      GLN  36  15.109 -21.419 -23.905
  249    H    CYS  37           HN       CYS  37   9.082 -19.098 -21.953
  250    HA   CYS  37           HA       CYS  37   9.966 -16.924 -20.412
  251    HB2  CYS  37           HB2      CYS  37   7.310 -18.432 -20.409
  252    HB3  CYS  37           HB1      CYS  37   7.606 -16.960 -19.448
  253    H    HIS  38           HN       HIS  38   9.045 -20.267 -19.672
  254    HA   HIS  38           HA       HIS  38   9.149 -19.878 -16.868
  255    HB2  HIS  38           HB2      HIS  38   7.920 -21.808 -17.961
  256    HB3  HIS  38           HB1      HIS  38   9.525 -22.476 -18.437
  257    HD2  HIS  38           HD2      HIS  38  11.139 -23.361 -16.225
  258    HE1  HIS  38           HE1      HIS  38   7.831 -23.453 -13.585
  259    HE2  HIS  38           HE2      HIS  38  10.251 -24.160 -13.951
  260    H    VAL  39           HN       VAL  39  11.383 -20.905 -19.427
  261    HA   VAL  39           HA       VAL  39  13.426 -21.680 -17.647
  262    HB   VAL  39           HB       VAL  39  13.495 -20.641 -20.509
  263   HG11  VAL  39          HG11      VAL  39  15.692 -21.597 -18.594
  264   HG12  VAL  39          HG12      VAL  39  15.648 -20.106 -19.608
  265   HG13  VAL  39          HG13      VAL  39  15.871 -21.722 -20.384
  266   HG21  VAL  39          HG21      VAL  39  14.280 -23.331 -20.397
  267   HG22  VAL  39          HG22      VAL  39  12.637 -22.729 -20.835
  268   HG23  VAL  39          HG23      VAL  39  12.991 -23.237 -19.136
  269    H    LYS  40           HN       LYS  40  12.399 -18.563 -19.141
  270    HA   LYS  40           HA       LYS  40  14.714 -17.162 -18.300
  271    HB2  LYS  40           HB2      LYS  40  11.840 -16.216 -18.829
  272    HB3  LYS  40           HB1      LYS  40  13.177 -15.095 -18.390
  273    HG2  LYS  40           HG2      LYS  40  14.198 -15.253 -20.446
  274    HG3  LYS  40           HG1      LYS  40  13.737 -16.977 -20.672
  275    HD2  LYS  40           HD2      LYS  40  12.132 -16.282 -22.092
  276    HD3  LYS  40           HD1      LYS  40  11.272 -15.575 -20.686
  277    HE2  LYS  40           HE2      LYS  40  12.424 -13.398 -21.030
  278    HE3  LYS  40           HE1      LYS  40  13.384 -14.102 -22.396
  279    HZ1  LYS  40           HZ1      LYS  40  10.427 -14.169 -22.395
  280    HZ2  LYS  40           HZ2      LYS  40  11.513 -14.272 -23.697
  281    HZ3  LYS  40           HZ3      LYS  40  11.283 -12.791 -22.899
  282    H    HIS  41           HN       HIS  41  11.583 -18.043 -16.843
  283    HA   HIS  41           HA       HIS  41  11.881 -16.454 -14.554
  284    HB2  HIS  41           HB2      HIS  41   9.726 -17.529 -15.053
  285    HB3  HIS  41           HB1      HIS  41  10.483 -19.144 -14.954
  286    HD2  HIS  41           HD2      HIS  41   9.367 -16.206 -12.503
  287    HE1  HIS  41           HE1      HIS  41  10.064 -19.731 -10.305
  288    HE2  HIS  41           HE2      HIS  41   9.217 -17.340 -10.219
  289    H    THR  42           HN       THR  42  12.922 -19.767 -15.463
  290    HA   THR  42           HA       THR  42  13.859 -20.471 -12.945
  291    HB   THR  42           HB       THR  42  14.829 -21.272 -15.738
  292    HG1  THR  42           HG1      THR  42  12.677 -21.818 -15.002
  293   HG21  THR  42          HG21      THR  42  15.738 -21.994 -12.941
  294   HG22  THR  42          HG22      THR  42  16.679 -21.864 -14.472
  295   HG23  THR  42          HG23      THR  42  15.645 -23.308 -14.168
  296    H    ASP  43           HN       ASP  43  15.475 -18.797 -15.746
  297    HA   ASP  43           HA       ASP  43  17.954 -18.606 -14.349
  298    HB2  ASP  43           HB2      ASP  43  16.824 -17.041 -16.737
  299    HB3  ASP  43           HB1      ASP  43  18.481 -16.771 -16.079
  300    H    CYS  44           HN       CYS  44  15.000 -16.629 -14.573
  301    HA   CYS  44           HA       CYS  44  16.137 -14.285 -13.465
  302    HB2  CYS  44           HB2      CYS  44  13.833 -14.442 -14.664
  303    HB3  CYS  44           HB1      CYS  44  13.228 -15.211 -13.162
  304    H    VAL  45           HN       VAL  45  14.647 -17.238 -12.226
  305    HA   VAL  45           HA       VAL  45  14.631 -16.251  -9.568
  306    HB   VAL  45           HB       VAL  45  14.063 -18.844 -10.949
  307   HG11  VAL  45          HG11      VAL  45  14.864 -18.538  -7.980
  308   HG12  VAL  45          HG12      VAL  45  15.648 -19.590  -9.229
  309   HG13  VAL  45          HG13      VAL  45  13.979 -19.962  -8.642
  310   HG21  VAL  45          HG21      VAL  45  12.683 -17.036  -8.872
  311   HG22  VAL  45          HG22      VAL  45  12.025 -18.632  -9.396
  312   HG23  VAL  45          HG23      VAL  45  12.220 -17.296 -10.597
  313    H    ASN  46           HN       ASN  46  16.730 -18.244 -11.616
  314    HA   ASN  46           HA       ASN  46  18.379 -19.118  -9.536
  315    HB2  ASN  46           HB2      ASN  46  18.748 -18.698 -12.508
  316    HB3  ASN  46           HB1      ASN  46  20.151 -19.128 -11.474
  317   HD21  ASN  46          HD21      ASN  46  18.556 -20.588 -13.658
  318   HD22  ASN  46          HD22      ASN  46  18.177 -22.118 -12.957
  319    H    THR  47           HN       THR  47  18.241 -16.047 -11.346
  320    HA   THR  47           HA       THR  47  20.774 -15.292 -10.110
  321    HB   THR  47           HB       THR  47  18.968 -13.713 -11.999
  322    HG1  THR  47           HG1      THR  47  19.926 -15.485 -12.982
  323   HG21  THR  47          HG21      THR  47  21.213 -12.374 -12.214
  324   HG22  THR  47          HG22      THR  47  21.689 -13.187 -10.676
  325   HG23  THR  47          HG23      THR  47  20.231 -12.126 -10.722
  326    H    GLY  48           HN       GLY  48  17.283 -14.366 -10.183
  327    HA2  GLY  48           HA2      GLY  48  17.710 -12.229  -8.358
  328    HA3  GLY  48           HA1      GLY  48  16.137 -13.003  -8.830
  329    H    CYS  49           HN       CYS  49  16.770 -15.729  -8.008
  330    HA   CYS  49           HA       CYS  49  17.427 -15.449  -5.195
  331    HB2  CYS  49           HB2      CYS  49  15.214 -16.957  -4.827
  332    HB3  CYS  49           HB1      CYS  49  15.186 -15.178  -4.665
  333    HA   PRO  50           HA       PRO  50  19.005 -19.135  -7.597
  334    HB2  PRO  50           HB2      PRO  50  21.166 -19.160  -5.671
  335    HB3  PRO  50           HB1      PRO  50  21.247 -18.640  -7.408
  336    HG2  PRO  50           HG2      PRO  50  20.932 -16.966  -4.898
  337    HG3  PRO  50           HG1      PRO  50  21.673 -16.531  -6.494
  338    HD2  PRO  50           HD2      PRO  50  19.236 -15.572  -5.744
  339    HD3  PRO  50           HD1      PRO  50  19.594 -15.992  -7.462
  Start of MODEL    6
    1    H1   SER   1           HT1      SER   1  11.934 -29.209   6.134
    2    H2   SER   1           HT2      SER   1  10.892 -29.940   5.008
    3    H3   SER   1           HT3      SER   1  11.125 -30.650   6.533
    4    HA   SER   1           HA       SER   1   9.278 -28.683   5.736
    5    HB2  SER   1           HB2      SER   1   8.933 -30.812   7.189
    6    HB3  SER   1           HB1      SER   1   9.702 -29.877   8.534
    7    HG   SER   1           HG       SER   1   8.068 -28.436   8.463
    8    H    SER   2           HN       SER   2  11.274 -26.990   5.506
    9    HA   SER   2           HA       SER   2  11.149 -25.478   8.009
   10    HB2  SER   2           HB2      SER   2  13.634 -25.785   6.209
   11    HB3  SER   2           HB1      SER   2  13.499 -24.650   7.612
   12    HG   SER   2           HG       SER   2  12.761 -27.138   8.318
   13    H    THR   3           HN       THR   3  11.095 -23.150   7.685
   14    HA   THR   3           HA       THR   3   9.990 -22.521   5.125
   15    HB   THR   3           HB       THR   3  10.740 -20.661   7.427
   16    HG1  THR   3           HG1      THR   3   8.181 -20.881   7.221
   17   HG21  THR   3          HG21      THR   3   9.186 -19.078   6.295
   18   HG22  THR   3          HG22      THR   3   8.894 -20.286   4.988
   19   HG23  THR   3          HG23      THR   3  10.528 -19.552   5.189
   20    HA   PRO   4           HA       PRO   4  13.898 -21.609   3.328
   21    HB2  PRO   4           HB2      PRO   4  12.927 -20.114   1.182
   22    HB3  PRO   4           HB1      PRO   4  12.961 -21.927   1.232
   23    HG2  PRO   4           HG2      PRO   4  10.660 -20.011   1.809
   24    HG3  PRO   4           HG1      PRO   4  10.647 -21.603   0.944
   25    HD2  PRO   4           HD2      PRO   4   9.798 -21.330   3.544
   26    HD3  PRO   4           HD1      PRO   4  10.603 -22.834   2.938
   27    H    ASP   5           HN       ASP   5  11.634 -18.805   2.957
   28    HA   ASP   5           HA       ASP   5  13.234 -17.249   4.675
   29    HB2  ASP   5           HB2      ASP   5  14.467 -17.290   2.339
   30    HB3  ASP   5           HB1      ASP   5  13.096 -16.266   1.810
   31    H    GLY   6           HN       GLY   6  12.201 -14.968   2.648
   32    HA2  GLY   6           HA2      GLY   6   9.407 -15.207   2.792
   33    HA3  GLY   6           HA1      GLY   6  10.088 -14.140   4.102
   34    H    THR   7           HN       THR   7  12.449 -13.363   2.440
   35    HA   THR   7           HA       THR   7  10.990 -11.429   0.774
   36    HB   THR   7           HB       THR   7  13.880 -11.477   1.787
   37    HG1  THR   7           HG1      THR   7  12.509  -9.272   2.311
   38   HG21  THR   7          HG21      THR   7  14.001 -10.514  -0.406
   39   HG22  THR   7          HG22      THR   7  13.843  -9.095   0.697
   40   HG23  THR   7          HG23      THR   7  12.409  -9.684  -0.226
   41    H    TRP   8           HN       TRP   8  13.367 -14.029   0.853
   42    HA   TRP   8           HA       TRP   8  14.313 -13.741  -1.736
   43    HB2  TRP   8           HB2      TRP   8  15.599 -15.357  -0.710
   44    HB3  TRP   8           HB1      TRP   8  14.281 -15.834   0.376
   45    HD1  TRP   8           HD1      TRP   8  15.949 -16.881  -2.911
   46    HE1  TRP   8           HE1      TRP   8  14.857 -19.038  -3.707
   47    HE3  TRP   8           HE3      TRP   8  12.054 -17.067   0.336
   48    HZ2  TRP   8           HZ2      TRP   8  12.627 -20.602  -3.031
   49    HZ3  TRP   8           HZ3      TRP   8  10.473 -18.926   0.202
   50    HH2  TRP   8           HH2      TRP   8  10.761 -20.679  -1.475
   51    H    VAL   9           HN       VAL   9  11.367 -15.267  -0.349
   52    HA   VAL   9           HA       VAL   9  10.647 -16.561  -2.768
   53    HB   VAL   9           HB       VAL   9   9.712 -17.187  -0.517
   54   HG11  VAL   9          HG11      VAL   9   8.352 -15.718   0.697
   55   HG12  VAL   9          HG12      VAL   9   7.802 -14.834  -0.775
   56   HG13  VAL   9          HG13      VAL   9   9.442 -14.526  -0.100
   57   HG21  VAL   9          HG21      VAL   9   8.667 -17.853  -2.685
   58   HG22  VAL   9          HG22      VAL   9   7.702 -16.317  -2.685
   59   HG23  VAL   9          HG23      VAL   9   7.428 -17.564  -1.405
   60    H    LYS  10           HN       LYS  10  10.380 -13.256  -1.532
   61    HA   LYS  10           HA       LYS  10   8.196 -12.507  -3.142
   62    HB2  LYS  10           HB2      LYS  10  10.588 -10.847  -2.135
   63    HB3  LYS  10           HB1      LYS  10   9.181 -10.142  -3.004
   64    HG2  LYS  10           HG2      LYS  10   7.650 -10.957  -1.211
   65    HG3  LYS  10           HG1      LYS  10   9.048 -11.674  -0.340
   66    HD2  LYS  10           HD2      LYS  10  10.069  -9.401  -0.108
   67    HD3  LYS  10           HD1      LYS  10   8.676  -8.682  -0.986
   68    HE2  LYS  10           HE2      LYS  10   7.124  -9.455   0.830
   69    HE3  LYS  10           HE1      LYS  10   8.524 -10.193   1.712
   70    HZ1  LYS  10           HZ1      LYS  10   7.620  -7.525   1.691
   71    HZ2  LYS  10           HZ2      LYS  10   9.210  -7.573   1.096
   72    HZ3  LYS  10           HZ3      LYS  10   8.851  -8.243   2.614
   73    H    CYS  11           HN       CYS  11  11.579 -13.241  -3.773
   74    HA   CYS  11           HA       CYS  11  11.659 -11.833  -6.245
   75    HB2  CYS  11           HB2      CYS  11  13.864 -12.243  -5.509
   76    HB3  CYS  11           HB1      CYS  11  13.424 -13.825  -4.825
   77    H    ARG  12           HN       ARG  12  11.016 -15.167  -5.085
   78    HA   ARG  12           HA       ARG  12  10.812 -16.363  -7.550
   79    HB2  ARG  12           HB2      ARG  12   9.127 -16.850  -5.043
   80    HB3  ARG  12           HB1      ARG  12   9.236 -17.948  -6.432
   81    HG2  ARG  12           HG2      ARG  12  11.761 -17.117  -5.014
   82    HG3  ARG  12           HG1      ARG  12  10.691 -18.356  -4.280
   83    HD2  ARG  12           HD2      ARG  12  10.831 -19.697  -6.438
   84    HD3  ARG  12           HD1      ARG  12  12.037 -18.481  -7.046
   85    HE   ARG  12           HE       ARG  12  13.088 -19.184  -4.607
   86   HH11  ARG  12          HH11      ARG  12  11.789 -21.025  -7.367
   87   HH12  ARG  12          HH12      ARG  12  12.844 -22.382  -7.160
   88   HH21  ARG  12          HH21      ARG  12  14.530 -21.043  -4.326
   89   HH22  ARG  12          HH22      ARG  12  14.426 -22.392  -5.406
   90    H    HIS  13           HN       HIS  13   8.458 -14.570  -5.542
   91    HA   HIS  13           HA       HIS  13   6.348 -14.964  -7.419
   92    HB2  HIS  13           HB2      HIS  13   5.708 -14.417  -5.130
   93    HB3  HIS  13           HB1      HIS  13   6.754 -12.953  -5.138
   94    HD2  HIS  13           HD2      HIS  13   5.469 -10.643  -5.890
   95    HE1  HIS  13           HE1      HIS  13   1.982 -12.485  -7.420
   96    HE2  HIS  13           HE2      HIS  13   3.118 -10.281  -6.846
   97    H    ASP  14           HN       ASP  14   8.834 -12.417  -6.850
   98    HA   ASP  14           HA       ASP  14   7.728 -10.508  -8.559
   99    HB2  ASP  14           HB2      ASP  14   9.827 -10.261  -7.007
  100    HB3  ASP  14           HB1      ASP  14  10.742 -11.002  -8.359
  101    H    CYS  15           HN       CYS  15  10.194 -13.117  -9.279
  102    HA   CYS  15           HA       CYS  15  10.175 -12.416 -12.050
  103    HB2  CYS  15           HB2      CYS  15  11.054 -15.019 -10.648
  104    HB3  CYS  15           HB1      CYS  15  11.288 -14.688 -12.393
  105    H    PHE  16           HN       PHE  16   8.205 -14.414  -9.924
  106    HA   PHE  16           HA       PHE  16   7.172 -16.090 -11.912
  107    HB2  PHE  16           HB2      PHE  16   6.754 -16.455  -9.480
  108    HB3  PHE  16           HB1      PHE  16   5.740 -14.976  -9.454
  109    HD1  PHE  16           HD1      PHE  16   6.055 -18.048 -11.565
  110    HD2  PHE  16           HD2      PHE  16   3.542 -15.366  -9.430
  111    HE1  PHE  16           HE1      PHE  16   4.098 -19.394 -12.157
  112    HE2  PHE  16           HE2      PHE  16   1.591 -16.722 -10.030
  113    HZ   PHE  16           HZ       PHE  16   1.869 -18.735 -11.393
  114    H    THR  17           HN       THR  17   6.078 -12.884 -10.619
  115    HA   THR  17           HA       THR  17   3.833 -12.785 -12.329
  116    HB   THR  17           HB       THR  17   3.887 -10.321 -11.964
  117    HG1  THR  17           HG1      THR  17   6.415 -11.010 -10.927
  118   HG21  THR  17          HG21      THR  17   4.586 -11.249  -9.235
  119   HG22  THR  17          HG22      THR  17   3.475 -12.375 -10.101
  120   HG23  THR  17          HG23      THR  17   3.016 -10.643  -9.881
  121    H    LYS  18           HN       LYS  18   7.291 -11.824 -12.712
  122    HA   LYS  18           HA       LYS  18   6.892 -10.541 -15.179
  123    HB2  LYS  18           HB2      LYS  18   9.299 -11.873 -13.881
  124    HB3  LYS  18           HB1      LYS  18   9.385 -11.320 -15.588
  125    HG2  LYS  18           HG2      LYS  18  10.186  -9.727 -13.642
  126    HG3  LYS  18           HG1      LYS  18   9.263  -9.061 -15.030
  127    HD2  LYS  18           HD2      LYS  18   7.304  -8.772 -13.765
  128    HD3  LYS  18           HD1      LYS  18   7.766 -10.017 -12.564
  129    HE2  LYS  18           HE2      LYS  18   9.491  -8.518 -11.617
  130    HE3  LYS  18           HE1      LYS  18   9.121  -7.270 -12.874
  131    HZ1  LYS  18           HZ1      LYS  18   6.804  -8.188 -11.446
  132    HZ2  LYS  18           HZ2      LYS  18   7.362  -6.612 -11.753
  133    HZ3  LYS  18           HZ3      LYS  18   7.976  -7.489 -10.433
  134    H    TYR  19           HN       TYR  19   7.142 -13.909 -14.142
  135    HA   TYR  19           HA       TYR  19   7.651 -14.864 -16.783
  136    HB2  TYR  19           HB2      TYR  19   8.313 -16.445 -15.195
  137    HB3  TYR  19           HB1      TYR  19   6.928 -16.102 -14.119
  138    HD1  TYR  19           HD1      TYR  19   7.807 -17.590 -17.412
  139    HD2  TYR  19           HD2      TYR  19   5.126 -17.461 -14.130
  140    HE1  TYR  19           HE1      TYR  19   6.633 -19.539 -18.308
  141    HE2  TYR  19           HE2      TYR  19   3.952 -19.410 -15.026
  142    HH   TYR  19           HH       TYR  19   4.301 -20.539 -18.139
  143    H    LYS  20           HN       LYS  20   4.803 -14.688 -14.569
  144    HA   LYS  20           HA       LYS  20   3.027 -15.842 -16.361
  145    HB2  LYS  20           HB2      LYS  20   2.475 -13.568 -14.383
  146    HB3  LYS  20           HB1      LYS  20   1.245 -14.632 -15.131
  147    HG2  LYS  20           HG2      LYS  20   3.515 -15.628 -13.363
  148    HG3  LYS  20           HG1      LYS  20   1.878 -15.242 -12.774
  149    HD2  LYS  20           HD2      LYS  20   2.055 -17.117 -15.130
  150    HD3  LYS  20           HD1      LYS  20   2.658 -17.744 -13.557
  151    HE2  LYS  20           HE2      LYS  20   0.440 -17.140 -12.500
  152    HE3  LYS  20           HE1      LYS  20  -0.159 -16.600 -14.122
  153    HZ1  LYS  20           HZ1      LYS  20   0.950 -19.130 -14.430
  154    HZ2  LYS  20           HZ2      LYS  20  -0.681 -18.670 -14.515
  155    HZ3  LYS  20           HZ3      LYS  20  -0.022 -19.192 -13.040
  156    H    SER  21           HN       SER  21   4.285 -12.520 -15.963
  157    HA   SER  21           HA       SER  21   2.482 -11.404 -17.867
  158    HB2  SER  21           HB2      SER  21   5.299 -10.475 -17.020
  159    HB3  SER  21           HB1      SER  21   4.167  -9.505 -18.048
  160    HG   SER  21           HG       SER  21   3.851 -10.366 -15.362
  161    H    CYS  22           HN       CYS  22   5.471 -13.300 -18.047
  162    HA   CYS  22           HA       CYS  22   6.094 -12.525 -20.710
  163    HB2  CYS  22           HB2      CYS  22   7.709 -13.679 -19.043
  164    HB3  CYS  22           HB1      CYS  22   6.788 -15.179 -19.369
  165    H    GLN  23           HN       GLN  23   4.170 -15.132 -19.163
  166    HA   GLN  23           HA       GLN  23   3.686 -16.439 -21.640
  167    HB2  GLN  23           HB2      GLN  23   2.232 -16.539 -18.935
  168    HB3  GLN  23           HB1      GLN  23   1.700 -17.498 -20.361
  169    HG2  GLN  23           HG2      GLN  23   4.257 -18.335 -20.385
  170    HG3  GLN  23           HG1      GLN  23   4.199 -17.822 -18.649
  171   HE21  GLN  23          HE21      GLN  23   1.518 -18.334 -17.977
  172   HE22  GLN  23          HE22      GLN  23   1.213 -20.035 -18.055
  173    H    MET  24           HN       MET  24   2.420 -13.595 -19.995
  174    HA   MET  24           HA       MET  24  -0.042 -13.676 -21.492
  175    HB2  MET  24           HB2      MET  24   1.260 -11.502 -19.780
  176    HB3  MET  24           HB1      MET  24  -0.319 -11.320 -20.605
  177    HG2  MET  24           HG2      MET  24   0.286 -13.548 -18.617
  178    HG3  MET  24           HG1      MET  24  -0.394 -11.972 -18.149
  179    HE1  MET  24           HE1      MET  24  -2.399 -15.714 -19.337
  180    HE2  MET  24           HE2      MET  24  -0.754 -15.304 -18.740
  181    HE3  MET  24           HE3      MET  24  -1.103 -15.272 -20.503
  182    H    SER  25           HN       SER  25   3.249 -12.755 -21.915
  183    HA   SER  25           HA       SER  25   2.750 -10.615 -23.707
  184    HB2  SER  25           HB2      SER  25   5.204 -12.461 -23.488
  185    HB3  SER  25           HB1      SER  25   5.130 -10.950 -24.481
  186    HG   SER  25           HG       SER  25   4.496 -10.951 -21.726
  187    H    ASP  26           HN       ASP  26   3.367 -10.762 -26.102
  188    HA   ASP  26           HA       ASP  26   1.953 -13.046 -27.158
  189    HB2  ASP  26           HB2      ASP  26   3.172 -10.559 -28.457
  190    HB3  ASP  26           HB1      ASP  26   2.405 -11.885 -29.399
  191    H    SER  27           HN       SER  27   4.850 -12.862 -25.887
  192    HA   SER  27           HA       SER  27   6.434 -13.659 -28.148
  193    HB2  SER  27           HB2      SER  27   7.047 -13.799 -25.130
  194    HB3  SER  27           HB1      SER  27   8.234 -14.153 -26.449
  195    HG   SER  27           HG       SER  27   8.530 -12.082 -25.886
  196    H    CYS  28           HN       CYS  28   4.040 -15.010 -26.186
  197    HA   CYS  28           HA       CYS  28   5.249 -17.637 -26.209
  198    HB2  CYS  28           HB2      CYS  28   3.762 -16.862 -24.280
  199    HB3  CYS  28           HB1      CYS  28   2.406 -16.800 -25.454
  200    H    HIS  29           HN       HIS  29   5.522 -17.694 -28.597
  201    HA   HIS  29           HA       HIS  29   3.053 -17.641 -30.098
  202    HB2  HIS  29           HB2      HIS  29   5.765 -18.609 -31.133
  203    HB3  HIS  29           HB1      HIS  29   4.390 -17.934 -32.089
  204    HD2  HIS  29           HD2      HIS  29   7.329 -16.657 -29.725
  205    HE1  HIS  29           HE1      HIS  29   5.686 -13.411 -31.881
  206    HE2  HIS  29           HE2      HIS  29   7.534 -14.169 -30.307
  207    H    ASP  30           HN       ASP  30   5.277 -19.930 -28.532
  208    HA   ASP  30           HA       ASP  30   3.403 -22.010 -29.306
  209    HB2  ASP  30           HB2      ASP  30   5.834 -21.884 -30.650
  210    HB3  ASP  30           HB1      ASP  30   6.285 -22.861 -29.208
  211    H    GLU  31           HN       GLU  31   4.159 -24.121 -27.945
  212    HA   GLU  31           HA       GLU  31   3.968 -23.290 -25.261
  213    HB2  GLU  31           HB2      GLU  31   4.736 -26.006 -26.481
  214    HB3  GLU  31           HB1      GLU  31   4.511 -25.735 -24.714
  215    HG2  GLU  31           HG2      GLU  31   2.123 -25.115 -25.055
  216    HG3  GLU  31           HG1      GLU  31   2.325 -25.266 -26.848
  217    H    GLN  32           HN       GLN  32   6.661 -24.314 -27.412
  218    HA   GLN  32           HA       GLN  32   8.577 -24.528 -25.375
  219    HB2  GLN  32           HB2      GLN  32   8.914 -25.309 -27.761
  220    HB3  GLN  32           HB1      GLN  32   8.998 -23.591 -28.255
  221    HG2  GLN  32           HG2      GLN  32  11.012 -23.226 -26.861
  222    HG3  GLN  32           HG1      GLN  32  10.912 -24.925 -26.250
  223   HE21  GLN  32          HE21      GLN  32  13.252 -24.442 -27.408
  224   HE22  GLN  32          HE22      GLN  32  13.356 -25.072 -29.016
  225    H    SER  33           HN       SER  33   7.364 -21.794 -27.377
  226    HA   SER  33           HA       SER  33   9.271 -19.952 -26.478
  227    HB2  SER  33           HB2      SER  33   6.344 -19.443 -27.283
  228    HB3  SER  33           HB1      SER  33   7.604 -18.165 -27.091
  229    HG   SER  33           HG       SER  33   8.710 -19.010 -28.774
  230    H    CYS  34           HN       CYS  34   6.058 -21.024 -25.179
  231    HA   CYS  34           HA       CYS  34   6.126 -19.124 -23.059
  232    HB2  CYS  34           HB2      CYS  34   4.436 -21.483 -23.810
  233    HB3  CYS  34           HB1      CYS  34   4.637 -21.264 -22.037
  234    H    HIS  35           HN       HIS  35   7.471 -22.384 -23.640
  235    HA   HIS  35           HA       HIS  35   8.033 -22.920 -20.921
  236    HB2  HIS  35           HB2      HIS  35   8.183 -24.741 -22.610
  237    HB3  HIS  35           HB1      HIS  35   9.495 -23.845 -23.456
  238    HD2  HIS  35           HD2      HIS  35  11.969 -24.705 -22.735
  239    HE1  HIS  35           HE1      HIS  35  10.927 -26.288 -18.956
  240    HE2  HIS  35           HE2      HIS  35  12.788 -25.962 -20.656
  241    H    GLN  36           HN       GLN  36   9.694 -21.129 -23.551
  242    HA   GLN  36           HA       GLN  36  12.138 -20.839 -22.227
  243    HB2  GLN  36           HB2      GLN  36  10.679 -18.957 -24.140
  244    HB3  GLN  36           HB1      GLN  36  12.343 -18.664 -23.552
  245    HG2  GLN  36           HG2      GLN  36  11.638 -21.320 -24.894
  246    HG3  GLN  36           HG1      GLN  36  12.007 -19.847 -25.879
  247   HE21  GLN  36          HE21      GLN  36  13.297 -22.261 -23.626
  248   HE22  GLN  36          HE22      GLN  36  14.954 -21.806 -23.766
  249    H    CYS  37           HN       CYS  37   9.020 -19.123 -22.006
  250    HA   CYS  37           HA       CYS  37   9.979 -16.999 -20.439
  251    HB2  CYS  37           HB2      CYS  37   7.245 -18.362 -20.511
  252    HB3  CYS  37           HB1      CYS  37   7.592 -16.910 -19.538
  253    H    HIS  38           HN       HIS  38   8.864 -20.291 -19.720
  254    HA   HIS  38           HA       HIS  38   8.912 -19.903 -16.913
  255    HB2  HIS  38           HB2      HIS  38   7.613 -21.771 -18.034
  256    HB3  HIS  38           HB1      HIS  38   9.193 -22.522 -18.471
  257    HD2  HIS  38           HD2      HIS  38  10.709 -23.476 -16.214
  258    HE1  HIS  38           HE1      HIS  38   7.330 -23.421 -13.665
  259    HE2  HIS  38           HE2      HIS  38   9.725 -24.234 -13.966
  260    H    VAL  39           HN       VAL  39  11.157 -21.054 -19.410
  261    HA   VAL  39           HA       VAL  39  13.110 -21.924 -17.572
  262    HB   VAL  39           HB       VAL  39  13.305 -20.918 -20.441
  263   HG11  VAL  39          HG11      VAL  39  15.461 -20.490 -19.489
  264   HG12  VAL  39          HG12      VAL  39  15.616 -22.122 -20.248
  265   HG13  VAL  39          HG13      VAL  39  15.400 -21.972 -18.462
  266   HG21  VAL  39          HG21      VAL  39  12.669 -23.486 -19.048
  267   HG22  VAL  39          HG22      VAL  39  13.935 -23.632 -20.330
  268   HG23  VAL  39          HG23      VAL  39  12.314 -22.956 -20.738
  269    H    LYS  40           HN       LYS  40  12.285 -18.774 -19.116
  270    HA   LYS  40           HA       LYS  40  14.648 -17.488 -18.227
  271    HB2  LYS  40           HB2      LYS  40  11.850 -16.427 -18.904
  272    HB3  LYS  40           HB1      LYS  40  13.184 -15.348 -18.361
  273    HG2  LYS  40           HG2      LYS  40  14.272 -15.442 -20.367
  274    HG3  LYS  40           HG1      LYS  40  13.945 -17.197 -20.583
  275    HD2  LYS  40           HD2      LYS  40  12.109 -16.815 -21.868
  276    HD3  LYS  40           HD1      LYS  40  11.488 -15.536 -20.772
  277    HE2  LYS  40           HE2      LYS  40  11.958 -14.518 -22.950
  278    HE3  LYS  40           HE1      LYS  40  13.228 -13.942 -21.795
  279    HZ1  LYS  40           HZ1      LYS  40  13.442 -15.640 -24.122
  280    HZ2  LYS  40           HZ2      LYS  40  14.318 -16.184 -22.772
  281    HZ3  LYS  40           HZ3      LYS  40  14.583 -14.623 -23.384
  282    H    HIS  41           HN       HIS  41  11.436 -18.193 -16.854
  283    HA   HIS  41           HA       HIS  41  11.742 -16.585 -14.579
  284    HB2  HIS  41           HB2      HIS  41   9.556 -17.566 -15.118
  285    HB3  HIS  41           HB1      HIS  41  10.232 -19.212 -14.985
  286    HD2  HIS  41           HD2      HIS  41   9.193 -16.203 -12.589
  287    HE1  HIS  41           HE1      HIS  41   9.674 -19.734 -10.343
  288    HE2  HIS  41           HE2      HIS  41   8.935 -17.306 -10.299
  289    H    THR  42           HN       THR  42  12.654 -19.954 -15.410
  290    HA   THR  42           HA       THR  42  13.487 -20.659 -12.856
  291    HB   THR  42           HB       THR  42  14.501 -21.548 -15.607
  292    HG1  THR  42           HG1      THR  42  12.305 -21.980 -14.935
  293   HG21  THR  42          HG21      THR  42  16.277 -22.221 -14.286
  294   HG22  THR  42          HG22      THR  42  15.158 -23.597 -13.969
  295   HG23  THR  42          HG23      THR  42  15.298 -22.254 -12.776
  296    H    ASP  43           HN       ASP  43  15.257 -19.105 -15.633
  297    HA   ASP  43           HA       ASP  43  17.701 -19.004 -14.164
  298    HB2  ASP  43           HB2      ASP  43  16.718 -17.430 -16.610
  299    HB3  ASP  43           HB1      ASP  43  18.366 -17.230 -15.909
  300    H    CYS  44           HN       CYS  44  14.845 -16.906 -14.507
  301    HA   CYS  44           HA       CYS  44  16.051 -14.590 -13.413
  302    HB2  CYS  44           HB2      CYS  44  13.771 -14.678 -14.670
  303    HB3  CYS  44           HB1      CYS  44  13.097 -15.383 -13.166
  304    H    VAL  45           HN       VAL  45  14.406 -17.453 -12.157
  305    HA   VAL  45           HA       VAL  45  14.366 -16.409  -9.520
  306    HB   VAL  45           HB       VAL  45  13.719 -19.004 -10.862
  307   HG11  VAL  45          HG11      VAL  45  14.453 -18.665  -7.879
  308   HG12  VAL  45          HG12      VAL  45  15.218 -19.782  -9.082
  309   HG13  VAL  45          HG13      VAL  45  13.521 -20.062  -8.533
  310   HG21  VAL  45          HG21      VAL  45  12.366 -17.087  -8.869
  311   HG22  VAL  45          HG22      VAL  45  11.653 -18.667  -9.368
  312   HG23  VAL  45          HG23      VAL  45  11.936 -17.374 -10.600
  313    H    ASN  46           HN       ASN  46  16.420 -18.541 -11.474
  314    HA   ASN  46           HA       ASN  46  17.978 -19.438  -9.333
  315    HB2  ASN  46           HB2      ASN  46  18.439 -19.108 -12.303
  316    HB3  ASN  46           HB1      ASN  46  19.789 -19.586 -11.223
  317   HD21  ASN  46          HD21      ASN  46  18.196 -21.017 -13.417
  318   HD22  ASN  46          HD22      ASN  46  17.713 -22.506 -12.694
  319    H    THR  47           HN       THR  47  18.025 -16.414 -11.223
  320    HA   THR  47           HA       THR  47  20.566 -15.745  -9.952
  321    HB   THR  47           HB       THR  47  18.873 -14.128 -11.913
  322    HG1  THR  47           HG1      THR  47  19.744 -15.955 -12.854
  323   HG21  THR  47          HG21      THR  47  20.198 -12.582 -10.643
  324   HG22  THR  47          HG22      THR  47  21.179 -12.905 -12.123
  325   HG23  THR  47          HG23      THR  47  21.602 -13.713 -10.566
  326    H    GLY  48           HN       GLY  48  17.124 -14.663 -10.116
  327    HA2  GLY  48           HA2      GLY  48  17.617 -12.502  -8.336
  328    HA3  GLY  48           HA1      GLY  48  16.018 -13.213  -8.821
  329    H    CYS  49           HN       CYS  49  16.511 -15.945  -7.923
  330    HA   CYS  49           HA       CYS  49  17.125 -15.629  -5.106
  331    HB2  CYS  49           HB2      CYS  49  14.840 -17.024  -4.744
  332    HB3  CYS  49           HB1      CYS  49  14.887 -15.242  -4.630
  333    HA   PRO  50           HA       PRO  50  18.576 -19.441  -7.390
  334    HB2  PRO  50           HB2      PRO  50  20.706 -19.520  -5.435
  335    HB3  PRO  50           HB1      PRO  50  20.833 -19.036  -7.180
  336    HG2  PRO  50           HG2      PRO  50  20.553 -17.304  -4.704
  337    HG3  PRO  50           HG1      PRO  50  21.342 -16.934  -6.292
  338    HD2  PRO  50           HD2      PRO  50  18.939 -15.851  -5.608
  339    HD3  PRO  50           HD1      PRO  50  19.308 -16.319  -7.311
  Start of MODEL    7
    1    H1   SER   1           HT1      SER   1  10.635 -29.518   5.011
    2    H2   SER   1           HT2      SER   1  11.117 -30.601   6.229
    3    H3   SER   1           HT3      SER   1  11.914 -29.110   6.054
    4    HA   SER   1           HA       SER   1   9.152 -28.699   6.367
    5    HB2  SER   1           HB2      SER   1   9.432 -30.951   7.633
    6    HB3  SER   1           HB1      SER   1  10.520 -30.049   8.764
    7    HG   SER   1           HG       SER   1   8.854 -28.787   9.361
    8    H    SER   2           HN       SER   2  10.818 -26.792   5.712
    9    HA   SER   2           HA       SER   2  11.097 -25.314   8.168
   10    HB2  SER   2           HB2      SER   2  13.383 -26.422   7.977
   11    HB3  SER   2           HB1      SER   2  13.530 -25.725   6.314
   12    HG   SER   2           HG       SER   2  13.706 -23.764   7.130
   13    H    THR   3           HN       THR   3  11.013 -23.026   7.752
   14    HA   THR   3           HA       THR   3   9.953 -22.472   5.155
   15    HB   THR   3           HB       THR   3  10.681 -20.543   7.409
   16    HG1  THR   3           HG1      THR   3   8.128 -20.746   7.192
   17   HG21  THR   3          HG21      THR   3  10.501 -19.516   5.123
   18   HG22  THR   3          HG22      THR   3   9.164 -18.983   6.207
   19   HG23  THR   3          HG23      THR   3   8.858 -20.232   4.944
   20    HA   PRO   4           HA       PRO   4  13.885 -21.638   3.372
   21    HB2  PRO   4           HB2      PRO   4  12.948 -20.146   1.204
   22    HB3  PRO   4           HB1      PRO   4  12.966 -21.960   1.270
   23    HG2  PRO   4           HG2      PRO   4  10.678 -20.018   1.813
   24    HG3  PRO   4           HG1      PRO   4  10.658 -21.617   0.962
   25    HD2  PRO   4           HD2      PRO   4   9.788 -21.319   3.549
   26    HD3  PRO   4           HD1      PRO   4  10.598 -22.831   2.969
   27    H    ASP   5           HN       ASP   5  11.662 -18.803   2.975
   28    HA   ASP   5           HA       ASP   5  13.298 -17.256   4.670
   29    HB2  ASP   5           HB2      ASP   5  14.503 -17.324   2.323
   30    HB3  ASP   5           HB1      ASP   5  13.134 -16.292   1.799
   31    H    GLY   6           HN       GLY   6  12.263 -14.979   2.634
   32    HA2  GLY   6           HA2      GLY   6   9.469 -15.187   2.818
   33    HA3  GLY   6           HA1      GLY   6  10.176 -14.121   4.113
   34    H    THR   7           HN       THR   7  12.523 -13.362   2.432
   35    HA   THR   7           HA       THR   7  11.063 -11.430   0.766
   36    HB   THR   7           HB       THR   7  13.962 -11.488   1.754
   37    HG1  THR   7           HG1      THR   7  12.777  -9.278   2.363
   38   HG21  THR   7          HG21      THR   7  12.479  -9.693  -0.249
   39   HG22  THR   7          HG22      THR   7  14.063 -10.535  -0.445
   40   HG23  THR   7          HG23      THR   7  13.927  -9.112   0.655
   41    H    TRP   8           HN       TRP   8  13.424 -14.042   0.840
   42    HA   TRP   8           HA       TRP   8  14.352 -13.772  -1.757
   43    HB2  TRP   8           HB2      TRP   8  15.637 -15.387  -0.729
   44    HB3  TRP   8           HB1      TRP   8  14.322 -15.857   0.364
   45    HD1  TRP   8           HD1      TRP   8  15.971 -16.913  -2.932
   46    HE1  TRP   8           HE1      TRP   8  14.869 -19.071  -3.717
   47    HE3  TRP   8           HE3      TRP   8  12.094 -17.088   0.340
   48    HZ2  TRP   8           HZ2      TRP   8  12.641 -20.631  -3.024
   49    HZ3  TRP   8           HZ3      TRP   8  10.508 -18.944   0.217
   50    HH2  TRP   8           HH2      TRP   8  10.784 -20.700  -1.457
   51    H    VAL   9           HN       VAL   9  11.411 -15.282  -0.341
   52    HA   VAL   9           HA       VAL   9  10.669 -16.577  -2.752
   53    HB   VAL   9           HB       VAL   9   9.751 -17.201  -0.493
   54   HG11  VAL   9          HG11      VAL   9   7.845 -14.842  -0.738
   55   HG12  VAL   9          HG12      VAL   9   9.490 -14.540  -0.071
   56   HG13  VAL   9          HG13      VAL   9   8.400 -15.729   0.730
   57   HG21  VAL   9          HG21      VAL   9   7.458 -17.569  -1.364
   58   HG22  VAL   9          HG22      VAL   9   8.688 -17.870  -2.649
   59   HG23  VAL   9          HG23      VAL   9   7.730 -16.329  -2.648
   60    H    LYS  10           HN       LYS  10  10.418 -13.272  -1.515
   61    HA   LYS  10           HA       LYS  10   8.225 -12.517  -3.108
   62    HB2  LYS  10           HB2      LYS  10  10.627 -10.864  -2.123
   63    HB3  LYS  10           HB1      LYS  10   9.218 -10.156  -2.982
   64    HG2  LYS  10           HG2      LYS  10   7.697 -10.963  -1.179
   65    HG3  LYS  10           HG1      LYS  10   9.098 -11.681  -0.315
   66    HD2  LYS  10           HD2      LYS  10  10.127  -9.410  -0.096
   67    HD3  LYS  10           HD1      LYS  10   8.729  -8.690  -0.967
   68    HE2  LYS  10           HE2      LYS  10   7.188  -9.456   0.862
   69    HE3  LYS  10           HE1      LYS  10   8.594 -10.193   1.738
   70    HZ1  LYS  10           HZ1      LYS  10   9.155  -7.511   1.033
   71    HZ2  LYS  10           HZ2      LYS  10   9.075  -8.241   2.564
   72    HZ3  LYS  10           HZ3      LYS  10   7.674  -7.589   1.857
   73    H    CYS  11           HN       CYS  11  11.594 -13.270  -3.767
   74    HA   CYS  11           HA       CYS  11  11.661 -11.861  -6.239
   75    HB2  CYS  11           HB2      CYS  11  13.870 -12.278  -5.519
   76    HB3  CYS  11           HB1      CYS  11  13.431 -13.858  -4.831
   77    H    ARG  12           HN       ARG  12  11.010 -15.189  -5.068
   78    HA   ARG  12           HA       ARG  12  10.787 -16.392  -7.529
   79    HB2  ARG  12           HB2      ARG  12   9.117 -16.864  -5.010
   80    HB3  ARG  12           HB1      ARG  12   9.210 -17.966  -6.397
   81    HG2  ARG  12           HG2      ARG  12  11.747 -17.143  -4.997
   82    HG3  ARG  12           HG1      ARG  12  10.678 -18.381  -4.258
   83    HD2  ARG  12           HD2      ARG  12  10.803 -19.724  -6.409
   84    HD3  ARG  12           HD1      ARG  12  12.000 -18.507  -7.036
   85    HE   ARG  12           HE       ARG  12  13.077 -19.205  -4.603
   86   HH11  ARG  12          HH11      ARG  12  11.765 -21.045  -7.357
   87   HH12  ARG  12          HH12      ARG  12  12.825 -22.399  -7.160
   88   HH21  ARG  12          HH21      ARG  12  14.527 -21.059  -4.336
   89   HH22  ARG  12          HH22      ARG  12  14.421 -22.407  -5.417
   90    H    HIS  13           HN       HIS  13   8.450 -14.583  -5.514
   91    HA   HIS  13           HA       HIS  13   6.331 -14.971  -7.387
   92    HB2  HIS  13           HB2      HIS  13   5.692 -14.428  -5.098
   93    HB3  HIS  13           HB1      HIS  13   6.749 -12.972  -5.099
   94    HD2  HIS  13           HD2      HIS  13   5.478 -10.650  -5.837
   95    HE1  HIS  13           HE1      HIS  13   1.981 -12.460  -7.382
   96    HE2  HIS  13           HE2      HIS  13   3.130 -10.269  -6.793
   97    H    ASP  14           HN       ASP  14   8.829 -12.438  -6.817
   98    HA   ASP  14           HA       ASP  14   7.729 -10.518  -8.519
   99    HB2  ASP  14           HB2      ASP  14   9.801 -10.234  -6.980
  100    HB3  ASP  14           HB1      ASP  14  10.736 -11.058  -8.269
  101    H    CYS  15           HN       CYS  15  10.176 -13.140  -9.244
  102    HA   CYS  15           HA       CYS  15  10.161 -12.434 -12.013
  103    HB2  CYS  15           HB2      CYS  15  11.024 -15.042 -10.610
  104    HB3  CYS  15           HB1      CYS  15  11.254 -14.718 -12.356
  105    H    PHE  16           HN       PHE  16   8.180 -14.425  -9.889
  106    HA   PHE  16           HA       PHE  16   7.136 -16.087 -11.881
  107    HB2  PHE  16           HB2      PHE  16   6.710 -16.456  -9.450
  108    HB3  PHE  16           HB1      PHE  16   5.709 -14.967  -9.422
  109    HD1  PHE  16           HD1      PHE  16   6.004 -18.042 -11.535
  110    HD2  PHE  16           HD2      PHE  16   3.508 -15.335  -9.408
  111    HE1  PHE  16           HE1      PHE  16   4.035 -19.369 -12.136
  112    HE2  PHE  16           HE2      PHE  16   1.546 -16.673 -10.018
  113    HZ   PHE  16           HZ       PHE  16   1.810 -18.688 -11.380
  114    H    THR  17           HN       THR  17   6.066 -12.876 -10.583
  115    HA   THR  17           HA       THR  17   3.825 -12.755 -12.297
  116    HB   THR  17           HB       THR  17   3.902 -10.292 -11.931
  117    HG1  THR  17           HG1      THR  17   6.429 -11.008 -10.928
  118   HG21  THR  17          HG21      THR  17   4.577 -11.199  -9.197
  119   HG22  THR  17          HG22      THR  17   3.492 -12.353 -10.059
  120   HG23  THR  17          HG23      THR  17   3.004 -10.627  -9.866
  121    H    LYS  18           HN       LYS  18   7.291 -11.831 -12.671
  122    HA   LYS  18           HA       LYS  18   6.917 -10.540 -15.136
  123    HB2  LYS  18           HB2      LYS  18   9.305 -11.901 -13.830
  124    HB3  LYS  18           HB1      LYS  18   9.403 -11.363 -15.541
  125    HG2  LYS  18           HG2      LYS  18  10.207  -9.771 -13.577
  126    HG3  LYS  18           HG1      LYS  18   9.343  -9.104 -15.002
  127    HD2  LYS  18           HD2      LYS  18   7.324  -8.812 -13.804
  128    HD3  LYS  18           HD1      LYS  18   7.793  -9.980 -12.529
  129    HE2  LYS  18           HE2      LYS  18   7.896  -7.644 -11.679
  130    HE3  LYS  18           HE1      LYS  18   9.550  -8.376 -11.715
  131    HZ1  LYS  18           HZ1      LYS  18   8.833  -6.019 -12.800
  132    HZ2  LYS  18           HZ2      LYS  18   8.793  -7.043 -14.154
  133    HZ3  LYS  18           HZ3      LYS  18  10.205  -6.924 -13.221
  134    H    TYR  19           HN       TYR  19   7.141 -13.916 -14.103
  135    HA   TYR  19           HA       TYR  19   7.630 -14.876 -16.741
  136    HB2  TYR  19           HB2      TYR  19   8.254 -16.469 -15.145
  137    HB3  TYR  19           HB1      TYR  19   6.863 -16.106 -14.083
  138    HD1  TYR  19           HD1      TYR  19   7.745 -17.590 -17.377
  139    HD2  TYR  19           HD2      TYR  19   5.046 -17.440 -14.113
  140    HE1  TYR  19           HE1      TYR  19   6.546 -19.513 -18.297
  141    HE2  TYR  19           HE2      TYR  19   3.846 -19.364 -15.030
  142    HH   TYR  19           HH       TYR  19   3.495 -20.435 -17.288
  143    H    LYS  20           HN       LYS  20   4.772 -14.658 -14.536
  144    HA   LYS  20           HA       LYS  20   2.980 -15.772 -16.339
  145    HB2  LYS  20           HB2      LYS  20   2.460 -13.483 -14.367
  146    HB3  LYS  20           HB1      LYS  20   1.215 -14.531 -15.115
  147    HG2  LYS  20           HG2      LYS  20   3.464 -15.548 -13.325
  148    HG3  LYS  20           HG1      LYS  20   1.822 -15.147 -12.755
  149    HD2  LYS  20           HD2      LYS  20   1.991 -17.025 -15.105
  150    HD3  LYS  20           HD1      LYS  20   2.604 -17.657 -13.540
  151    HE2  LYS  20           HE2      LYS  20   0.407 -17.098 -12.457
  152    HE3  LYS  20           HE1      LYS  20  -0.210 -16.475 -14.042
  153    HZ1  LYS  20           HZ1      LYS  20   0.714 -18.904 -14.697
  154    HZ2  LYS  20           HZ2      LYS  20  -0.893 -18.551 -14.273
  155    HZ3  LYS  20           HZ3      LYS  20   0.173 -19.184 -13.112
  156    H    SER  21           HN       SER  21   4.317 -12.488 -15.936
  157    HA   SER  21           HA       SER  21   2.565 -11.282 -17.804
  158    HB2  SER  21           HB2      SER  21   4.065  -9.918 -16.264
  159    HB3  SER  21           HB1      SER  21   5.493 -10.517 -17.198
  160    HG   SER  21           HG       SER  21   4.067  -9.659 -19.053
  161    H    CYS  22           HN       CYS  22   5.592 -13.184 -18.064
  162    HA   CYS  22           HA       CYS  22   6.058 -12.558 -20.780
  163    HB2  CYS  22           HB2      CYS  22   7.708 -13.706 -19.128
  164    HB3  CYS  22           HB1      CYS  22   6.752 -15.194 -19.407
  165    H    GLN  23           HN       GLN  23   4.120 -15.050 -19.065
  166    HA   GLN  23           HA       GLN  23   3.520 -16.468 -21.449
  167    HB2  GLN  23           HB2      GLN  23   2.429 -16.442 -18.616
  168    HB3  GLN  23           HB1      GLN  23   1.370 -17.108 -19.910
  169    HG2  GLN  23           HG2      GLN  23   3.421 -18.599 -20.595
  170    HG3  GLN  23           HG1      GLN  23   4.113 -18.130 -18.989
  171   HE21  GLN  23          HE21      GLN  23   1.898 -20.215 -20.642
  172   HE22  GLN  23          HE22      GLN  23   1.122 -20.905 -19.257
  173    H    MET  24           HN       MET  24   2.385 -13.483 -19.957
  174    HA   MET  24           HA       MET  24  -0.087 -13.567 -21.454
  175    HB2  MET  24           HB2      MET  24   1.228 -11.364 -19.791
  176    HB3  MET  24           HB1      MET  24  -0.354 -11.205 -20.612
  177    HG2  MET  24           HG2      MET  24   0.264 -13.373 -18.563
  178    HG3  MET  24           HG1      MET  24  -0.421 -11.785 -18.139
  179    HE1  MET  24           HE1      MET  24  -2.415 -15.569 -19.178
  180    HE2  MET  24           HE2      MET  24  -0.761 -15.129 -18.628
  181    HE3  MET  24           HE3      MET  24  -1.143 -15.169 -20.384
  182    H    SER  25           HN       SER  25   3.220 -12.739 -21.870
  183    HA   SER  25           HA       SER  25   2.794 -10.612 -23.693
  184    HB2  SER  25           HB2      SER  25   5.192 -12.526 -23.439
  185    HB3  SER  25           HB1      SER  25   5.167 -11.022 -24.447
  186    HG   SER  25           HG       SER  25   4.494 -10.951 -21.707
  187    H    ASP  26           HN       ASP  26   3.379 -10.791 -26.075
  188    HA   ASP  26           HA       ASP  26   1.953 -13.083 -27.103
  189    HB2  ASP  26           HB2      ASP  26   3.132 -10.588 -28.421
  190    HB3  ASP  26           HB1      ASP  26   2.369 -11.924 -29.352
  191    H    SER  27           HN       SER  27   4.845 -12.905 -25.859
  192    HA   SER  27           HA       SER  27   6.429 -13.658 -28.129
  193    HB2  SER  27           HB2      SER  27   7.035 -13.850 -25.112
  194    HB3  SER  27           HB1      SER  27   8.226 -14.189 -26.432
  195    HG   SER  27           HG       SER  27   8.566 -12.142 -25.945
  196    H    CYS  28           HN       CYS  28   4.033 -15.053 -26.204
  197    HA   CYS  28           HA       CYS  28   5.245 -17.676 -26.258
  198    HB2  CYS  28           HB2      CYS  28   3.730 -16.956 -24.340
  199    HB3  CYS  28           HB1      CYS  28   2.392 -16.839 -25.532
  200    H    HIS  29           HN       HIS  29   5.561 -17.671 -28.649
  201    HA   HIS  29           HA       HIS  29   3.103 -17.639 -30.177
  202    HB2  HIS  29           HB2      HIS  29   5.844 -18.505 -31.221
  203    HB3  HIS  29           HB1      HIS  29   4.462 -17.823 -32.161
  204    HD2  HIS  29           HD2      HIS  29   7.389 -16.585 -29.771
  205    HE1  HIS  29           HE1      HIS  29   5.654 -13.281 -31.761
  206    HE2  HIS  29           HE2      HIS  29   7.537 -14.070 -30.247
  207    H    ASP  30           HN       ASP  30   5.385 -19.894 -28.653
  208    HA   ASP  30           HA       ASP  30   3.590 -22.014 -29.507
  209    HB2  ASP  30           HB2      ASP  30   6.029 -21.786 -30.804
  210    HB3  ASP  30           HB1      ASP  30   6.504 -22.753 -29.362
  211    H    GLU  31           HN       GLU  31   4.359 -24.125 -28.171
  212    HA   GLU  31           HA       GLU  31   4.101 -23.352 -25.472
  213    HB2  GLU  31           HB2      GLU  31   4.923 -26.032 -26.736
  214    HB3  GLU  31           HB1      GLU  31   4.662 -25.801 -24.967
  215    HG2  GLU  31           HG2      GLU  31   2.274 -25.209 -25.336
  216    HG3  GLU  31           HG1      GLU  31   2.509 -25.305 -27.129
  217    H    GLN  32           HN       GLN  32   6.842 -24.286 -27.599
  218    HA   GLN  32           HA       GLN  32   8.729 -24.535 -25.541
  219    HB2  GLN  32           HB2      GLN  32   9.076 -25.224 -27.972
  220    HB3  GLN  32           HB1      GLN  32   9.197 -23.486 -28.374
  221    HG2  GLN  32           HG2      GLN  32  11.463 -24.408 -28.161
  222    HG3  GLN  32           HG1      GLN  32  11.154 -23.293 -26.772
  223   HE21  GLN  32          HE21      GLN  32  12.136 -24.145 -24.998
  224   HE22  GLN  32          HE22      GLN  32  12.011 -25.786 -24.466
  225    H    SER  33           HN       SER  33   7.535 -21.757 -27.503
  226    HA   SER  33           HA       SER  33   9.397 -19.924 -26.487
  227    HB2  SER  33           HB2      SER  33   6.506 -19.411 -27.414
  228    HB3  SER  33           HB1      SER  33   7.752 -18.131 -27.143
  229    HG   SER  33           HG       SER  33   8.893 -18.872 -28.817
  230    H    CYS  34           HN       CYS  34   6.151 -21.061 -25.349
  231    HA   CYS  34           HA       CYS  34   6.076 -19.189 -23.209
  232    HB2  CYS  34           HB2      CYS  34   4.469 -21.540 -24.091
  233    HB3  CYS  34           HB1      CYS  34   4.635 -21.443 -22.305
  234    H    HIS  35           HN       HIS  35   7.508 -22.427 -23.745
  235    HA   HIS  35           HA       HIS  35   7.989 -22.937 -21.004
  236    HB2  HIS  35           HB2      HIS  35   8.209 -24.767 -22.674
  237    HB3  HIS  35           HB1      HIS  35   9.538 -23.863 -23.485
  238    HD2  HIS  35           HD2      HIS  35  11.996 -24.689 -22.681
  239    HE1  HIS  35           HE1      HIS  35  10.852 -26.262 -18.928
  240    HE2  HIS  35           HE2      HIS  35  12.762 -25.926 -20.570
  241    H    GLN  36           HN       GLN  36   9.700 -21.130 -23.587
  242    HA   GLN  36           HA       GLN  36  12.108 -20.809 -22.206
  243    HB2  GLN  36           HB2      GLN  36  10.668 -18.949 -24.151
  244    HB3  GLN  36           HB1      GLN  36  12.312 -18.629 -23.523
  245    HG2  GLN  36           HG2      GLN  36  11.683 -21.296 -24.879
  246    HG3  GLN  36           HG1      GLN  36  12.052 -19.818 -25.855
  247   HE21  GLN  36          HE21      GLN  36  13.329 -22.233 -23.613
  248   HE22  GLN  36          HE22      GLN  36  14.979 -21.743 -23.694
  249    H    CYS  37           HN       CYS  37   8.959 -19.150 -22.027
  250    HA   CYS  37           HA       CYS  37   9.858 -17.000 -20.462
  251    HB2  CYS  37           HB2      CYS  37   7.153 -18.421 -20.542
  252    HB3  CYS  37           HB1      CYS  37   7.463 -16.955 -19.579
  253    H    HIS  38           HN       HIS  38   8.797 -20.310 -19.732
  254    HA   HIS  38           HA       HIS  38   8.831 -19.900 -16.926
  255    HB2  HIS  38           HB2      HIS  38   7.548 -21.784 -18.040
  256    HB3  HIS  38           HB1      HIS  38   9.135 -22.527 -18.463
  257    HD2  HIS  38           HD2      HIS  38  10.646 -23.451 -16.189
  258    HE1  HIS  38           HE1      HIS  38   7.254 -23.394 -13.657
  259    HE2  HIS  38           HE2      HIS  38   9.655 -24.196 -13.940
  260    H    VAL  39           HN       VAL  39  11.091 -21.050 -19.411
  261    HA   VAL  39           HA       VAL  39  13.043 -21.898 -17.564
  262    HB   VAL  39           HB       VAL  39  13.246 -20.896 -20.432
  263   HG11  VAL  39          HG11      VAL  39  15.336 -21.920 -18.433
  264   HG12  VAL  39          HG12      VAL  39  15.394 -20.450 -19.477
  265   HG13  VAL  39          HG13      VAL  39  15.566 -22.089 -20.214
  266   HG21  VAL  39          HG21      VAL  39  12.608 -23.461 -19.041
  267   HG22  VAL  39          HG22      VAL  39  13.900 -23.611 -20.297
  268   HG23  VAL  39          HG23      VAL  39  12.283 -22.945 -20.741
  269    H    LYS  40           HN       LYS  40  12.196 -18.758 -19.104
  270    HA   LYS  40           HA       LYS  40  14.548 -17.453 -18.227
  271    HB2  LYS  40           HB2      LYS  40  11.731 -16.407 -18.856
  272    HB3  LYS  40           HB1      LYS  40  13.073 -15.323 -18.344
  273    HG2  LYS  40           HG2      LYS  40  14.157 -15.456 -20.360
  274    HG3  LYS  40           HG1      LYS  40  13.739 -17.189 -20.600
  275    HD2  LYS  40           HD2      LYS  40  12.090 -16.604 -22.020
  276    HD3  LYS  40           HD1      LYS  40  11.276 -15.681 -20.714
  277    HE2  LYS  40           HE2      LYS  40  11.631 -14.102 -22.502
  278    HE3  LYS  40           HE1      LYS  40  12.925 -13.733 -21.291
  279    HZ1  LYS  40           HZ1      LYS  40  13.130 -14.672 -23.981
  280    HZ2  LYS  40           HZ2      LYS  40  14.004 -15.649 -22.902
  281    HZ3  LYS  40           HZ3      LYS  40  14.300 -13.978 -22.965
  282    H    HIS  41           HN       HIS  41  11.358 -18.192 -16.826
  283    HA   HIS  41           HA       HIS  41  11.677 -16.597 -14.544
  284    HB2  HIS  41           HB2      HIS  41   9.492 -17.588 -15.080
  285    HB3  HIS  41           HB1      HIS  41  10.178 -19.229 -14.943
  286    HD2  HIS  41           HD2      HIS  41   9.144 -16.213 -12.552
  287    HE1  HIS  41           HE1      HIS  41   9.634 -19.737 -10.300
  288    HE2  HIS  41           HE2      HIS  41   8.896 -17.310 -10.257
  289    H    THR  42           HN       THR  42  12.589 -19.960 -15.404
  290    HA   THR  42           HA       THR  42  13.450 -20.678 -12.864
  291    HB   THR  42           HB       THR  42  14.438 -21.551 -15.629
  292    HG1  THR  42           HG1      THR  42  12.243 -21.983 -14.914
  293   HG21  THR  42          HG21      THR  42  15.121 -23.608 -14.021
  294   HG22  THR  42          HG22      THR  42  15.254 -22.283 -12.807
  295   HG23  THR  42          HG23      THR  42  16.227 -22.222 -14.320
  296    H    ASP  43           HN       ASP  43  15.193 -19.113 -15.653
  297    HA   ASP  43           HA       ASP  43  17.648 -19.016 -14.206
  298    HB2  ASP  43           HB2      ASP  43  16.642 -17.437 -16.640
  299    HB3  ASP  43           HB1      ASP  43  18.296 -17.234 -15.952
  300    H    CYS  44           HN       CYS  44  14.789 -16.918 -14.516
  301    HA   CYS  44           HA       CYS  44  16.005 -14.606 -13.424
  302    HB2  CYS  44           HB2      CYS  44  13.719 -14.684 -14.664
  303    HB3  CYS  44           HB1      CYS  44  13.053 -15.401 -13.162
  304    H    VAL  45           HN       VAL  45  14.370 -17.473 -12.165
  305    HA   VAL  45           HA       VAL  45  14.350 -16.440  -9.523
  306    HB   VAL  45           HB       VAL  45  13.692 -19.029 -10.871
  307   HG11  VAL  45          HG11      VAL  45  13.528 -20.109  -8.552
  308   HG12  VAL  45          HG12      VAL  45  14.453 -18.713  -7.890
  309   HG13  VAL  45          HG13      VAL  45  15.221 -19.811  -9.110
  310   HG21  VAL  45          HG21      VAL  45  12.362 -17.125  -8.850
  311   HG22  VAL  45          HG22      VAL  45  11.645 -18.704  -9.346
  312   HG23  VAL  45          HG23      VAL  45  11.910 -17.405 -10.576
  313    H    ASN  46           HN       ASN  46  16.392 -18.557 -11.503
  314    HA   ASN  46           HA       ASN  46  17.972 -19.460  -9.380
  315    HB2  ASN  46           HB2      ASN  46  18.401 -19.115 -12.355
  316    HB3  ASN  46           HB1      ASN  46  19.767 -19.588 -11.290
  317   HD21  ASN  46          HD21      ASN  46  18.155 -21.021 -13.473
  318   HD22  ASN  46          HD22      ASN  46  17.695 -22.518 -12.749
  319    H    THR  47           HN       THR  47  17.991 -16.429 -11.257
  320    HA   THR  47           HA       THR  47  20.539 -15.758 -10.006
  321    HB   THR  47           HB       THR  47  18.828 -14.143 -11.951
  322    HG1  THR  47           HG1      THR  47  19.696 -15.962 -12.904
  323   HG21  THR  47          HG21      THR  47  21.563 -13.723 -10.620
  324   HG22  THR  47          HG22      THR  47  20.156 -12.595 -10.688
  325   HG23  THR  47          HG23      THR  47  21.130 -12.914 -12.173
  326    H    GLY  48           HN       GLY  48  17.094 -14.682 -10.144
  327    HA2  GLY  48           HA2      GLY  48  17.594 -12.523  -8.364
  328    HA3  GLY  48           HA1      GLY  48  15.994 -13.239  -8.838
  329    H    CYS  49           HN       CYS  49  16.496 -15.969  -7.949
  330    HA   CYS  49           HA       CYS  49  17.133 -15.657  -5.135
  331    HB2  CYS  49           HB2      CYS  49  14.854 -17.058  -4.756
  332    HB3  CYS  49           HB1      CYS  49  14.896 -15.276  -4.642
  333    HA   PRO  50           HA       PRO  50  18.579 -19.457  -7.441
  334    HB2  PRO  50           HB2      PRO  50  20.717 -19.535  -5.492
  335    HB3  PRO  50           HB1      PRO  50  20.837 -19.054  -7.238
  336    HG2  PRO  50           HG2      PRO  50  20.570 -17.320  -4.764
  337    HG3  PRO  50           HG1      PRO  50  21.345 -16.949  -6.359
  338    HD2  PRO  50           HD2      PRO  50  18.944 -15.872  -5.653
  339    HD3  PRO  50           HD1      PRO  50  19.301 -16.337  -7.359
  Start of MODEL    8
    1    H1   SER   1           HT1      SER   1   8.980 -30.110   5.890
    2    H2   SER   1           HT2      SER   1   9.929 -28.700   5.900
    3    H3   SER   1           HT3      SER   1   9.357 -29.329   4.429
    4    HA   SER   1           HA       SER   1   7.519 -28.186   4.571
    5    HB2  SER   1           HB2      SER   1   6.763 -30.142   6.108
    6    HB3  SER   1           HB1      SER   1   7.160 -29.052   7.497
    7    HG   SER   1           HG       SER   1   5.621 -27.662   6.847
    8    H    SER   2           HN       SER   2   9.445 -26.458   4.642
    9    HA   SER   2           HA       SER   2   8.575 -24.557   6.626
   10    HB2  SER   2           HB2      SER   2  10.516 -25.706   7.812
   11    HB3  SER   2           HB1      SER   2  11.556 -25.316   6.383
   12    HG   SER   2           HG       SER   2  11.486 -23.244   6.874
   13    H    THR   3           HN       THR   3   8.989 -22.372   5.901
   14    HA   THR   3           HA       THR   3   9.415 -22.294   3.078
   15    HB   THR   3           HB       THR   3   9.230 -19.951   5.019
   16    HG1  THR   3           HG1      THR   3   7.020 -20.206   3.719
   17   HG21  THR   3          HG21      THR   3   8.507 -18.728   2.954
   18   HG22  THR   3          HG22      THR   3   8.752 -20.231   1.988
   19   HG23  THR   3          HG23      THR   3  10.160 -19.421   2.771
   20    HA   PRO   4           HA       PRO   4  13.802 -22.042   3.230
   21    HB2  PRO   4           HB2      PRO   4  13.344 -20.307   0.804
   22    HB3  PRO   4           HB1      PRO   4  14.433 -21.735   1.008
   23    HG2  PRO   4           HG2      PRO   4  12.111 -21.980  -0.329
   24    HG3  PRO   4           HG1      PRO   4  12.671 -23.285   0.777
   25    HD2  PRO   4           HD2      PRO   4  10.510 -21.183   1.203
   26    HD3  PRO   4           HD1      PRO   4  10.563 -22.911   1.739
   27    H    ASP   5           HN       ASP   5  11.955 -19.032   2.486
   28    HA   ASP   5           HA       ASP   5  13.477 -17.707   4.497
   29    HB2  ASP   5           HB2      ASP   5  14.776 -17.518   2.202
   30    HB3  ASP   5           HB1      ASP   5  13.429 -16.426   1.746
   31    H    GLY   6           HN       GLY   6  12.530 -15.212   2.699
   32    HA2  GLY   6           HA2      GLY   6   9.714 -15.456   2.828
   33    HA3  GLY   6           HA1      GLY   6  10.433 -14.444   4.159
   34    H    THR   7           HN       THR   7  12.762 -13.602   2.513
   35    HA   THR   7           HA       THR   7  11.284 -11.626   0.914
   36    HB   THR   7           HB       THR   7  14.180 -11.672   1.910
   37    HG1  THR   7           HG1      THR   7  12.732  -9.520   2.528
   38   HG21  THR   7          HG21      THR   7  12.658  -9.829  -0.016
   39   HG22  THR   7          HG22      THR   7  14.271 -10.609  -0.232
   40   HG23  THR   7          HG23      THR   7  14.078  -9.240   0.929
   41    H    TRP   8           HN       TRP   8  13.718 -14.178   0.910
   42    HA   TRP   8           HA       TRP   8  14.631 -13.788  -1.679
   43    HB2  TRP   8           HB2      TRP   8  15.976 -15.389  -0.706
   44    HB3  TRP   8           HB1      TRP   8  14.682 -15.941   0.372
   45    HD1  TRP   8           HD1      TRP   8  16.366 -16.833  -2.955
   46    HE1  TRP   8           HE1      TRP   8  15.338 -19.000  -3.811
   47    HE3  TRP   8           HE3      TRP   8  12.493 -17.243   0.300
   48    HZ2  TRP   8           HZ2      TRP   8  13.162 -20.655  -3.172
   49    HZ3  TRP   8           HZ3      TRP   8  10.970 -19.146   0.118
   50    HH2  TRP   8           HH2      TRP   8  11.309 -20.832  -1.613
   51    H    VAL   9           HN       VAL   9  11.745 -15.437  -0.306
   52    HA   VAL   9           HA       VAL   9  11.043 -16.683  -2.756
   53    HB   VAL   9           HB       VAL   9  10.154 -17.411  -0.518
   54   HG11  VAL   9          HG11      VAL   9   8.173 -15.103  -0.690
   55   HG12  VAL   9          HG12      VAL   9   9.804 -14.785   0.004
   56   HG13  VAL   9          HG13      VAL   9   8.739 -16.031   0.747
   57   HG21  VAL   9          HG21      VAL   9   8.096 -16.544  -2.639
   58   HG22  VAL   9          HG22      VAL   9   7.873 -17.838  -1.396
   59   HG23  VAL   9          HG23      VAL   9   9.109 -18.041  -2.696
   60    H    LYS  10           HN       LYS  10  10.687 -13.425  -1.417
   61    HA   LYS  10           HA       LYS  10   8.462 -12.692  -2.974
   62    HB2  LYS  10           HB2      LYS  10  10.827 -10.997  -1.965
   63    HB3  LYS  10           HB1      LYS  10   9.396 -10.304  -2.803
   64    HG2  LYS  10           HG2      LYS  10   7.905 -11.184  -1.009
   65    HG3  LYS  10           HG1      LYS  10   9.325 -11.893  -0.171
   66    HD2  LYS  10           HD2      LYS  10  10.313  -9.592   0.070
   67    HD3  LYS  10           HD1      LYS  10   8.866  -8.896  -0.737
   68    HE2  LYS  10           HE2      LYS  10   8.792 -10.526   1.893
   69    HE3  LYS  10           HE1      LYS  10   8.752  -8.717   1.784
   70    HZ1  LYS  10           HZ1      LYS  10   6.597  -8.918   1.573
   71    HZ2  LYS  10           HZ2      LYS  10   6.668 -10.610   1.432
   72    HZ3  LYS  10           HZ3      LYS  10   6.820  -9.636   0.050
   73    H    CYS  11           HN       CYS  11  11.858 -13.305  -3.675
   74    HA   CYS  11           HA       CYS  11  11.852 -11.844  -6.115
   75    HB2  CYS  11           HB2      CYS  11  14.080 -12.204  -5.426
   76    HB3  CYS  11           HB1      CYS  11  13.699 -13.812  -4.769
   77    H    ARG  12           HN       ARG  12  11.332 -15.223  -5.024
   78    HA   ARG  12           HA       ARG  12  11.119 -16.365  -7.513
   79    HB2  ARG  12           HB2      ARG  12   9.499 -16.965  -4.989
   80    HB3  ARG  12           HB1      ARG  12   9.612 -18.024  -6.407
   81    HG2  ARG  12           HG2      ARG  12  12.138 -17.153  -5.014
   82    HG3  ARG  12           HG1      ARG  12  11.121 -18.445  -4.297
   83    HD2  ARG  12           HD2      ARG  12  11.265 -19.725  -6.487
   84    HD3  ARG  12           HD1      ARG  12  12.410 -18.450  -7.093
   85    HE   ARG  12           HE       ARG  12  13.551 -19.171  -4.702
   86   HH11  ARG  12          HH11      ARG  12  12.233 -21.002  -7.460
   87   HH12  ARG  12          HH12      ARG  12  13.336 -22.328  -7.309
   88   HH21  ARG  12          HH21      ARG  12  15.060 -20.987  -4.498
   89   HH22  ARG  12          HH22      ARG  12  14.968 -22.319  -5.599
   90    H    HIS  13           HN       HIS  13   8.746 -14.698  -5.420
   91    HA   HIS  13           HA       HIS  13   6.614 -15.112  -7.268
   92    HB2  HIS  13           HB2      HIS  13   6.000 -14.630  -4.957
   93    HB3  HIS  13           HB1      HIS  13   7.004 -13.137  -4.953
   94    HD2  HIS  13           HD2      HIS  13   5.641 -10.850  -5.635
   95    HE1  HIS  13           HE1      HIS  13   2.178 -12.758  -7.138
   96    HE2  HIS  13           HE2      HIS  13   3.263 -10.536  -6.540
   97    H    ASP  14           HN       ASP  14   9.036 -12.510  -6.690
   98    HA   ASP  14           HA       ASP  14   7.849 -10.596  -8.338
   99    HB2  ASP  14           HB2      ASP  14   9.943 -10.286  -6.825
  100    HB3  ASP  14           HB1      ASP  14  10.876 -11.038  -8.158
  101    H    CYS  15           HN       CYS  15  10.372 -13.119  -9.155
  102    HA   CYS  15           HA       CYS  15  10.279 -12.367 -11.911
  103    HB2  CYS  15           HB2      CYS  15  11.262 -14.965 -10.572
  104    HB3  CYS  15           HB1      CYS  15  11.446 -14.603 -12.316
  105    H    PHE  16           HN       PHE  16   8.413 -14.463  -9.785
  106    HA   PHE  16           HA       PHE  16   7.387 -16.128 -11.784
  107    HB2  PHE  16           HB2      PHE  16   7.029 -16.550  -9.351
  108    HB3  PHE  16           HB1      PHE  16   5.974 -15.102  -9.278
  109    HD1  PHE  16           HD1      PHE  16   6.339 -18.131 -11.446
  110    HD2  PHE  16           HD2      PHE  16   3.789 -15.552  -9.225
  111    HE1  PHE  16           HE1      PHE  16   4.410 -19.523 -12.024
  112    HE2  PHE  16           HE2      PHE  16   1.867 -16.956  -9.813
  113    HZ   PHE  16           HZ       PHE  16   2.178 -18.939 -11.211
  114    H    THR  17           HN       THR  17   6.230 -12.981 -10.407
  115    HA   THR  17           HA       THR  17   3.950 -12.911 -12.070
  116    HB   THR  17           HB       THR  17   3.947 -10.453 -11.662
  117    HG1  THR  17           HG1      THR  17   6.516 -11.096 -10.713
  118   HG21  THR  17          HG21      THR  17   3.106 -10.855  -9.586
  119   HG22  THR  17          HG22      THR  17   4.713 -11.385  -8.960
  120   HG23  THR  17          HG23      THR  17   3.648 -12.558  -9.822
  121    H    LYS  18           HN       LYS  18   7.371 -11.870 -12.505
  122    HA   LYS  18           HA       LYS  18   6.897 -10.548 -14.938
  123    HB2  LYS  18           HB2      LYS  18   9.358 -11.844 -13.706
  124    HB3  LYS  18           HB1      LYS  18   9.401 -11.277 -15.410
  125    HG2  LYS  18           HG2      LYS  18  10.193  -9.688 -13.437
  126    HG3  LYS  18           HG1      LYS  18   9.274  -9.030 -14.832
  127    HD2  LYS  18           HD2      LYS  18   7.278  -8.814 -13.585
  128    HD3  LYS  18           HD1      LYS  18   7.802 -10.003 -12.349
  129    HE2  LYS  18           HE2      LYS  18   7.857  -7.688 -11.440
  130    HE3  LYS  18           HE1      LYS  18   9.530  -8.372 -11.526
  131    HZ1  LYS  18           HZ1      LYS  18   8.910  -7.112 -13.957
  132    HZ2  LYS  18           HZ2      LYS  18  10.092  -6.711 -12.807
  133    HZ3  LYS  18           HZ3      LYS  18   8.534  -6.049 -12.688
  134    H    TYR  19           HN       TYR  19   7.271 -13.930 -13.966
  135    HA   TYR  19           HA       TYR  19   7.723 -14.828 -16.636
  136    HB2  TYR  19           HB2      TYR  19   8.463 -16.417 -15.082
  137    HB3  TYR  19           HB1      TYR  19   7.086 -16.132 -13.977
  138    HD1  TYR  19           HD1      TYR  19   7.995 -17.572 -17.279
  139    HD2  TYR  19           HD2      TYR  19   5.280 -17.496 -14.024
  140    HE1  TYR  19           HE1      TYR  19   6.856 -19.532 -18.198
  141    HE2  TYR  19           HE2      TYR  19   4.142 -19.455 -14.941
  142    HH   TYR  19           HH       TYR  19   3.825 -20.622 -17.019
  143    H    LYS  20           HN       LYS  20   4.923 -14.723 -14.352
  144    HA   LYS  20           HA       LYS  20   3.120 -15.895 -16.112
  145    HB2  LYS  20           HB2      LYS  20   2.581 -13.649 -14.100
  146    HB3  LYS  20           HB1      LYS  20   1.349 -14.725 -14.831
  147    HG2  LYS  20           HG2      LYS  20   3.672 -15.681 -13.108
  148    HG3  LYS  20           HG1      LYS  20   2.024 -15.365 -12.507
  149    HD2  LYS  20           HD2      LYS  20   2.244 -17.192 -14.891
  150    HD3  LYS  20           HD1      LYS  20   2.904 -17.822 -13.345
  151    HE2  LYS  20           HE2      LYS  20   0.700 -17.390 -12.227
  152    HE3  LYS  20           HE1      LYS  20   0.036 -16.752 -13.787
  153    HZ1  LYS  20           HZ1      LYS  20   0.896 -19.045 -14.644
  154    HZ2  LYS  20           HZ2      LYS  20  -0.605 -18.898 -13.861
  155    HZ3  LYS  20           HZ3      LYS  20   0.741 -19.492 -13.014
  156    H    SER  21           HN       SER  21   4.357 -12.569 -15.730
  157    HA   SER  21           HA       SER  21   2.491 -11.429 -17.541
  158    HB2  SER  21           HB2      SER  21   5.376 -10.566 -16.871
  159    HB3  SER  21           HB1      SER  21   4.215  -9.575 -17.841
  160    HG   SER  21           HG       SER  21   3.982 -10.435 -15.143
  161    H    CYS  22           HN       CYS  22   5.442 -13.370 -17.891
  162    HA   CYS  22           HA       CYS  22   5.882 -12.646 -20.606
  163    HB2  CYS  22           HB2      CYS  22   7.560 -13.824 -18.955
  164    HB3  CYS  22           HB1      CYS  22   6.649 -15.314 -19.353
  165    H    GLN  23           HN       GLN  23   4.018 -15.161 -18.855
  166    HA   GLN  23           HA       GLN  23   3.363 -16.565 -21.232
  167    HB2  GLN  23           HB2      GLN  23   2.055 -16.493 -18.451
  168    HB3  GLN  23           HB1      GLN  23   1.414 -17.499 -19.799
  169    HG2  GLN  23           HG2      GLN  23   3.816 -18.541 -19.946
  170    HG3  GLN  23           HG1      GLN  23   4.092 -17.775 -18.329
  171   HE21  GLN  23          HE21      GLN  23   2.373 -20.294 -20.119
  172   HE22  GLN  23          HE22      GLN  23   1.639 -21.066 -18.754
  173    H    MET  24           HN       MET  24   2.257 -13.617 -19.649
  174    HA   MET  24           HA       MET  24  -0.286 -13.686 -20.993
  175    HB2  MET  24           HB2      MET  24   1.194 -11.464 -19.503
  176    HB3  MET  24           HB1      MET  24  -0.432 -11.277 -20.229
  177    HG2  MET  24           HG2      MET  24   0.250 -13.395 -18.147
  178    HG3  MET  24           HG1      MET  24  -0.368 -11.775 -17.742
  179    HE1  MET  24           HE1      MET  24  -0.582 -15.054 -19.051
  180    HE2  MET  24           HE2      MET  24  -2.271 -15.467 -19.506
  181    HE3  MET  24           HE3      MET  24  -1.811 -15.357 -17.772
  182    H    SER  25           HN       SER  25   3.002 -12.890 -21.669
  183    HA   SER  25           HA       SER  25   2.460 -10.840 -23.544
  184    HB2  SER  25           HB2      SER  25   4.848 -12.781 -23.410
  185    HB3  SER  25           HB1      SER  25   4.764 -11.307 -24.458
  186    HG   SER  25           HG       SER  25   4.290 -11.123 -21.686
  187    H    ASP  26           HN       ASP  26   2.892 -11.130 -25.964
  188    HA   ASP  26           HA       ASP  26   1.289 -13.372 -26.804
  189    HB2  ASP  26           HB2      ASP  26   2.687 -11.182 -28.429
  190    HB3  ASP  26           HB1      ASP  26   1.540 -12.399 -29.096
  191    H    SER  27           HN       SER  27   4.348 -13.194 -25.772
  192    HA   SER  27           HA       SER  27   5.639 -14.379 -28.048
  193    HB2  SER  27           HB2      SER  27   6.569 -14.139 -25.115
  194    HB3  SER  27           HB1      SER  27   7.589 -14.746 -26.483
  195    HG   SER  27           HG       SER  27   8.081 -12.700 -26.464
  196    H    CYS  28           HN       CYS  28   3.445 -15.313 -25.623
  197    HA   CYS  28           HA       CYS  28   4.521 -17.999 -25.458
  198    HB2  CYS  28           HB2      CYS  28   3.423 -16.913 -23.434
  199    HB3  CYS  28           HB1      CYS  28   1.895 -16.849 -24.374
  200    H    HIS  29           HN       HIS  29   4.367 -18.118 -27.924
  201    HA   HIS  29           HA       HIS  29   1.587 -18.673 -28.676
  202    HB2  HIS  29           HB2      HIS  29   2.470 -18.585 -31.071
  203    HB3  HIS  29           HB1      HIS  29   2.552 -17.009 -30.211
  204    HD2  HIS  29           HD2      HIS  29   5.219 -16.185 -29.480
  205    HE1  HIS  29           HE1      HIS  29   7.073 -19.058 -31.958
  206    HE2  HIS  29           HE2      HIS  29   7.405 -16.961 -30.560
  207    H    ASP  30           HN       ASP  30   4.937 -19.842 -28.444
  208    HA   ASP  30           HA       ASP  30   3.939 -22.449 -29.300
  209    HB2  ASP  30           HB2      ASP  30   6.758 -21.234 -29.345
  210    HB3  ASP  30           HB1      ASP  30   6.494 -23.012 -29.435
  211    H    GLU  31           HN       GLU  31   4.621 -24.296 -27.978
  212    HA   GLU  31           HA       GLU  31   4.443 -23.680 -25.244
  213    HB2  GLU  31           HB2      GLU  31   5.342 -26.248 -26.674
  214    HB3  GLU  31           HB1      GLU  31   5.148 -26.121 -24.887
  215    HG2  GLU  31           HG2      GLU  31   2.721 -25.636 -25.122
  216    HG3  GLU  31           HG1      GLU  31   2.880 -25.620 -26.925
  217    H    GLN  32           HN       GLN  32   7.169 -24.426 -27.487
  218    HA   GLN  32           HA       GLN  32   9.098 -24.579 -25.432
  219    HB2  GLN  32           HB2      GLN  32   9.461 -25.398 -27.803
  220    HB3  GLN  32           HB1      GLN  32   9.482 -23.688 -28.331
  221    HG2  GLN  32           HG2      GLN  32  11.482 -23.225 -26.935
  222    HG3  GLN  32           HG1      GLN  32  11.447 -24.923 -26.309
  223   HE21  GLN  32          HE21      GLN  32  13.765 -24.338 -27.484
  224   HE22  GLN  32          HE22      GLN  32  13.890 -24.985 -29.084
  225    H    SER  33           HN       SER  33   7.828 -21.929 -27.524
  226    HA   SER  33           HA       SER  33   9.665 -20.013 -26.618
  227    HB2  SER  33           HB2      SER  33   8.143 -19.625 -28.627
  228    HB3  SER  33           HB1      SER  33   6.748 -19.513 -27.481
  229    HG   SER  33           HG       SER  33   7.275 -17.547 -27.226
  230    H    CYS  34           HN       CYS  34   6.414 -21.092 -25.419
  231    HA   CYS  34           HA       CYS  34   6.371 -19.134 -23.358
  232    HB2  CYS  34           HB2      CYS  34   4.508 -20.990 -24.324
  233    HB3  CYS  34           HB1      CYS  34   5.013 -21.731 -22.766
  234    H    HIS  35           HN       HIS  35   7.831 -22.363 -23.792
  235    HA   HIS  35           HA       HIS  35   8.280 -22.836 -21.039
  236    HB2  HIS  35           HB2      HIS  35   8.569 -24.687 -22.663
  237    HB3  HIS  35           HB1      HIS  35   9.863 -23.760 -23.500
  238    HD2  HIS  35           HD2      HIS  35  12.356 -24.482 -22.698
  239    HE1  HIS  35           HE1      HIS  35  11.282 -26.064 -18.928
  240    HE2  HIS  35           HE2      HIS  35  13.172 -25.676 -20.582
  241    H    GLN  36           HN       GLN  36   9.965 -20.983 -23.596
  242    HA   GLN  36           HA       GLN  36  12.363 -20.619 -22.214
  243    HB2  GLN  36           HB2      GLN  36  10.883 -18.769 -24.134
  244    HB3  GLN  36           HB1      GLN  36  12.523 -18.428 -23.509
  245    HG2  GLN  36           HG2      GLN  36  11.927 -21.086 -24.901
  246    HG3  GLN  36           HG1      GLN  36  12.285 -19.590 -25.853
  247   HE21  GLN  36          HE21      GLN  36  13.580 -22.036 -23.660
  248   HE22  GLN  36          HE22      GLN  36  15.225 -21.526 -23.722
  249    H    CYS  37           HN       CYS  37   9.169 -19.063 -21.991
  250    HA   CYS  37           HA       CYS  37  10.007 -16.889 -20.427
  251    HB2  CYS  37           HB2      CYS  37   7.360 -18.415 -20.463
  252    HB3  CYS  37           HB1      CYS  37   7.632 -16.939 -19.504
  253    H    HIS  38           HN       HIS  38   9.087 -20.237 -19.697
  254    HA   HIS  38           HA       HIS  38   9.159 -19.835 -16.892
  255    HB2  HIS  38           HB2      HIS  38   7.922 -21.760 -17.989
  256    HB3  HIS  38           HB1      HIS  38   9.528 -22.446 -18.441
  257    HD2  HIS  38           HD2      HIS  38  11.117 -23.299 -16.188
  258    HE1  HIS  38           HE1      HIS  38   7.761 -23.391 -13.610
  259    HE2  HIS  38           HE2      HIS  38  10.190 -24.087 -13.925
  260    H    VAL  39           HN       VAL  39  11.408 -20.892 -19.427
  261    HA   VAL  39           HA       VAL  39  13.425 -21.684 -17.627
  262    HB   VAL  39           HB       VAL  39  13.537 -20.642 -20.486
  263   HG11  VAL  39          HG11      VAL  39  15.684 -20.131 -19.558
  264   HG12  VAL  39          HG12      VAL  39  15.902 -21.747 -20.333
  265   HG13  VAL  39          HG13      VAL  39  15.701 -21.622 -18.545
  266   HG21  VAL  39          HG21      VAL  39  13.020 -23.246 -19.114
  267   HG22  VAL  39          HG22      VAL  39  14.287 -23.331 -20.402
  268   HG23  VAL  39          HG23      VAL  39  12.638 -22.721 -20.799
  269    H    LYS  40           HN       LYS  40  12.439 -18.558 -19.119
  270    HA   LYS  40           HA       LYS  40  14.760 -17.180 -18.263
  271    HB2  LYS  40           HB2      LYS  40  11.901 -16.221 -18.844
  272    HB3  LYS  40           HB1      LYS  40  13.219 -15.100 -18.350
  273    HG2  LYS  40           HG2      LYS  40  14.265 -15.187 -20.387
  274    HG3  LYS  40           HG1      LYS  40  13.909 -16.934 -20.622
  275    HD2  LYS  40           HD2      LYS  40  12.284 -16.359 -22.072
  276    HD3  LYS  40           HD1      LYS  40  11.376 -15.620 -20.712
  277    HE2  LYS  40           HE2      LYS  40  11.577 -13.886 -22.379
  278    HE3  LYS  40           HE1      LYS  40  12.819 -13.478 -21.124
  279    HZ1  LYS  40           HZ1      LYS  40  14.212 -13.449 -22.805
  280    HZ2  LYS  40           HZ2      LYS  40  13.136 -14.212 -23.874
  281    HZ3  LYS  40           HZ3      LYS  40  14.113 -15.143 -22.843
  282    H    HIS  41           HN       HIS  41  11.613 -18.039 -16.828
  283    HA   HIS  41           HA       HIS  41  11.911 -16.451 -14.538
  284    HB2  HIS  41           HB2      HIS  41   9.748 -17.504 -15.050
  285    HB3  HIS  41           HB1      HIS  41  10.487 -19.126 -14.944
  286    HD2  HIS  41           HD2      HIS  41   9.392 -16.174 -12.502
  287    HE1  HIS  41           HE1      HIS  41  10.041 -19.703 -10.297
  288    HE2  HIS  41           HE2      HIS  41   9.220 -17.303 -10.215
  289    H    THR  42           HN       THR  42  12.929 -19.769 -15.449
  290    HA   THR  42           HA       THR  42  13.846 -20.487 -12.925
  291    HB   THR  42           HB       THR  42  14.828 -21.293 -15.713
  292    HG1  THR  42           HG1      THR  42  12.657 -21.808 -14.961
  293   HG21  THR  42          HG21      THR  42  15.700 -22.038 -12.910
  294   HG22  THR  42          HG22      THR  42  16.661 -21.899 -14.427
  295   HG23  THR  42          HG23      THR  42  15.615 -23.339 -14.150
  296    H    ASP  43           HN       ASP  43  15.498 -18.830 -15.717
  297    HA   ASP  43           HA       ASP  43  17.967 -18.662 -14.298
  298    HB2  ASP  43           HB2      ASP  43  16.876 -17.092 -16.701
  299    HB3  ASP  43           HB1      ASP  43  18.529 -16.837 -16.029
  300    H    CYS  44           HN       CYS  44  15.033 -16.660 -14.553
  301    HA   CYS  44           HA       CYS  44  16.180 -14.322 -13.445
  302    HB2  CYS  44           HB2      CYS  44  13.881 -14.467 -14.656
  303    HB3  CYS  44           HB1      CYS  44  13.262 -15.224 -13.153
  304    H    VAL  45           HN       VAL  45  14.661 -17.261 -12.205
  305    HA   VAL  45           HA       VAL  45  14.637 -16.264  -9.550
  306    HB   VAL  45           HB       VAL  45  14.052 -18.852 -10.928
  307   HG11  VAL  45          HG11      VAL  45  15.628 -19.614  -9.207
  308   HG12  VAL  45          HG12      VAL  45  13.956 -19.974  -8.624
  309   HG13  VAL  45          HG13      VAL  45  14.851 -18.562  -7.959
  310   HG21  VAL  45          HG21      VAL  45  12.214 -17.308 -10.583
  311   HG22  VAL  45          HG22      VAL  45  12.688 -17.022  -8.863
  312   HG23  VAL  45          HG23      VAL  45  12.022 -18.621  -9.358
  313    H    ASN  46           HN       ASN  46  16.731 -18.281 -11.582
  314    HA   ASN  46           HA       ASN  46  18.365 -19.156  -9.487
  315    HB2  ASN  46           HB2      ASN  46  18.748 -18.760 -12.460
  316    HB3  ASN  46           HB1      ASN  46  20.143 -19.195 -11.418
  317   HD21  ASN  46          HD21      ASN  46  18.562 -20.660 -13.599
  318   HD22  ASN  46          HD22      ASN  46  18.162 -22.181 -12.889
  319    H    THR  47           HN       THR  47  18.252 -16.099 -11.318
  320    HA   THR  47           HA       THR  47  20.792 -15.354 -10.096
  321    HB   THR  47           HB       THR  47  18.986 -13.768 -11.980
  322    HG1  THR  47           HG1      THR  47  19.904 -15.536 -12.982
  323   HG21  THR  47          HG21      THR  47  21.722 -13.267 -10.679
  324   HG22  THR  47          HG22      THR  47  20.276 -12.189 -10.722
  325   HG23  THR  47          HG23      THR  47  21.248 -12.458 -12.219
  326    H    GLY  48           HN       GLY  48  17.308 -14.401 -10.158
  327    HA2  GLY  48           HA2      GLY  48  17.760 -12.261  -8.342
  328    HA3  GLY  48           HA1      GLY  48  16.179 -13.024  -8.805
  329    H    CYS  49           HN       CYS  49  16.792 -15.751  -7.977
  330    HA   CYS  49           HA       CYS  49  17.463 -15.470  -5.168
  331    HB2  CYS  49           HB2      CYS  49  15.242 -16.961  -4.785
  332    HB3  CYS  49           HB1      CYS  49  15.225 -15.181  -4.631
  333    HA   PRO  50           HA       PRO  50  19.025 -19.160  -7.571
  334    HB2  PRO  50           HB2      PRO  50  21.163 -19.205  -5.615
  335    HB3  PRO  50           HB1      PRO  50  21.270 -18.699  -7.355
  336    HG2  PRO  50           HG2      PRO  50  20.952 -17.004  -4.861
  337    HG3  PRO  50           HG1      PRO  50  21.699 -16.586  -6.458
  338    HD2  PRO  50           HD2      PRO  50  19.266 -15.606  -5.716
  339    HD3  PRO  50           HD1      PRO  50  19.628 -16.032  -7.432
  Start of MODEL    9
    1    H1   SER   1           HT1      SER   1  10.647 -30.804   5.522
    2    H2   SER   1           HT2      SER   1  11.842 -29.802   6.195
    3    H3   SER   1           HT3      SER   1  11.032 -29.325   4.780
    4    HA   SER   1           HA       SER   1   9.105 -28.823   5.859
    5    HB2  SER   1           HB2      SER   1   9.101 -31.072   7.146
    6    HB3  SER   1           HB1      SER   1  10.124 -30.244   8.387
    7    HG   SER   1           HG       SER   1   8.496 -28.915   8.860
    8    H    SER   2           HN       SER   2  10.676 -26.892   5.419
    9    HA   SER   2           HA       SER   2  10.928 -25.535   7.943
   10    HB2  SER   2           HB2      SER   2  13.221 -26.626   7.722
   11    HB3  SER   2           HB1      SER   2  13.383 -25.843   6.099
   12    HG   SER   2           HG       SER   2  13.521 -23.921   7.021
   13    H    THR   3           HN       THR   3  10.873 -23.221   7.631
   14    HA   THR   3           HA       THR   3   9.804 -22.548   5.068
   15    HB   THR   3           HB       THR   3  10.580 -20.716   7.385
   16    HG1  THR   3           HG1      THR   3   8.018 -20.890   7.177
   17   HG21  THR   3          HG21      THR   3   9.056 -19.101   6.260
   18   HG22  THR   3          HG22      THR   3   8.743 -20.296   4.947
   19   HG23  THR   3          HG23      THR   3  10.391 -19.593   5.153
   20    HA   PRO   4           HA       PRO   4  13.741 -21.697   3.301
   21    HB2  PRO   4           HB2      PRO   4  12.814 -20.175   1.156
   22    HB3  PRO   4           HB1      PRO   4  12.813 -21.990   1.198
   23    HG2  PRO   4           HG2      PRO   4  10.546 -20.030   1.768
   24    HG3  PRO   4           HG1      PRO   4  10.508 -21.617   0.895
   25    HD2  PRO   4           HD2      PRO   4   9.646 -21.338   3.493
   26    HD3  PRO   4           HD1      PRO   4  10.423 -22.856   2.884
   27    H    ASP   5           HN       ASP   5  11.531 -18.850   2.928
   28    HA   ASP   5           HA       ASP   5  13.148 -17.333   4.665
   29    HB2  ASP   5           HB2      ASP   5  14.393 -17.382   2.337
   30    HB3  ASP   5           HB1      ASP   5  13.041 -16.332   1.805
   31    H    GLY   6           HN       GLY   6  12.166 -15.024   2.644
   32    HA2  GLY   6           HA2      GLY   6   9.367 -15.214   2.769
   33    HA3  GLY   6           HA1      GLY   6  10.058 -14.169   4.092
   34    H    THR   7           HN       THR   7  12.444 -13.418   2.454
   35    HA   THR   7           HA       THR   7  11.029 -11.451   0.789
   36    HB   THR   7           HB       THR   7  13.910 -11.546   1.823
   37    HG1  THR   7           HG1      THR   7  12.491  -9.334   2.329
   38   HG21  THR   7          HG21      THR   7  14.066 -10.564  -0.354
   39   HG22  THR   7          HG22      THR   7  13.898  -9.150   0.756
   40   HG23  THR   7          HG23      THR   7  12.475  -9.728  -0.191
   41    H    TRP   8           HN       TRP   8  13.363 -14.087   0.872
   42    HA   TRP   8           HA       TRP   8  14.336 -13.795  -1.707
   43    HB2  TRP   8           HB2      TRP   8  15.586 -15.441  -0.684
   44    HB3  TRP   8           HB1      TRP   8  14.253 -15.902   0.389
   45    HD1  TRP   8           HD1      TRP   8  15.926 -16.952  -2.897
   46    HE1  TRP   8           HE1      TRP   8  14.803 -19.085  -3.715
   47    HE3  TRP   8           HE3      TRP   8  12.008 -17.100   0.326
   48    HZ2  TRP   8           HZ2      TRP   8  12.544 -20.619  -3.064
   49    HZ3  TRP   8           HZ3      TRP   8  10.397 -18.932   0.169
   50    HH2  TRP   8           HH2      TRP   8  10.667 -20.677  -1.520
   51    H    VAL   9           HN       VAL   9  11.353 -15.274  -0.354
   52    HA   VAL   9           HA       VAL   9  10.632 -16.537  -2.790
   53    HB   VAL   9           HB       VAL   9   9.671 -17.169  -0.551
   54   HG11  VAL   9          HG11      VAL   9   7.796 -14.787  -0.808
   55   HG12  VAL   9          HG12      VAL   9   9.433 -14.509  -0.114
   56   HG13  VAL   9          HG13      VAL   9   8.319 -15.691   0.661
   57   HG21  VAL   9          HG21      VAL   9   8.638 -17.805  -2.731
   58   HG22  VAL   9          HG22      VAL   9   7.698 -16.252  -2.733
   59   HG23  VAL   9          HG23      VAL   9   7.389 -17.503  -1.464
   60    H    LYS  10           HN       LYS  10  10.415 -13.239  -1.524
   61    HA   LYS  10           HA       LYS  10   8.255 -12.433  -3.135
   62    HB2  LYS  10           HB2      LYS  10  10.679 -10.829  -2.116
   63    HB3  LYS  10           HB1      LYS  10   9.291 -10.090  -2.985
   64    HG2  LYS  10           HG2      LYS  10   7.737 -10.881  -1.198
   65    HG3  LYS  10           HG1      LYS  10   9.120 -11.626  -0.326
   66    HD2  LYS  10           HD2      LYS  10  10.186  -9.374  -0.087
   67    HD3  LYS  10           HD1      LYS  10   8.808  -8.626  -0.967
   68    HE2  LYS  10           HE2      LYS  10   7.239  -9.374   0.846
   69    HE3  LYS  10           HE1      LYS  10   8.624 -10.138   1.729
   70    HZ1  LYS  10           HZ1      LYS  10   7.759  -7.476   1.757
   71    HZ2  LYS  10           HZ2      LYS  10   9.320  -7.507   1.089
   72    HZ3  LYS  10           HZ3      LYS  10   9.035  -8.198   2.613
   73    H    CYS  11           HN       CYS  11  11.626 -13.229  -3.762
   74    HA   CYS  11           HA       CYS  11  11.736 -11.809  -6.225
   75    HB2  CYS  11           HB2      CYS  11  13.929 -12.264  -5.491
   76    HB3  CYS  11           HB1      CYS  11  13.461 -13.839  -4.811
   77    H    ARG  12           HN       ARG  12  11.028 -15.137  -5.084
   78    HA   ARG  12           HA       ARG  12  10.808 -16.317  -7.555
   79    HB2  ARG  12           HB2      ARG  12   9.104 -16.784  -5.057
   80    HB3  ARG  12           HB1      ARG  12   9.197 -17.877  -6.451
   81    HG2  ARG  12           HG2      ARG  12  11.730 -17.101  -5.015
   82    HG3  ARG  12           HG1      ARG  12  10.635 -18.328  -4.299
   83    HD2  ARG  12           HD2      ARG  12  10.767 -19.654  -6.464
   84    HD3  ARG  12           HD1      ARG  12  11.993 -18.450  -7.059
   85    HE   ARG  12           HE       ARG  12  13.024 -19.187  -4.621
   86   HH11  ARG  12          HH11      ARG  12  11.716 -20.986  -7.405
   87   HH12  ARG  12          HH12      ARG  12  12.751 -22.358  -7.204
   88   HH21  ARG  12          HH21      ARG  12  14.440 -21.067  -4.349
   89   HH22  ARG  12          HH22      ARG  12  14.324 -22.406  -5.440
   90    H    HIS  13           HN       HIS  13   8.481 -14.489  -5.547
   91    HA   HIS  13           HA       HIS  13   6.371 -14.830  -7.436
   92    HB2  HIS  13           HB2      HIS  13   5.727 -14.282  -5.150
   93    HB3  HIS  13           HB1      HIS  13   6.809 -12.844  -5.140
   94    HD2  HIS  13           HD2      HIS  13   5.583 -10.499  -5.881
   95    HE1  HIS  13           HE1      HIS  13   2.066 -12.245  -7.452
   96    HE2  HIS  13           HE2      HIS  13   3.248 -10.075  -6.851
   97    H    ASP  14           HN       ASP  14   8.906 -12.338  -6.842
   98    HA   ASP  14           HA       ASP  14   7.849 -10.398  -8.549
   99    HB2  ASP  14           HB2      ASP  14   9.924 -10.167  -6.991
  100    HB3  ASP  14           HB1      ASP  14  10.847 -10.976  -8.297
  101    H    CYS  15           HN       CYS  15  10.260 -13.057  -9.264
  102    HA   CYS  15           HA       CYS  15  10.268 -12.348 -12.032
  103    HB2  CYS  15           HB2      CYS  15  11.096 -14.967 -10.631
  104    HB3  CYS  15           HB1      CYS  15  11.341 -14.639 -12.374
  105    H    PHE  16           HN       PHE  16   8.254 -14.306  -9.914
  106    HA   PHE  16           HA       PHE  16   7.198 -15.964 -11.905
  107    HB2  PHE  16           HB2      PHE  16   6.761 -16.316  -9.472
  108    HB3  PHE  16           HB1      PHE  16   5.774 -14.819  -9.456
  109    HD1  PHE  16           HD1      PHE  16   6.049 -17.911 -11.545
  110    HD2  PHE  16           HD2      PHE  16   3.567 -15.161  -9.456
  111    HE1  PHE  16           HE1      PHE  16   4.072 -19.224 -12.145
  112    HE2  PHE  16           HE2      PHE  16   1.597 -16.485 -10.065
  113    HZ   PHE  16           HZ       PHE  16   1.849 -18.515 -11.408
  114    H    THR  17           HN       THR  17   6.163 -12.735 -10.621
  115    HA   THR  17           HA       THR  17   3.930 -12.592 -12.344
  116    HB   THR  17           HB       THR  17   4.040 -10.126 -11.989
  117    HG1  THR  17           HG1      THR  17   6.543 -10.875 -10.943
  118   HG21  THR  17          HG21      THR  17   4.685 -11.056  -9.250
  119   HG22  THR  17          HG22      THR  17   3.564 -12.168 -10.124
  120   HG23  THR  17          HG23      THR  17   3.134 -10.427  -9.920
  121    H    LYS  18           HN       LYS  18   7.408 -11.718 -12.709
  122    HA   LYS  18           HA       LYS  18   7.058 -10.432 -15.182
  123    HB2  LYS  18           HB2      LYS  18   9.424 -11.811 -13.856
  124    HB3  LYS  18           HB1      LYS  18   9.537 -11.289 -15.571
  125    HG2  LYS  18           HG2      LYS  18  10.354  -9.689 -13.621
  126    HG3  LYS  18           HG1      LYS  18   9.494  -9.023 -15.050
  127    HD2  LYS  18           HD2      LYS  18   7.486  -8.690 -13.851
  128    HD3  LYS  18           HD1      LYS  18   7.927  -9.874 -12.580
  129    HE2  LYS  18           HE2      LYS  18   8.068  -7.538 -11.725
  130    HE3  LYS  18           HE1      LYS  18   9.704  -8.310 -11.743
  131    HZ1  LYS  18           HZ1      LYS  18   9.530  -7.194 -14.187
  132    HZ2  LYS  18           HZ2      LYS  18  10.271  -6.492 -12.831
  133    HZ3  LYS  18           HZ3      LYS  18   8.677  -6.074 -13.241
  134    H    TYR  19           HN       TYR  19   7.230 -13.802 -14.127
  135    HA   TYR  19           HA       TYR  19   7.717 -14.782 -16.760
  136    HB2  TYR  19           HB2      TYR  19   8.331 -16.367 -15.150
  137    HB3  TYR  19           HB1      TYR  19   6.938 -15.990 -14.096
  138    HD1  TYR  19           HD1      TYR  19   7.849 -17.524 -17.356
  139    HD2  TYR  19           HD2      TYR  19   5.090 -17.289 -14.147
  140    HE1  TYR  19           HE1      TYR  19   6.645 -19.448 -18.266
  141    HE2  TYR  19           HE2      TYR  19   3.885 -19.212 -15.056
  142    HH   TYR  19           HH       TYR  19   3.553 -20.360 -17.195
  143    H    LYS  20           HN       LYS  20   4.861 -14.514 -14.557
  144    HA   LYS  20           HA       LYS  20   3.056 -15.624 -16.351
  145    HB2  LYS  20           HB2      LYS  20   2.564 -13.316 -14.397
  146    HB3  LYS  20           HB1      LYS  20   1.307 -14.351 -15.140
  147    HG2  LYS  20           HG2      LYS  20   3.535 -15.376 -13.331
  148    HG3  LYS  20           HG1      LYS  20   1.888 -14.970 -12.784
  149    HD2  LYS  20           HD2      LYS  20   2.089 -16.861 -15.123
  150    HD3  LYS  20           HD1      LYS  20   2.668 -17.485 -13.541
  151    HE2  LYS  20           HE2      LYS  20   0.449 -16.902 -12.508
  152    HE3  LYS  20           HE1      LYS  20  -0.130 -16.300 -14.114
  153    HZ1  LYS  20           HZ1      LYS  20   0.838 -18.762 -14.671
  154    HZ2  LYS  20           HZ2      LYS  20  -0.790 -18.367 -14.390
  155    HZ3  LYS  20           HZ3      LYS  20   0.164 -18.983 -13.128
  156    H    SER  21           HN       SER  21   4.436 -12.356 -15.979
  157    HA   SER  21           HA       SER  21   2.695 -11.138 -17.847
  158    HB2  SER  21           HB2      SER  21   4.242  -9.788 -16.341
  159    HB3  SER  21           HB1      SER  21   5.646 -10.428 -17.286
  160    HG   SER  21           HG       SER  21   4.178  -9.562 -19.126
  161    H    CYS  22           HN       CYS  22   5.683 -13.100 -18.113
  162    HA   CYS  22           HA       CYS  22   6.124 -12.525 -20.843
  163    HB2  CYS  22           HB2      CYS  22   7.757 -13.697 -19.171
  164    HB3  CYS  22           HB1      CYS  22   6.778 -15.167 -19.468
  165    H    GLN  23           HN       GLN  23   4.149 -14.937 -19.058
  166    HA   GLN  23           HA       GLN  23   3.480 -16.381 -21.412
  167    HB2  GLN  23           HB2      GLN  23   2.245 -16.218 -18.612
  168    HB3  GLN  23           HB1      GLN  23   1.419 -17.117 -19.934
  169    HG2  GLN  23           HG2      GLN  23   3.746 -18.364 -20.235
  170    HG3  GLN  23           HG1      GLN  23   4.086 -17.738 -18.571
  171   HE21  GLN  23          HE21      GLN  23   2.226 -20.014 -20.503
  172   HE22  GLN  23          HE22      GLN  23   1.389 -20.784 -19.198
  173    H    MET  24           HN       MET  24   2.443 -13.350 -19.941
  174    HA   MET  24           HA       MET  24  -0.073 -13.391 -21.353
  175    HB2  MET  24           HB2      MET  24   1.398 -11.185 -19.830
  176    HB3  MET  24           HB1      MET  24  -0.197 -10.973 -20.615
  177    HG2  MET  24           HG2      MET  24   0.364 -13.094 -18.500
  178    HG3  MET  24           HG1      MET  24  -0.216 -11.455 -18.118
  179    HE1  MET  24           HE1      MET  24  -2.286 -15.119 -19.785
  180    HE2  MET  24           HE2      MET  24  -1.619 -14.946 -18.125
  181    HE3  MET  24           HE3      MET  24  -0.542 -14.747 -19.552
  182    H    SER  25           HN       SER  25   3.247 -12.687 -21.930
  183    HA   SER  25           HA       SER  25   2.815 -10.636 -23.837
  184    HB2  SER  25           HB2      SER  25   5.156 -12.624 -23.602
  185    HB3  SER  25           HB1      SER  25   5.141 -11.155 -24.660
  186    HG   SER  25           HG       SER  25   4.573 -10.953 -21.906
  187    H    ASP  26           HN       ASP  26   3.315 -10.954 -26.237
  188    HA   ASP  26           HA       ASP  26   1.703 -13.174 -27.113
  189    HB2  ASP  26           HB2      ASP  26   3.131 -10.912 -28.603
  190    HB3  ASP  26           HB1      ASP  26   2.219 -12.219 -29.438
  191    H    SER  27           HN       SER  27   4.694 -13.099 -25.946
  192    HA   SER  27           HA       SER  27   6.086 -14.270 -28.165
  193    HB2  SER  27           HB2      SER  27   6.825 -14.143 -25.172
  194    HB3  SER  27           HB1      SER  27   7.913 -14.754 -26.484
  195    HG   SER  27           HG       SER  27   8.479 -12.737 -26.414
  196    H    CYS  28           HN       CYS  28   3.727 -15.191 -25.882
  197    HA   CYS  28           HA       CYS  28   4.685 -17.919 -25.741
  198    HB2  CYS  28           HB2      CYS  28   3.492 -16.851 -23.762
  199    HB3  CYS  28           HB1      CYS  28   2.037 -16.696 -24.803
  200    H    HIS  29           HN       HIS  29   4.679 -17.847 -28.261
  201    HA   HIS  29           HA       HIS  29   1.942 -18.253 -29.215
  202    HB2  HIS  29           HB2      HIS  29   2.919 -18.139 -31.515
  203    HB3  HIS  29           HB1      HIS  29   3.287 -16.649 -30.585
  204    HD2  HIS  29           HD2      HIS  29   6.037 -16.308 -29.885
  205    HE1  HIS  29           HE1      HIS  29   7.372 -19.519 -32.285
  206    HE2  HIS  29           HE2      HIS  29   8.060 -17.487 -30.921
  207    H    ASP  30           HN       ASP  30   5.075 -19.753 -28.573
  208    HA   ASP  30           HA       ASP  30   3.915 -22.242 -29.567
  209    HB2  ASP  30           HB2      ASP  30   6.386 -21.098 -30.366
  210    HB3  ASP  30           HB1      ASP  30   6.843 -22.298 -29.107
  211    H    GLU  31           HN       GLU  31   4.740 -24.188 -28.279
  212    HA   GLU  31           HA       GLU  31   4.308 -23.598 -25.541
  213    HB2  GLU  31           HB2      GLU  31   5.280 -26.159 -26.940
  214    HB3  GLU  31           HB1      GLU  31   4.960 -26.050 -25.171
  215    HG2  GLU  31           HG2      GLU  31   2.557 -25.503 -25.596
  216    HG3  GLU  31           HG1      GLU  31   2.859 -25.544 -27.380
  217    H    GLN  32           HN       GLN  32   7.155 -24.355 -27.620
  218    HA   GLN  32           HA       GLN  32   8.951 -24.540 -25.453
  219    HB2  GLN  32           HB2      GLN  32   9.445 -25.348 -27.806
  220    HB3  GLN  32           HB1      GLN  32   9.527 -23.634 -28.312
  221    HG2  GLN  32           HG2      GLN  32  11.443 -23.217 -26.800
  222    HG3  GLN  32           HG1      GLN  32  11.335 -24.911 -26.174
  223   HE21  GLN  32          HE21      GLN  32  13.733 -24.461 -27.162
  224   HE22  GLN  32          HE22      GLN  32  13.951 -25.084 -28.760
  225    H    SER  33           HN       SER  33   7.803 -21.879 -27.581
  226    HA   SER  33           HA       SER  33   9.600 -19.973 -26.597
  227    HB2  SER  33           HB2      SER  33   6.731 -19.566 -27.637
  228    HB3  SER  33           HB1      SER  33   7.928 -18.238 -27.364
  229    HG   SER  33           HG       SER  33   8.006 -18.832 -29.474
  230    H    CYS  34           HN       CYS  34   6.347 -21.110 -25.486
  231    HA   CYS  34           HA       CYS  34   6.232 -19.139 -23.429
  232    HB2  CYS  34           HB2      CYS  34   4.420 -21.053 -24.463
  233    HB3  CYS  34           HB1      CYS  34   4.822 -21.681 -22.829
  234    H    HIS  35           HN       HIS  35   7.656 -22.389 -23.835
  235    HA   HIS  35           HA       HIS  35   8.027 -22.860 -21.066
  236    HB2  HIS  35           HB2      HIS  35   8.296 -24.728 -22.679
  237    HB3  HIS  35           HB1      HIS  35   9.639 -23.843 -23.487
  238    HD2  HIS  35           HD2      HIS  35  12.085 -24.655 -22.622
  239    HE1  HIS  35           HE1      HIS  35  10.868 -26.152 -18.858
  240    HE2  HIS  35           HE2      HIS  35  12.808 -25.853 -20.473
  241    H    GLN  36           HN       GLN  36   9.820 -21.085 -23.607
  242    HA   GLN  36           HA       GLN  36  12.197 -20.773 -22.177
  243    HB2  GLN  36           HB2      GLN  36  10.808 -18.914 -24.156
  244    HB3  GLN  36           HB1      GLN  36  12.438 -18.596 -23.492
  245    HG2  GLN  36           HG2      GLN  36  11.827 -21.264 -24.857
  246    HG3  GLN  36           HG1      GLN  36  12.232 -19.791 -25.825
  247   HE21  GLN  36          HE21      GLN  36  13.441 -22.249 -23.614
  248   HE22  GLN  36          HE22      GLN  36  15.093 -21.757 -23.628
  249    H    CYS  37           HN       CYS  37   9.049 -19.115 -22.042
  250    HA   CYS  37           HA       CYS  37   9.921 -16.951 -20.487
  251    HB2  CYS  37           HB2      CYS  37   7.230 -18.396 -20.563
  252    HB3  CYS  37           HB1      CYS  37   7.525 -16.918 -19.612
  253    H    HIS  38           HN       HIS  38   8.884 -20.259 -19.735
  254    HA   HIS  38           HA       HIS  38   8.917 -19.819 -16.932
  255    HB2  HIS  38           HB2      HIS  38   7.629 -21.712 -18.024
  256    HB3  HIS  38           HB1      HIS  38   9.214 -22.462 -18.439
  257    HD2  HIS  38           HD2      HIS  38  10.732 -23.344 -16.149
  258    HE1  HIS  38           HE1      HIS  38   7.335 -23.267 -13.624
  259    HE2  HIS  38           HE2      HIS  38   9.741 -24.062 -13.891
  260    H    VAL  39           HN       VAL  39  11.170 -20.994 -19.411
  261    HA   VAL  39           HA       VAL  39  13.122 -21.841 -17.565
  262    HB   VAL  39           HB       VAL  39  13.329 -20.831 -20.430
  263   HG11  VAL  39          HG11      VAL  39  15.416 -21.866 -18.433
  264   HG12  VAL  39          HG12      VAL  39  15.475 -20.387 -19.466
  265   HG13  VAL  39          HG13      VAL  39  15.648 -22.020 -20.215
  266   HG21  VAL  39          HG21      VAL  39  12.367 -22.877 -20.749
  267   HG22  VAL  39          HG22      VAL  39  12.686 -23.398 -19.046
  268   HG23  VAL  39          HG23      VAL  39  13.980 -23.545 -20.298
  269    H    LYS  40           HN       LYS  40  12.285 -18.693 -19.104
  270    HA   LYS  40           HA       LYS  40  14.640 -17.394 -18.212
  271    HB2  LYS  40           HB2      LYS  40  11.828 -16.321 -18.821
  272    HB3  LYS  40           HB1      LYS  40  13.202 -15.259 -18.352
  273    HG2  LYS  40           HG2      LYS  40  14.263 -15.471 -20.382
  274    HG3  LYS  40           HG1      LYS  40  13.744 -17.177 -20.606
  275    HD2  LYS  40           HD2      LYS  40  12.221 -16.420 -22.088
  276    HD3  LYS  40           HD1      LYS  40  11.330 -15.707 -20.705
  277    HE2  LYS  40           HE2      LYS  40  12.498 -13.549 -20.993
  278    HE3  LYS  40           HE1      LYS  40  13.553 -14.254 -22.286
  279    HZ1  LYS  40           HZ1      LYS  40  10.619 -14.369 -22.547
  280    HZ2  LYS  40           HZ2      LYS  40  11.825 -14.340 -23.743
  281    HZ3  LYS  40           HZ3      LYS  40  11.447 -12.925 -22.883
  282    H    HIS  41           HN       HIS  41  11.438 -18.121 -16.830
  283    HA   HIS  41           HA       HIS  41  11.759 -16.531 -14.543
  284    HB2  HIS  41           HB2      HIS  41   9.566 -17.502 -15.099
  285    HB3  HIS  41           HB1      HIS  41  10.237 -19.150 -14.956
  286    HD2  HIS  41           HD2      HIS  41   9.211 -16.122 -12.575
  287    HE1  HIS  41           HE1      HIS  41   9.653 -19.648 -10.314
  288    HE2  HIS  41           HE2      HIS  41   8.937 -17.213 -10.281
  289    H    THR  42           HN       THR  42  12.653 -19.898 -15.410
  290    HA   THR  42           HA       THR  42  13.490 -20.633 -12.864
  291    HB   THR  42           HB       THR  42  14.492 -21.504 -15.624
  292    HG1  THR  42           HG1      THR  42  12.279 -21.911 -14.890
  293   HG21  THR  42          HG21      THR  42  15.271 -22.264 -12.796
  294   HG22  THR  42          HG22      THR  42  16.268 -22.183 -14.294
  295   HG23  THR  42          HG23      THR  42  15.152 -23.572 -14.027
  296    H    ASP  43           HN       ASP  43  15.268 -19.077 -15.638
  297    HA   ASP  43           HA       ASP  43  17.711 -19.004 -14.168
  298    HB2  ASP  43           HB2      ASP  43  16.741 -17.413 -16.611
  299    HB3  ASP  43           HB1      ASP  43  18.389 -17.224 -15.906
  300    H    CYS  44           HN       CYS  44  14.874 -16.878 -14.503
  301    HA   CYS  44           HA       CYS  44  16.106 -14.579 -13.396
  302    HB2  CYS  44           HB2      CYS  44  13.832 -14.630 -14.659
  303    HB3  CYS  44           HB1      CYS  44  13.142 -15.343 -13.166
  304    H    VAL  45           HN       VAL  45  14.424 -17.431 -12.156
  305    HA   VAL  45           HA       VAL  45  14.389 -16.402  -9.513
  306    HB   VAL  45           HB       VAL  45  13.713 -18.979 -10.872
  307   HG11  VAL  45          HG11      VAL  45  15.213 -19.786  -9.101
  308   HG12  VAL  45          HG12      VAL  45  13.511 -20.062  -8.556
  309   HG13  VAL  45          HG13      VAL  45  14.452 -18.681  -7.886
  310   HG21  VAL  45          HG21      VAL  45  12.392 -17.047  -8.875
  311   HG22  VAL  45          HG22      VAL  45  11.663 -18.628  -9.343
  312   HG23  VAL  45          HG23      VAL  45  11.939 -17.355 -10.595
  313    H    ASN  46           HN       ASN  46  16.427 -18.541 -11.475
  314    HA   ASN  46           HA       ASN  46  17.971 -19.467  -9.335
  315    HB2  ASN  46           HB2      ASN  46  18.438 -19.124 -12.303
  316    HB3  ASN  46           HB1      ASN  46  19.789 -19.609 -11.226
  317   HD21  ASN  46          HD21      ASN  46  18.196 -21.027 -13.425
  318   HD22  ASN  46          HD22      ASN  46  17.710 -22.519 -12.708
  319    H    THR  47           HN       THR  47  18.043 -16.434 -11.200
  320    HA   THR  47           HA       THR  47  20.587 -15.797  -9.929
  321    HB   THR  47           HB       THR  47  18.904 -14.156 -11.876
  322    HG1  THR  47           HG1      THR  47  19.755 -15.966 -12.846
  323   HG21  THR  47          HG21      THR  47  21.216 -12.947 -12.080
  324   HG22  THR  47          HG22      THR  47  21.635 -13.767 -10.528
  325   HG23  THR  47          HG23      THR  47  20.238 -12.626 -10.598
  326    H    GLY  48           HN       GLY  48  17.156 -14.675 -10.085
  327    HA2  GLY  48           HA2      GLY  48  17.674 -12.537  -8.282
  328    HA3  GLY  48           HA1      GLY  48  16.067 -13.222  -8.778
  329    H    CYS  49           HN       CYS  49  16.517 -15.968  -7.905
  330    HA   CYS  49           HA       CYS  49  17.130 -15.689  -5.081
  331    HB2  CYS  49           HB2      CYS  49  14.829 -17.063  -4.738
  332    HB3  CYS  49           HB1      CYS  49  14.893 -15.282  -4.611
  333    HA   PRO  50           HA       PRO  50  18.573 -19.474  -7.411
  334    HB2  PRO  50           HB2      PRO  50  20.637 -19.607  -5.375
  335    HB3  PRO  50           HB1      PRO  50  20.831 -19.139  -7.117
  336    HG2  PRO  50           HG2      PRO  50  20.531 -17.385  -4.665
  337    HG3  PRO  50           HG1      PRO  50  21.337 -17.031  -6.249
  338    HD2  PRO  50           HD2      PRO  50  18.936 -15.921  -5.579
  339    HD3  PRO  50           HD1      PRO  50  19.323 -16.381  -7.280
  Start of MODEL   10
    1    H1   SER   1           HT1      SER   1  10.532 -30.937   5.895
    2    H2   SER   1           HT2      SER   1  11.711 -29.904   6.552
    3    H3   SER   1           HT3      SER   1  11.096 -29.611   4.995
    4    HA   SER   1           HA       SER   1   9.152 -28.777   5.733
    5    HB2  SER   1           HB2      SER   1   8.703 -30.884   7.173
    6    HB3  SER   1           HB1      SER   1   9.598 -30.040   8.499
    7    HG   SER   1           HG       SER   1   8.038 -28.614   8.671
    8    H    SER   2           HN       SER   2  10.616 -26.882   5.421
    9    HA   SER   2           HA       SER   2  10.870 -25.507   7.937
   10    HB2  SER   2           HB2      SER   2  13.150 -26.626   7.738
   11    HB3  SER   2           HB1      SER   2  13.328 -25.866   6.106
   12    HG   SER   2           HG       SER   2  13.530 -23.949   6.998
   13    H    THR   3           HN       THR   3  10.824 -23.200   7.610
   14    HA   THR   3           HA       THR   3   9.786 -22.534   5.035
   15    HB   THR   3           HB       THR   3  10.557 -20.700   7.351
   16    HG1  THR   3           HG1      THR   3   8.027 -20.801   7.192
   17   HG21  THR   3          HG21      THR   3   8.757 -20.265   4.889
   18   HG22  THR   3          HG22      THR   3  10.411 -19.583   5.110
   19   HG23  THR   3          HG23      THR   3   9.069 -19.069   6.199
   20    HA   PRO   4           HA       PRO   4  13.744 -21.730   3.295
   21    HB2  PRO   4           HB2      PRO   4  12.845 -20.224   1.129
   22    HB3  PRO   4           HB1      PRO   4  12.830 -22.037   1.188
   23    HG2  PRO   4           HG2      PRO   4  10.573 -20.057   1.724
   24    HG3  PRO   4           HG1      PRO   4  10.531 -21.651   0.863
   25    HD2  PRO   4           HD2      PRO   4   9.651 -21.348   3.449
   26    HD3  PRO   4           HD1      PRO   4  10.426 -22.875   2.860
   27    H    ASP   5           HN       ASP   5  11.542 -18.878   2.903
   28    HA   ASP   5           HA       ASP   5  13.169 -17.351   4.622
   29    HB2  ASP   5           HB2      ASP   5  14.404 -17.419   2.291
   30    HB3  ASP   5           HB1      ASP   5  13.053 -16.372   1.755
   31    H    GLY   6           HN       GLY   6  12.184 -15.054   2.589
   32    HA2  GLY   6           HA2      GLY   6   9.384 -15.238   2.733
   33    HA3  GLY   6           HA1      GLY   6  10.088 -14.178   4.037
   34    H    THR   7           HN       THR   7  12.460 -13.442   2.386
   35    HA   THR   7           HA       THR   7  11.037 -11.502   0.697
   36    HB   THR   7           HB       THR   7  13.920 -11.582   1.730
   37    HG1  THR   7           HG1      THR   7  12.702  -9.350   2.275
   38   HG21  THR   7          HG21      THR   7  14.081 -10.643  -0.468
   39   HG22  THR   7          HG22      THR   7  13.919  -9.207   0.613
   40   HG23  THR   7          HG23      THR   7  12.494  -9.797  -0.322
   41    H    TRP   8           HN       TRP   8  13.371 -14.135   0.810
   42    HA   TRP   8           HA       TRP   8  14.333 -13.875  -1.776
   43    HB2  TRP   8           HB2      TRP   8  15.593 -15.497  -0.723
   44    HB3  TRP   8           HB1      TRP   8  14.253 -15.965   0.342
   45    HD1  TRP   8           HD1      TRP   8  15.957 -17.011  -2.929
   46    HE1  TRP   8           HE1      TRP   8  14.856 -19.155  -3.748
   47    HE3  TRP   8           HE3      TRP   8  12.023 -17.180   0.272
   48    HZ2  TRP   8           HZ2      TRP   8  12.603 -20.704  -3.104
   49    HZ3  TRP   8           HZ3      TRP   8  10.426 -19.024   0.109
   50    HH2  TRP   8           HH2      TRP   8  10.719 -20.771  -1.572
   51    H    VAL   9           HN       VAL   9  11.361 -15.360  -0.389
   52    HA   VAL   9           HA       VAL   9  10.636 -16.645  -2.815
   53    HB   VAL   9           HB       VAL   9   9.694 -17.276  -0.568
   54   HG11  VAL   9          HG11      VAL   9   8.328 -15.806   0.647
   55   HG12  VAL   9          HG12      VAL   9   7.807 -14.900  -0.822
   56   HG13  VAL   9          HG13      VAL   9   9.443 -14.623  -0.124
   57   HG21  VAL   9          HG21      VAL   9   8.649 -17.926  -2.739
   58   HG22  VAL   9          HG22      VAL   9   7.699 -16.382  -2.738
   59   HG23  VAL   9          HG23      VAL   9   7.408 -17.629  -1.463
   60    H    LYS  10           HN       LYS  10  10.370 -13.351  -1.538
   61    HA   LYS  10           HA       LYS  10   8.213 -12.575  -3.165
   62    HB2  LYS  10           HB2      LYS  10  10.589 -10.962  -2.062
   63    HB3  LYS  10           HB1      LYS  10   9.261 -10.214  -3.013
   64    HG2  LYS  10           HG2      LYS  10   7.599 -10.849  -1.333
   65    HG3  LYS  10           HG1      LYS  10   8.817 -11.808  -0.424
   66    HD2  LYS  10           HD2      LYS  10   8.513  -9.694   0.734
   67    HD3  LYS  10           HD1      LYS  10  10.136  -9.671  -0.037
   68    HE2  LYS  10           HE2      LYS  10   9.268  -8.255  -1.895
   69    HE3  LYS  10           HE1      LYS  10   7.596  -8.334  -1.200
   70    HZ1  LYS  10           HZ1      LYS  10   9.513  -7.509   0.738
   71    HZ2  LYS  10           HZ2      LYS  10   8.099  -6.739   0.196
   72    HZ3  LYS  10           HZ3      LYS  10   9.563  -6.510  -0.635
   73    H    CYS  11           HN       CYS  11  11.595 -13.327  -3.767
   74    HA   CYS  11           HA       CYS  11  11.711 -11.887  -6.220
   75    HB2  CYS  11           HB2      CYS  11  13.904 -12.318  -5.462
   76    HB3  CYS  11           HB1      CYS  11  13.450 -13.908  -4.808
   77    H    ARG  12           HN       ARG  12  11.034 -15.232  -5.108
   78    HA   ARG  12           HA       ARG  12  10.852 -16.394  -7.591
   79    HB2  ARG  12           HB2      ARG  12   9.141 -16.907  -5.107
   80    HB3  ARG  12           HB1      ARG  12   9.257 -17.986  -6.510
   81    HG2  ARG  12           HG2      ARG  12  11.771 -17.188  -5.057
   82    HG3  ARG  12           HG1      ARG  12  10.690 -18.434  -4.353
   83    HD2  ARG  12           HD2      ARG  12  10.847 -19.744  -6.527
   84    HD3  ARG  12           HD1      ARG  12  12.061 -18.521  -7.109
   85    HE   ARG  12           HE       ARG  12  13.081 -19.268  -4.661
   86   HH11  ARG  12          HH11      ARG  12  11.842 -21.043  -7.492
   87   HH12  ARG  12          HH12      ARG  12  12.902 -22.400  -7.303
   88   HH21  ARG  12          HH21      ARG  12  14.530 -21.126  -4.405
   89   HH22  ARG  12          HH22      ARG  12  14.454 -22.447  -5.520
   90    H    HIS  13           HN       HIS  13   8.481 -14.620  -5.582
   91    HA   HIS  13           HA       HIS  13   6.393 -14.974  -7.500
   92    HB2  HIS  13           HB2      HIS  13   5.722 -14.481  -5.206
   93    HB3  HIS  13           HB1      HIS  13   6.766 -13.015  -5.167
   94    HD2  HIS  13           HD2      HIS  13   5.480 -10.694  -5.871
   95    HE1  HIS  13           HE1      HIS  13   2.028 -12.506  -7.512
   96    HE2  HIS  13           HE2      HIS  13   3.144 -10.317  -6.856
   97    H    ASP  14           HN       ASP  14   8.882 -12.454  -6.836
   98    HA   ASP  14           HA       ASP  14   7.817 -10.489  -8.502
   99    HB2  ASP  14           HB2      ASP  14   9.876 -10.254  -6.940
  100    HB3  ASP  14           HB1      ASP  14  10.817 -11.061  -8.233
  101    H    CYS  15           HN       CYS  15  10.248 -13.111  -9.271
  102    HA   CYS  15           HA       CYS  15  10.247 -12.336 -12.025
  103    HB2  CYS  15           HB2      CYS  15  11.109 -14.976 -10.681
  104    HB3  CYS  15           HB1      CYS  15  11.350 -14.606 -12.416
  105    H    PHE  16           HN       PHE  16   8.256 -14.362  -9.948
  106    HA   PHE  16           HA       PHE  16   7.221 -15.981 -11.986
  107    HB2  PHE  16           HB2      PHE  16   6.813 -16.414  -9.557
  108    HB3  PHE  16           HB1      PHE  16   5.776 -14.950  -9.501
  109    HD1  PHE  16           HD1      PHE  16   6.172 -18.025 -11.593
  110    HD2  PHE  16           HD2      PHE  16   3.579 -15.308  -9.603
  111    HE1  PHE  16           HE1      PHE  16   4.239 -19.376 -12.248
  112    HE2  PHE  16           HE2      PHE  16   1.652 -16.668 -10.269
  113    HZ   PHE  16           HZ       PHE  16   1.984 -18.704 -11.589
  114    H    THR  17           HN       THR  17   6.170 -12.796 -10.610
  115    HA   THR  17           HA       THR  17   3.903 -12.634 -12.285
  116    HB   THR  17           HB       THR  17   4.004 -10.176 -11.893
  117    HG1  THR  17           HG1      THR  17   6.515 -10.914 -10.839
  118   HG21  THR  17          HG21      THR  17   4.729 -11.187  -9.191
  119   HG22  THR  17          HG22      THR  17   3.545 -12.233 -10.064
  120   HG23  THR  17          HG23      THR  17   3.178 -10.487  -9.786
  121    H    LYS  18           HN       LYS  18   7.365 -11.742 -12.704
  122    HA   LYS  18           HA       LYS  18   6.958 -10.436 -15.156
  123    HB2  LYS  18           HB2      LYS  18   9.363 -11.816 -13.898
  124    HB3  LYS  18           HB1      LYS  18   9.434 -11.248 -15.602
  125    HG2  LYS  18           HG2      LYS  18  10.263  -9.694 -13.608
  126    HG3  LYS  18           HG1      LYS  18   9.400  -9.004 -15.023
  127    HD2  LYS  18           HD2      LYS  18   7.357  -8.771 -13.814
  128    HD3  LYS  18           HD1      LYS  18   7.889  -9.893 -12.520
  129    HE2  LYS  18           HE2      LYS  18   7.955  -7.563 -11.701
  130    HE3  LYS  18           HE1      LYS  18   9.642  -8.204 -11.826
  131    HZ1  LYS  18           HZ1      LYS  18   8.941  -7.071 -14.279
  132    HZ2  LYS  18           HZ2      LYS  18  10.098  -6.548 -13.152
  133    HZ3  LYS  18           HZ3      LYS  18   8.505  -5.968 -13.064
  134    H    TYR  19           HN       TYR  19   7.201 -13.813 -14.129
  135    HA   TYR  19           HA       TYR  19   7.630 -14.774 -16.778
  136    HB2  TYR  19           HB2      TYR  19   8.301 -16.344 -15.152
  137    HB3  TYR  19           HB1      TYR  19   6.883 -16.018 -14.112
  138    HD1  TYR  19           HD1      TYR  19   7.929 -17.536 -17.329
  139    HD2  TYR  19           HD2      TYR  19   5.026 -17.314 -14.243
  140    HE1  TYR  19           HE1      TYR  19   6.789 -19.484 -18.270
  141    HE2  TYR  19           HE2      TYR  19   3.896 -19.259 -15.188
  142    HH   TYR  19           HH       TYR  19   3.683 -20.551 -17.099
  143    H    LYS  20           HN       LYS  20   4.827 -14.478 -14.518
  144    HA   LYS  20           HA       LYS  20   2.963 -15.608 -16.236
  145    HB2  LYS  20           HB2      LYS  20   2.520 -13.230 -14.347
  146    HB3  LYS  20           HB1      LYS  20   1.251 -14.305 -15.008
  147    HG2  LYS  20           HG2      LYS  20   3.433 -15.743 -13.604
  148    HG3  LYS  20           HG1      LYS  20   2.516 -14.606 -12.562
  149    HD2  LYS  20           HD2      LYS  20   1.277 -16.579 -12.339
  150    HD3  LYS  20           HD1      LYS  20   0.380 -15.732 -13.626
  151    HE2  LYS  20           HE2      LYS  20   2.590 -17.506 -14.625
  152    HE3  LYS  20           HE1      LYS  20   1.233 -18.369 -13.788
  153    HZ1  LYS  20           HZ1      LYS  20   0.644 -16.291 -15.789
  154    HZ2  LYS  20           HZ2      LYS  20  -0.258 -17.651 -15.324
  155    HZ3  LYS  20           HZ3      LYS  20   1.126 -17.842 -16.299
  156    H    SER  21           HN       SER  21   4.382 -12.334 -15.982
  157    HA   SER  21           HA       SER  21   2.580 -11.194 -17.871
  158    HB2  SER  21           HB2      SER  21   5.457 -10.371 -17.126
  159    HB3  SER  21           HB1      SER  21   4.344  -9.383 -18.154
  160    HG   SER  21           HG       SER  21   4.030 -10.165 -15.441
  161    H    CYS  22           HN       CYS  22   5.478 -13.226 -18.063
  162    HA   CYS  22           HA       CYS  22   6.051 -12.562 -20.767
  163    HB2  CYS  22           HB2      CYS  22   7.612 -13.779 -19.028
  164    HB3  CYS  22           HB1      CYS  22   6.668 -15.242 -19.459
  165    H    GLN  23           HN       GLN  23   4.030 -14.994 -19.065
  166    HA   GLN  23           HA       GLN  23   3.417 -16.390 -21.463
  167    HB2  GLN  23           HB2      GLN  23   2.048 -16.277 -18.715
  168    HB3  GLN  23           HB1      GLN  23   1.376 -17.236 -20.082
  169    HG2  GLN  23           HG2      GLN  23   3.647 -18.461 -20.216
  170    HG3  GLN  23           HG1      GLN  23   4.072 -17.641 -18.658
  171   HE21  GLN  23          HE21      GLN  23   2.470 -20.329 -20.089
  172   HE22  GLN  23          HE22      GLN  23   1.616 -20.894 -18.695
  173    H    MET  24           HN       MET  24   2.360 -13.398 -19.941
  174    HA   MET  24           HA       MET  24  -0.137 -13.396 -21.378
  175    HB2  MET  24           HB2      MET  24   1.343 -11.221 -19.819
  176    HB3  MET  24           HB1      MET  24  -0.246 -10.986 -20.612
  177    HG2  MET  24           HG2      MET  24   0.284 -13.137 -18.519
  178    HG3  MET  24           HG1      MET  24  -0.286 -11.498 -18.120
  179    HE1  MET  24           HE1      MET  24  -1.177 -14.875 -20.190
  180    HE2  MET  24           HE2      MET  24  -2.572 -15.164 -19.092
  181    HE3  MET  24           HE3      MET  24  -0.945 -14.831 -18.406
  182    H    SER  25           HN       SER  25   3.198 -12.690 -21.914
  183    HA   SER  25           HA       SER  25   2.783 -10.624 -23.809
  184    HB2  SER  25           HB2      SER  25   5.128 -12.604 -23.554
  185    HB3  SER  25           HB1      SER  25   5.120 -11.135 -24.613
  186    HG   SER  25           HG       SER  25   4.534 -10.951 -21.858
  187    H    ASP  26           HN       ASP  26   3.248 -10.892 -26.195
  188    HA   ASP  26           HA       ASP  26   1.765 -13.207 -27.093
  189    HB2  ASP  26           HB2      ASP  26   2.884 -10.751 -28.534
  190    HB3  ASP  26           HB1      ASP  26   2.071 -12.108 -29.388
  191    H    SER  27           HN       SER  27   4.724 -12.981 -25.998
  192    HA   SER  27           HA       SER  27   6.178 -13.821 -28.331
  193    HB2  SER  27           HB2      SER  27   6.972 -13.842 -25.352
  194    HB3  SER  27           HB1      SER  27   8.082 -14.255 -26.721
  195    HG   SER  27           HG       SER  27   8.310 -12.243 -27.116
  196    H    CYS  28           HN       CYS  28   3.926 -15.143 -26.187
  197    HA   CYS  28           HA       CYS  28   5.169 -17.754 -26.194
  198    HB2  CYS  28           HB2      CYS  28   3.771 -16.950 -24.218
  199    HB3  CYS  28           HB1      CYS  28   2.356 -16.920 -25.323
  200    H    HIS  29           HN       HIS  29   5.327 -17.874 -28.593
  201    HA   HIS  29           HA       HIS  29   2.775 -17.930 -29.959
  202    HB2  HIS  29           HB2      HIS  29   5.452 -18.829 -31.134
  203    HB3  HIS  29           HB1      HIS  29   4.005 -18.208 -32.016
  204    HD2  HIS  29           HD2      HIS  29   7.060 -16.821 -29.881
  205    HE1  HIS  29           HE1      HIS  29   5.167 -13.644 -31.933
  206    HE2  HIS  29           HE2      HIS  29   7.149 -14.334 -30.497
  207    H    ASP  30           HN       ASP  30   5.174 -20.101 -28.480
  208    HA   ASP  30           HA       ASP  30   3.348 -22.266 -29.137
  209    HB2  ASP  30           HB2      ASP  30   5.743 -22.073 -30.541
  210    HB3  ASP  30           HB1      ASP  30   6.256 -23.010 -29.092
  211    H    GLU  31           HN       GLU  31   4.194 -24.309 -27.747
  212    HA   GLU  31           HA       GLU  31   4.059 -23.409 -25.079
  213    HB2  GLU  31           HB2      GLU  31   4.835 -26.144 -26.250
  214    HB3  GLU  31           HB1      GLU  31   4.653 -25.829 -24.486
  215    HG2  GLU  31           HG2      GLU  31   2.244 -25.237 -24.791
  216    HG3  GLU  31           HG1      GLU  31   2.407 -25.473 -26.579
  217    H    GLN  32           HN       GLN  32   6.705 -24.431 -27.288
  218    HA   GLN  32           HA       GLN  32   8.685 -24.574 -25.304
  219    HB2  GLN  32           HB2      GLN  32   8.971 -25.391 -27.686
  220    HB3  GLN  32           HB1      GLN  32   9.002 -23.680 -28.212
  221    HG2  GLN  32           HG2      GLN  32  11.048 -23.247 -26.882
  222    HG3  GLN  32           HG1      GLN  32  11.004 -24.939 -26.243
  223   HE21  GLN  32          HE21      GLN  32  13.295 -24.351 -27.506
  224   HE22  GLN  32          HE22      GLN  32  13.368 -25.030 -29.095
  225    H    SER  33           HN       SER  33   7.370 -21.893 -27.319
  226    HA   SER  33           HA       SER  33   9.269 -20.004 -26.501
  227    HB2  SER  33           HB2      SER  33   6.311 -19.561 -27.240
  228    HB3  SER  33           HB1      SER  33   7.550 -18.254 -27.095
  229    HG   SER  33           HG       SER  33   8.571 -19.005 -28.827
  230    H    CYS  34           HN       CYS  34   6.108 -21.105 -25.104
  231    HA   CYS  34           HA       CYS  34   6.208 -19.172 -23.014
  232    HB2  CYS  34           HB2      CYS  34   4.512 -21.540 -23.705
  233    HB3  CYS  34           HB1      CYS  34   4.763 -21.323 -21.939
  234    H    HIS  35           HN       HIS  35   7.590 -22.414 -23.592
  235    HA   HIS  35           HA       HIS  35   8.200 -22.927 -20.878
  236    HB2  HIS  35           HB2      HIS  35   8.357 -24.752 -22.568
  237    HB3  HIS  35           HB1      HIS  35   9.652 -23.841 -23.424
  238    HD2  HIS  35           HD2      HIS  35  12.142 -24.668 -22.718
  239    HE1  HIS  35           HE1      HIS  35  11.144 -26.244 -18.923
  240    HE2  HIS  35           HE2      HIS  35  12.990 -25.903 -20.639
  241    H    GLN  36           HN       GLN  36   9.797 -21.126 -23.541
  242    HA   GLN  36           HA       GLN  36  12.250 -20.782 -22.243
  243    HB2  GLN  36           HB2      GLN  36  10.742 -18.943 -24.160
  244    HB3  GLN  36           HB1      GLN  36  12.410 -18.623 -23.595
  245    HG2  GLN  36           HG2      GLN  36  11.735 -21.308 -24.891
  246    HG3  GLN  36           HG1      GLN  36  12.045 -19.843 -25.907
  247   HE21  GLN  36          HE21      GLN  36  13.440 -22.153 -23.595
  248   HE22  GLN  36          HE22      GLN  36  15.084 -21.671 -23.797
  249    H    CYS  37           HN       CYS  37   9.107 -19.115 -22.018
  250    HA   CYS  37           HA       CYS  37  10.041 -16.965 -20.472
  251    HB2  CYS  37           HB2      CYS  37   7.326 -18.363 -20.528
  252    HB3  CYS  37           HB1      CYS  37   7.657 -16.899 -19.567
  253    H    HIS  38           HN       HIS  38   8.972 -20.261 -19.733
  254    HA   HIS  38           HA       HIS  38   9.014 -19.852 -16.931
  255    HB2  HIS  38           HB2      HIS  38   7.744 -21.743 -18.051
  256    HB3  HIS  38           HB1      HIS  38   9.338 -22.478 -18.463
  257    HD2  HIS  38           HD2      HIS  38  10.834 -23.408 -16.194
  258    HE1  HIS  38           HE1      HIS  38   7.442 -23.320 -13.661
  259    HE2  HIS  38           HE2      HIS  38   9.839 -24.139 -13.939
  260    H    VAL  39           HN       VAL  39  11.275 -20.994 -19.418
  261    HA   VAL  39           HA       VAL  39  13.235 -21.827 -17.572
  262    HB   VAL  39           HB       VAL  39  13.427 -20.835 -20.445
  263   HG11  VAL  39          HG11      VAL  39  15.749 -22.013 -20.238
  264   HG12  VAL  39          HG12      VAL  39  15.524 -21.863 -18.454
  265   HG13  VAL  39          HG13      VAL  39  15.575 -20.383 -19.484
  266   HG21  VAL  39          HG21      VAL  39  12.492 -22.890 -20.771
  267   HG22  VAL  39          HG22      VAL  39  12.765 -23.384 -19.053
  268   HG23  VAL  39          HG23      VAL  39  14.090 -23.558 -20.269
  269    H    LYS  40           HN       LYS  40  12.385 -18.694 -19.145
  270    HA   LYS  40           HA       LYS  40  14.732 -17.380 -18.251
  271    HB2  LYS  40           HB2      LYS  40  11.923 -16.320 -18.901
  272    HB3  LYS  40           HB1      LYS  40  13.291 -15.249 -18.433
  273    HG2  LYS  40           HG2      LYS  40  14.372 -15.483 -20.449
  274    HG3  LYS  40           HG1      LYS  40  13.861 -17.194 -20.656
  275    HD2  LYS  40           HD2      LYS  40  12.349 -16.464 -22.161
  276    HD3  LYS  40           HD1      LYS  40  11.445 -15.728 -20.797
  277    HE2  LYS  40           HE2      LYS  40  12.642 -13.579 -21.105
  278    HE3  LYS  40           HE1      LYS  40  13.669 -14.310 -22.407
  279    HZ1  LYS  40           HZ1      LYS  40  11.786 -13.021 -23.228
  280    HZ2  LYS  40           HZ2      LYS  40  10.702 -14.094 -22.482
  281    HZ3  LYS  40           HZ3      LYS  40  11.725 -14.643 -23.722
  282    H    HIS  41           HN       HIS  41  11.512 -18.083 -16.895
  283    HA   HIS  41           HA       HIS  41  11.811 -16.470 -14.623
  284    HB2  HIS  41           HB2      HIS  41   9.620 -17.426 -15.164
  285    HB3  HIS  41           HB1      HIS  41  10.283 -19.082 -15.052
  286    HD2  HIS  41           HD2      HIS  41   9.231 -16.108 -12.632
  287    HE1  HIS  41           HE1      HIS  41   9.754 -19.647 -10.407
  288    HE2  HIS  41           HE2      HIS  41   8.987 -17.228 -10.347
  289    H    THR  42           HN       THR  42  12.710 -19.849 -15.439
  290    HA   THR  42           HA       THR  42  13.523 -20.554 -12.877
  291    HB   THR  42           HB       THR  42  14.543 -21.458 -15.619
  292    HG1  THR  42           HG1      THR  42  12.354 -21.892 -14.989
  293   HG21  THR  42          HG21      THR  42  15.318 -22.175 -12.780
  294   HG22  THR  42          HG22      THR  42  16.318 -22.115 -14.277
  295   HG23  THR  42          HG23      THR  42  15.205 -23.502 -13.991
  296    H    ASP  43           HN       ASP  43  15.318 -19.021 -15.648
  297    HA   ASP  43           HA       ASP  43  17.754 -18.935 -14.169
  298    HB2  ASP  43           HB2      ASP  43  16.789 -17.349 -16.615
  299    HB3  ASP  43           HB1      ASP  43  18.434 -17.160 -15.906
  300    H    CYS  44           HN       CYS  44  14.910 -16.821 -14.519
  301    HA   CYS  44           HA       CYS  44  16.125 -14.517 -13.409
  302    HB2  CYS  44           HB2      CYS  44  13.856 -14.573 -14.675
  303    HB3  CYS  44           HB1      CYS  44  13.166 -15.302 -13.190
  304    H    VAL  45           HN       VAL  45  14.450 -17.374 -12.175
  305    HA   VAL  45           HA       VAL  45  14.400 -16.353  -9.532
  306    HB   VAL  45           HB       VAL  45  13.786 -18.949 -10.889
  307   HG11  VAL  45          HG11      VAL  45  14.474 -18.603  -7.896
  308   HG12  VAL  45          HG12      VAL  45  15.268 -19.712  -9.086
  309   HG13  VAL  45          HG13      VAL  45  13.564 -20.007  -8.562
  310   HG21  VAL  45          HG21      VAL  45  11.696 -18.628  -9.429
  311   HG22  VAL  45          HG22      VAL  45  11.989 -17.328 -10.651
  312   HG23  VAL  45          HG23      VAL  45  12.390 -17.045  -8.911
  313    H    ASN  46           HN       ASN  46  16.475 -18.460 -11.485
  314    HA   ASN  46           HA       ASN  46  18.026 -19.345  -9.330
  315    HB2  ASN  46           HB2      ASN  46  18.493 -19.038 -12.303
  316    HB3  ASN  46           HB1      ASN  46  19.839 -19.511 -11.213
  317   HD21  ASN  46          HD21      ASN  46  18.250 -20.954 -13.406
  318   HD22  ASN  46          HD22      ASN  46  17.762 -22.438 -12.674
  319    H    THR  47           HN       THR  47  18.038 -16.339 -11.228
  320    HA   THR  47           HA       THR  47  20.593 -15.644 -10.028
  321    HB   THR  47           HB       THR  47  18.791 -14.012 -11.874
  322    HG1  THR  47           HG1      THR  47  19.641 -15.817 -12.887
  323   HG21  THR  47          HG21      THR  47  20.155 -12.472 -10.646
  324   HG22  THR  47          HG22      THR  47  21.082 -12.767 -12.168
  325   HG23  THR  47          HG23      THR  47  21.571 -13.592 -10.639
  326    H    GLY  48           HN       GLY  48  17.143 -14.550 -10.072
  327    HA2  GLY  48           HA2      GLY  48  17.698 -12.464  -8.216
  328    HA3  GLY  48           HA1      GLY  48  16.082 -13.129  -8.707
  329    H    CYS  49           HN       CYS  49  16.536 -15.903  -7.913
  330    HA   CYS  49           HA       CYS  49  17.153 -15.680  -5.079
  331    HB2  CYS  49           HB2      CYS  49  14.890 -17.124  -4.782
  332    HB3  CYS  49           HB1      CYS  49  14.905 -15.346  -4.610
  333    HA   PRO  50           HA       PRO  50  18.663 -19.409  -7.445
  334    HB2  PRO  50           HB2      PRO  50  20.827 -19.508  -5.548
  335    HB3  PRO  50           HB1      PRO  50  20.909 -18.931  -7.267
  336    HG2  PRO  50           HG2      PRO  50  20.608 -17.339  -4.696
  337    HG3  PRO  50           HG1      PRO  50  21.403 -16.877  -6.258
  338    HD2  PRO  50           HD2      PRO  50  18.981 -15.863  -5.543
  339    HD3  PRO  50           HD1      PRO  50  19.363 -16.254  -7.264
  Start of MODEL   11
    1    H1   SER   1           HT1      SER   1  11.143 -29.587   5.850
    2    H2   SER   1           HT2      SER   1   9.968 -30.800   5.656
    3    H3   SER   1           HT3      SER   1  10.515 -30.388   7.212
    4    HA   SER   1           HA       SER   1   8.908 -28.734   5.376
    5    HB2  SER   1           HB2      SER   1   7.762 -30.564   6.818
    6    HB3  SER   1           HB1      SER   1   8.290 -29.603   8.257
    7    HG   SER   1           HG       SER   1   6.952 -28.047   7.735
    8    H    SER   2           HN       SER   2  10.680 -27.072   5.368
    9    HA   SER   2           HA       SER   2  10.516 -25.555   7.868
   10    HB2  SER   2           HB2      SER   2  13.045 -25.934   6.142
   11    HB3  SER   2           HB1      SER   2  12.900 -24.794   7.540
   12    HG   SER   2           HG       SER   2  12.082 -27.298   8.176
   13    H    THR   3           HN       THR   3  10.527 -23.230   7.548
   14    HA   THR   3           HA       THR   3   9.526 -22.566   4.951
   15    HB   THR   3           HB       THR   3  10.242 -20.732   7.286
   16    HG1  THR   3           HG1      THR   3   7.682 -20.893   6.975
   17   HG21  THR   3          HG21      THR   3  10.137 -19.611   5.046
   18   HG22  THR   3          HG22      THR   3   8.770 -19.106   6.106
   19   HG23  THR   3          HG23      THR   3   8.493 -20.301   4.786
   20    HA   PRO   4           HA       PRO   4  13.513 -21.741   3.292
   21    HB2  PRO   4           HB2      PRO   4  12.655 -20.210   1.124
   22    HB3  PRO   4           HB1      PRO   4  12.638 -22.024   1.163
   23    HG2  PRO   4           HG2      PRO   4  10.372 -20.048   1.675
   24    HG3  PRO   4           HG1      PRO   4  10.347 -21.635   0.799
   25    HD2  PRO   4           HD2      PRO   4   9.417 -21.354   3.373
   26    HD3  PRO   4           HD1      PRO   4  10.201 -22.876   2.782
   27    H    ASP   5           HN       ASP   5  11.331 -18.878   2.871
   28    HA   ASP   5           HA       ASP   5  12.912 -17.373   4.649
   29    HB2  ASP   5           HB2      ASP   5  14.222 -17.431   2.358
   30    HB3  ASP   5           HB1      ASP   5  12.895 -16.373   1.786
   31    H    GLY   6           HN       GLY   6  12.006 -15.056   2.600
   32    HA2  GLY   6           HA2      GLY   6   9.203 -15.225   2.650
   33    HA3  GLY   6           HA1      GLY   6   9.866 -14.184   3.991
   34    H    THR   7           HN       THR   7  12.300 -13.454   2.417
   35    HA   THR   7           HA       THR   7  10.949 -11.474   0.716
   36    HB   THR   7           HB       THR   7  13.802 -11.601   1.824
   37    HG1  THR   7           HG1      THR   7  12.271  -9.394   2.245
   38   HG21  THR   7          HG21      THR   7  14.029 -10.621  -0.347
   39   HG22  THR   7          HG22      THR   7  13.843  -9.204   0.754
   40   HG23  THR   7          HG23      THR   7  12.443  -9.772  -0.232
   41    H    TRP   8           HN       TRP   8  13.255 -14.133   0.856
   42    HA   TRP   8           HA       TRP   8  14.294 -13.851  -1.698
   43    HB2  TRP   8           HB2      TRP   8  15.506 -15.505  -0.642
   44    HB3  TRP   8           HB1      TRP   8  14.141 -15.956   0.397
   45    HD1  TRP   8           HD1      TRP   8  15.893 -17.022  -2.842
   46    HE1  TRP   8           HE1      TRP   8  14.775 -19.146  -3.691
   47    HE3  TRP   8           HE3      TRP   8  11.887 -17.134   0.272
   48    HZ2  TRP   8           HZ2      TRP   8  12.486 -20.659  -3.102
   49    HZ3  TRP   8           HZ3      TRP   8  10.265 -18.953   0.070
   50    HH2  TRP   8           HH2      TRP   8  10.567 -20.699  -1.611
   51    H    VAL   9           HN       VAL   9  11.266 -15.309  -0.422
   52    HA   VAL   9           HA       VAL   9  10.598 -16.571  -2.873
   53    HB   VAL   9           HB       VAL   9   9.571 -17.188  -0.659
   54   HG11  VAL   9          HG11      VAL   9   7.728 -14.787  -0.964
   55   HG12  VAL   9          HG12      VAL   9   9.352 -14.524  -0.231
   56   HG13  VAL   9          HG13      VAL   9   8.206 -15.693   0.518
   57   HG21  VAL   9          HG21      VAL   9   7.312 -17.503  -1.627
   58   HG22  VAL   9          HG22      VAL   9   8.586 -17.815  -2.866
   59   HG23  VAL   9          HG23      VAL   9   7.659 -16.256  -2.886
   60    H    LYS  10           HN       LYS  10  10.363 -13.270  -1.616
   61    HA   LYS  10           HA       LYS  10   8.257 -12.455  -3.296
   62    HB2  LYS  10           HB2      LYS  10  10.651 -10.863  -2.196
   63    HB3  LYS  10           HB1      LYS  10   9.294 -10.117  -3.107
   64    HG2  LYS  10           HG2      LYS  10   7.682 -10.898  -1.375
   65    HG3  LYS  10           HG1      LYS  10   9.027 -11.664  -0.463
   66    HD2  LYS  10           HD2      LYS  10  10.113  -9.411  -0.201
   67    HD3  LYS  10           HD1      LYS  10   8.739  -8.657  -1.082
   68    HE2  LYS  10           HE2      LYS  10   8.474 -10.246   1.562
   69    HE3  LYS  10           HE1      LYS  10   8.512  -8.438   1.426
   70    HZ1  LYS  10           HZ1      LYS  10   6.331  -8.695   1.278
   71    HZ2  LYS  10           HZ2      LYS  10   6.406 -10.325   0.808
   72    HZ3  LYS  10           HZ3      LYS  10   6.619  -9.098  -0.346
   73    H    CYS  11           HN       CYS  11  11.645 -13.259  -3.817
   74    HA   CYS  11           HA       CYS  11  11.837 -11.835  -6.273
   75    HB2  CYS  11           HB2      CYS  11  14.006 -12.303  -5.472
   76    HB3  CYS  11           HB1      CYS  11  13.509 -13.878  -4.811
   77    H    ARG  12           HN       ARG  12  11.084 -15.166  -5.168
   78    HA   ARG  12           HA       ARG  12  10.935 -16.334  -7.649
   79    HB2  ARG  12           HB2      ARG  12   9.154 -16.806  -5.207
   80    HB3  ARG  12           HB1      ARG  12   9.288 -17.894  -6.601
   81    HG2  ARG  12           HG2      ARG  12  11.781 -17.131  -5.094
   82    HG3  ARG  12           HG1      ARG  12  10.659 -18.346  -4.400
   83    HD2  ARG  12           HD2      ARG  12  10.836 -19.682  -6.558
   84    HD3  ARG  12           HD1      ARG  12  12.093 -18.494  -7.120
   85    HE   ARG  12           HE       ARG  12  13.039 -19.234  -4.647
   86   HH11  ARG  12          HH11      ARG  12  11.795 -21.030  -7.463
   87   HH12  ARG  12          HH12      ARG  12  12.807 -22.415  -7.225
   88   HH21  ARG  12          HH21      ARG  12  14.423 -21.131  -4.324
   89   HH22  ARG  12          HH22      ARG  12  14.324 -22.472  -5.413
   90    H    HIS  13           HN       HIS  13   8.554 -14.509  -5.705
   91    HA   HIS  13           HA       HIS  13   6.503 -14.838  -7.658
   92    HB2  HIS  13           HB2      HIS  13   5.795 -14.308  -5.385
   93    HB3  HIS  13           HB1      HIS  13   6.868 -12.864  -5.340
   94    HD2  HIS  13           HD2      HIS  13   5.658 -10.522  -6.120
   95    HE1  HIS  13           HE1      HIS  13   2.180 -12.281  -7.762
   96    HE2  HIS  13           HE2      HIS  13   3.344 -10.107  -7.139
   97    H    ASP  14           HN       ASP  14   9.025 -12.362  -6.977
   98    HA   ASP  14           HA       ASP  14   8.023 -10.397  -8.685
   99    HB2  ASP  14           HB2      ASP  14  10.053 -10.181  -7.083
  100    HB3  ASP  14           HB1      ASP  14  11.008 -11.010  -8.354
  101    H    CYS  15           HN       CYS  15  10.445 -13.055  -9.382
  102    HA   CYS  15           HA       CYS  15  10.515 -12.310 -12.142
  103    HB2  CYS  15           HB2      CYS  15  11.293 -14.958 -10.764
  104    HB3  CYS  15           HB1      CYS  15  11.590 -14.597 -12.493
  105    H    PHE  16           HN       PHE  16   8.462 -14.317 -10.101
  106    HA   PHE  16           HA       PHE  16   7.436 -15.930 -12.138
  107    HB2  PHE  16           HB2      PHE  16   6.959 -16.319  -9.719
  108    HB3  PHE  16           HB1      PHE  16   5.970 -14.822  -9.697
  109    HD1  PHE  16           HD1      PHE  16   6.268 -17.847 -11.887
  110    HD2  PHE  16           HD2      PHE  16   3.773 -15.207  -9.674
  111    HE1  PHE  16           HE1      PHE  16   4.301 -19.155 -12.525
  112    HE2  PHE  16           HE2      PHE  16   1.812 -16.526 -10.322
  113    HZ   PHE  16           HZ       PHE  16   2.075 -18.498 -11.745
  114    H    THR  17           HN       THR  17   6.373 -12.729 -10.812
  115    HA   THR  17           HA       THR  17   4.180 -12.556 -12.584
  116    HB   THR  17           HB       THR  17   4.264 -10.101 -12.161
  117    HG1  THR  17           HG1      THR  17   6.752 -10.866 -11.106
  118   HG21  THR  17          HG21      THR  17   3.320 -10.452 -10.114
  119   HG22  THR  17          HG22      THR  17   4.849 -11.121  -9.435
  120   HG23  THR  17          HG23      THR  17   3.736 -12.187 -10.372
  121    H    LYS  18           HN       LYS  18   7.660 -11.678 -12.849
  122    HA   LYS  18           HA       LYS  18   7.377 -10.292 -15.272
  123    HB2  LYS  18           HB2      LYS  18   9.693 -11.757 -13.957
  124    HB3  LYS  18           HB1      LYS  18   9.849 -11.180 -15.650
  125    HG2  LYS  18           HG2      LYS  18  10.638  -9.665 -13.613
  126    HG3  LYS  18           HG1      LYS  18   9.855  -8.940 -15.055
  127    HD2  LYS  18           HD2      LYS  18   7.807  -8.589 -13.932
  128    HD3  LYS  18           HD1      LYS  18   8.166  -9.817 -12.678
  129    HE2  LYS  18           HE2      LYS  18   8.328  -7.517 -11.743
  130    HE3  LYS  18           HE1      LYS  18   9.950  -8.318 -11.731
  131    HZ1  LYS  18           HZ1      LYS  18  10.652  -6.576 -12.831
  132    HZ2  LYS  18           HZ2      LYS  18   9.085  -5.966 -13.068
  133    HZ3  LYS  18           HZ3      LYS  18   9.740  -7.076 -14.172
  134    H    TYR  19           HN       TYR  19   7.418 -13.705 -14.370
  135    HA   TYR  19           HA       TYR  19   7.917 -14.524 -17.079
  136    HB2  TYR  19           HB2      TYR  19   8.635 -16.181 -15.586
  137    HB3  TYR  19           HB1      TYR  19   7.262 -15.917 -14.467
  138    HD1  TYR  19           HD1      TYR  19   8.203 -17.290 -17.787
  139    HD2  TYR  19           HD2      TYR  19   5.379 -17.185 -14.614
  140    HE1  TYR  19           HE1      TYR  19   7.021 -19.182 -18.787
  141    HE2  TYR  19           HE2      TYR  19   4.197 -19.076 -15.612
  142    HH   TYR  19           HH       TYR  19   4.963 -21.094 -17.247
  143    H    LYS  20           HN       LYS  20   5.127 -14.402 -14.773
  144    HA   LYS  20           HA       LYS  20   3.270 -15.492 -16.534
  145    HB2  LYS  20           HB2      LYS  20   2.830 -13.265 -14.489
  146    HB3  LYS  20           HB1      LYS  20   1.549 -14.266 -15.241
  147    HG2  LYS  20           HG2      LYS  20   3.834 -15.365 -13.565
  148    HG3  LYS  20           HG1      LYS  20   2.209 -14.986 -12.945
  149    HD2  LYS  20           HD2      LYS  20   2.380 -16.778 -15.369
  150    HD3  LYS  20           HD1      LYS  20   2.920 -17.462 -13.803
  151    HE2  LYS  20           HE2      LYS  20   0.707 -16.935 -12.786
  152    HE3  LYS  20           HE1      LYS  20   0.160 -16.180 -14.338
  153    HZ1  LYS  20           HZ1      LYS  20   0.657 -19.002 -13.684
  154    HZ2  LYS  20           HZ2      LYS  20   0.855 -18.474 -15.291
  155    HZ3  LYS  20           HZ3      LYS  20  -0.641 -18.275 -14.503
  156    H    SER  21           HN       SER  21   4.764 -12.322 -16.276
  157    HA   SER  21           HA       SER  21   2.909 -10.921 -17.837
  158    HB2  SER  21           HB2      SER  21   4.877  -9.787 -16.679
  159    HB3  SER  21           HB1      SER  21   5.976 -10.575 -17.880
  160    HG   SER  21           HG       SER  21   4.315  -9.520 -19.410
  161    H    CYS  22           HN       CYS  22   5.537 -13.228 -18.652
  162    HA   CYS  22           HA       CYS  22   5.436 -12.694 -21.437
  163    HB2  CYS  22           HB2      CYS  22   7.395 -13.865 -20.445
  164    HB3  CYS  22           HB1      CYS  22   6.319 -15.195 -19.918
  165    H    GLN  23           HN       GLN  23   3.810 -15.014 -19.220
  166    HA   GLN  23           HA       GLN  23   2.555 -16.439 -21.296
  167    HB2  GLN  23           HB2      GLN  23   1.770 -16.028 -18.353
  168    HB3  GLN  23           HB1      GLN  23   0.814 -17.057 -19.479
  169    HG2  GLN  23           HG2      GLN  23   3.019 -18.378 -19.933
  170    HG3  GLN  23           HG1      GLN  23   3.696 -17.500 -18.501
  171   HE21  GLN  23          HE21      GLN  23   2.016 -20.278 -19.470
  172   HE22  GLN  23          HE22      GLN  23   1.290 -20.713 -17.962
  173    H    MET  24           HN       MET  24   1.991 -13.295 -19.789
  174    HA   MET  24           HA       MET  24  -0.713 -13.205 -20.794
  175    HB2  MET  24           HB2      MET  24   1.091 -11.055 -19.574
  176    HB3  MET  24           HB1      MET  24  -0.606 -10.789 -20.080
  177    HG2  MET  24           HG2      MET  24   0.240 -12.888 -18.032
  178    HG3  MET  24           HG1      MET  24  -0.235 -11.223 -17.607
  179    HE1  MET  24           HE1      MET  24  -1.483 -14.648 -19.368
  180    HE2  MET  24           HE2      MET  24  -2.708 -14.885 -18.074
  181    HE3  MET  24           HE3      MET  24  -0.995 -14.563 -17.640
  182    H    SER  25           HN       SER  25   2.556 -12.590 -21.813
  183    HA   SER  25           HA       SER  25   1.803 -10.662 -23.791
  184    HB2  SER  25           HB2      SER  25   4.350 -12.375 -23.548
  185    HB3  SER  25           HB1      SER  25   4.117 -11.032 -24.739
  186    HG   SER  25           HG       SER  25   3.842 -10.732 -21.925
  187    H    ASP  26           HN       ASP  26   2.313 -11.173 -26.202
  188    HA   ASP  26           HA       ASP  26   0.858 -13.605 -26.782
  189    HB2  ASP  26           HB2      ASP  26   1.929 -11.343 -28.547
  190    HB3  ASP  26           HB1      ASP  26   1.114 -12.807 -29.205
  191    H    SER  27           HN       SER  27   3.922 -13.026 -25.879
  192    HA   SER  27           HA       SER  27   5.265 -14.306 -28.081
  193    HB2  SER  27           HB2      SER  27   6.243 -13.698 -25.218
  194    HB3  SER  27           HB1      SER  27   7.283 -14.337 -26.555
  195    HG   SER  27           HG       SER  27   7.577 -12.279 -26.798
  196    H    CYS  28           HN       CYS  28   3.272 -15.188 -25.464
  197    HA   CYS  28           HA       CYS  28   4.566 -17.778 -25.183
  198    HB2  CYS  28           HB2      CYS  28   3.557 -16.460 -23.172
  199    HB3  CYS  28           HB1      CYS  28   1.958 -16.801 -23.904
  200    H    HIS  29           HN       HIS  29   4.090 -17.942 -27.664
  201    HA   HIS  29           HA       HIS  29   1.313 -18.839 -27.973
  202    HB2  HIS  29           HB2      HIS  29   1.732 -18.628 -30.464
  203    HB3  HIS  29           HB1      HIS  29   1.831 -17.052 -29.606
  204    HD2  HIS  29           HD2      HIS  29   4.499 -15.982 -29.372
  205    HE1  HIS  29           HE1      HIS  29   6.118 -18.678 -32.190
  206    HE2  HIS  29           HE2      HIS  29   6.509 -16.555 -30.848
  207    H    ASP  30           HN       ASP  30   4.777 -19.582 -28.263
  208    HA   ASP  30           HA       ASP  30   4.019 -22.250 -29.158
  209    HB2  ASP  30           HB2      ASP  30   6.658 -20.702 -29.244
  210    HB3  ASP  30           HB1      ASP  30   6.641 -22.499 -29.345
  211    H    GLU  31           HN       GLU  31   4.726 -24.071 -27.936
  212    HA   GLU  31           HA       GLU  31   4.709 -23.594 -25.174
  213    HB2  GLU  31           HB2      GLU  31   5.563 -26.070 -26.781
  214    HB3  GLU  31           HB1      GLU  31   5.474 -26.035 -24.982
  215    HG2  GLU  31           HG2      GLU  31   3.030 -25.585 -25.049
  216    HG3  GLU  31           HG1      GLU  31   3.080 -25.477 -26.854
  217    H    GLN  32           HN       GLN  32   7.305 -24.150 -27.610
  218    HA   GLN  32           HA       GLN  32   9.357 -24.400 -25.690
  219    HB2  GLN  32           HB2      GLN  32   9.586 -25.041 -28.129
  220    HB3  GLN  32           HB1      GLN  32   9.549 -23.299 -28.532
  221    HG2  GLN  32           HG2      GLN  32  11.624 -22.897 -27.229
  222    HG3  GLN  32           HG1      GLN  32  11.653 -24.636 -26.728
  223   HE21  GLN  32          HE21      GLN  32  13.883 -23.904 -28.001
  224   HE22  GLN  32          HE22      GLN  32  13.920 -24.439 -29.645
  225    H    SER  33           HN       SER  33   7.987 -21.613 -27.563
  226    HA   SER  33           HA       SER  33   9.836 -19.746 -26.566
  227    HB2  SER  33           HB2      SER  33   6.910 -19.314 -27.435
  228    HB3  SER  33           HB1      SER  33   8.088 -17.980 -27.111
  229    HG   SER  33           HG       SER  33   8.891 -18.299 -28.975
  230    H    CYS  34           HN       CYS  34   6.618 -20.905 -25.396
  231    HA   CYS  34           HA       CYS  34   6.545 -19.107 -23.222
  232    HB2  CYS  34           HB2      CYS  34   5.312 -21.915 -23.510
  233    HB3  CYS  34           HB1      CYS  34   4.934 -20.768 -22.178
  234    H    HIS  35           HN       HIS  35   7.964 -22.382 -23.762
  235    HA   HIS  35           HA       HIS  35   8.582 -22.832 -21.043
  236    HB2  HIS  35           HB2      HIS  35   8.699 -24.677 -22.723
  237    HB3  HIS  35           HB1      HIS  35  10.043 -23.814 -23.554
  238    HD2  HIS  35           HD2      HIS  35  12.493 -24.698 -22.769
  239    HE1  HIS  35           HE1      HIS  35  11.337 -26.241 -19.004
  240    HE2  HIS  35           HE2      HIS  35  13.243 -25.953 -20.663
  241    H    GLN  36           HN       GLN  36  10.269 -21.130 -23.732
  242    HA   GLN  36           HA       GLN  36  12.714 -20.845 -22.405
  243    HB2  GLN  36           HB2      GLN  36  11.298 -18.992 -24.381
  244    HB3  GLN  36           HB1      GLN  36  12.964 -18.702 -23.787
  245    HG2  GLN  36           HG2      GLN  36  12.265 -21.401 -25.034
  246    HG3  GLN  36           HG1      GLN  36  12.595 -19.968 -26.086
  247   HE21  GLN  36          HE21      GLN  36  13.950 -22.166 -23.620
  248   HE22  GLN  36          HE22      GLN  36  15.601 -21.727 -23.854
  249    H    CYS  37           HN       CYS  37   9.661 -18.991 -22.289
  250    HA   CYS  37           HA       CYS  37  10.734 -16.926 -20.693
  251    HB2  CYS  37           HB2      CYS  37   7.902 -17.989 -21.055
  252    HB3  CYS  37           HB1      CYS  37   8.286 -16.633 -19.953
  253    H    HIS  38           HN       HIS  38   9.335 -20.109 -20.042
  254    HA   HIS  38           HA       HIS  38   9.187 -19.688 -17.244
  255    HB2  HIS  38           HB2      HIS  38   7.898 -21.520 -18.423
  256    HB3  HIS  38           HB1      HIS  38   9.471 -22.332 -18.761
  257    HD2  HIS  38           HD2      HIS  38  10.813 -23.325 -16.407
  258    HE1  HIS  38           HE1      HIS  38   7.287 -23.138 -14.073
  259    HE2  HIS  38           HE2      HIS  38   9.665 -24.037 -14.223
  260    H    VAL  39           HN       VAL  39  11.570 -20.924 -19.561
  261    HA   VAL  39           HA       VAL  39  13.358 -21.845 -17.579
  262    HB   VAL  39           HB       VAL  39  13.776 -20.897 -20.445
  263   HG11  VAL  39          HG11      VAL  39  16.033 -22.153 -20.082
  264   HG12  VAL  39          HG12      VAL  39  15.704 -21.978 -18.316
  265   HG13  VAL  39          HG13      VAL  39  15.873 -20.512 -19.353
  266   HG21  VAL  39          HG21      VAL  39  12.821 -22.925 -20.833
  267   HG22  VAL  39          HG22      VAL  39  12.898 -23.385 -19.087
  268   HG23  VAL  39          HG23      VAL  39  14.329 -23.649 -20.158
  269    H    LYS  40           HN       LYS  40  12.729 -18.697 -19.210
  270    HA   LYS  40           HA       LYS  40  15.073 -17.466 -18.218
  271    HB2  LYS  40           HB2      LYS  40  12.337 -16.343 -19.034
  272    HB3  LYS  40           HB1      LYS  40  13.662 -15.288 -18.425
  273    HG2  LYS  40           HG2      LYS  40  14.871 -15.431 -20.363
  274    HG3  LYS  40           HG1      LYS  40  14.475 -17.167 -20.613
  275    HD2  LYS  40           HD2      LYS  40  12.705 -16.696 -21.966
  276    HD3  LYS  40           HD1      LYS  40  12.122 -15.365 -20.912
  277    HE2  LYS  40           HE2      LYS  40  13.844 -13.826 -21.888
  278    HE3  LYS  40           HE1      LYS  40  14.445 -15.171 -22.943
  279    HZ1  LYS  40           HZ1      LYS  40  11.706 -14.007 -22.946
  280    HZ2  LYS  40           HZ2      LYS  40  12.242 -15.291 -23.918
  281    HZ3  LYS  40           HZ3      LYS  40  12.923 -13.746 -24.100
  282    H    HIS  41           HN       HIS  41  11.782 -18.061 -16.988
  283    HA   HIS  41           HA       HIS  41  12.045 -16.458 -14.706
  284    HB2  HIS  41           HB2      HIS  41   9.847 -17.333 -15.310
  285    HB3  HIS  41           HB1      HIS  41  10.448 -19.012 -15.214
  286    HD2  HIS  41           HD2      HIS  41   9.433 -16.051 -12.764
  287    HE1  HIS  41           HE1      HIS  41   9.750 -19.654 -10.605
  288    HE2  HIS  41           HE2      HIS  41   9.076 -17.209 -10.513
  289    H    THR  42           HN       THR  42  12.856 -19.868 -15.485
  290    HA   THR  42           HA       THR  42  13.552 -20.593 -12.895
  291    HB   THR  42           HB       THR  42  14.651 -21.539 -15.592
  292    HG1  THR  42           HG1      THR  42  12.403 -21.866 -15.017
  293   HG21  THR  42          HG21      THR  42  15.282 -22.261 -12.725
  294   HG22  THR  42          HG22      THR  42  16.329 -22.292 -14.190
  295   HG23  THR  42          HG23      THR  42  15.131 -23.607 -13.911
  296    H    ASP  43           HN       ASP  43  15.502 -19.133 -15.603
  297    HA   ASP  43           HA       ASP  43  17.885 -19.127 -14.038
  298    HB2  ASP  43           HB2      ASP  43  17.063 -17.508 -16.514
  299    HB3  ASP  43           HB1      ASP  43  18.689 -17.379 -15.749
  300    H    CYS  44           HN       CYS  44  15.131 -16.916 -14.486
  301    HA   CYS  44           HA       CYS  44  16.383 -14.652 -13.337
  302    HB2  CYS  44           HB2      CYS  44  14.152 -14.642 -14.674
  303    HB3  CYS  44           HB1      CYS  44  13.395 -15.340 -13.207
  304    H    VAL  45           HN       VAL  45  14.585 -17.452 -12.152
  305    HA   VAL  45           HA       VAL  45  14.487 -16.422  -9.512
  306    HB   VAL  45           HB       VAL  45  13.807 -18.988 -10.893
  307   HG11  VAL  45          HG11      VAL  45  13.485 -20.051  -8.584
  308   HG12  VAL  45          HG12      VAL  45  14.427 -18.687  -7.881
  309   HG13  VAL  45          HG13      VAL  45  15.213 -19.818  -9.058
  310   HG21  VAL  45          HG21      VAL  45  12.448 -17.008  -8.973
  311   HG22  VAL  45          HG22      VAL  45  11.706 -18.582  -9.442
  312   HG23  VAL  45          HG23      VAL  45  12.054 -17.337 -10.704
  313    H    ASN  46           HN       ASN  46  16.540 -18.607 -11.405
  314    HA   ASN  46           HA       ASN  46  17.990 -19.563  -9.210
  315    HB2  ASN  46           HB2      ASN  46  18.558 -19.254 -12.164
  316    HB3  ASN  46           HB1      ASN  46  19.854 -19.779 -11.040
  317   HD21  ASN  46          HD21      ASN  46  18.283 -21.152 -13.287
  318   HD22  ASN  46          HD22      ASN  46  17.724 -22.623 -12.581
  319    H    THR  47           HN       THR  47  18.192 -16.547 -11.089
  320    HA   THR  47           HA       THR  47  20.722 -15.969  -9.763
  321    HB   THR  47           HB       THR  47  19.117 -14.286 -11.739
  322    HG1  THR  47           HG1      THR  47  19.945 -16.127 -12.685
  323   HG21  THR  47          HG21      THR  47  21.461 -13.134 -11.898
  324   HG22  THR  47          HG22      THR  47  21.832 -13.967 -10.341
  325   HG23  THR  47          HG23      THR  47  20.465 -12.793 -10.432
  326    H    GLY  48           HN       GLY  48  17.326 -14.760  -9.991
  327    HA2  GLY  48           HA2      GLY  48  17.859 -12.642  -8.172
  328    HA3  GLY  48           HA1      GLY  48  16.246 -13.285  -8.702
  329    H    CYS  49           HN       CYS  49  16.616 -16.046  -7.830
  330    HA   CYS  49           HA       CYS  49  17.162 -15.777  -4.990
  331    HB2  CYS  49           HB2      CYS  49  14.834 -17.122  -4.717
  332    HB3  CYS  49           HB1      CYS  49  14.920 -15.343  -4.578
  333    HA   PRO  50           HA       PRO  50  18.588 -19.600  -7.270
  334    HB2  PRO  50           HB2      PRO  50  20.660 -19.747  -5.258
  335    HB3  PRO  50           HB1      PRO  50  20.847 -19.253  -6.994
  336    HG2  PRO  50           HG2      PRO  50  20.545 -17.535  -4.512
  337    HG3  PRO  50           HG1      PRO  50  21.381 -17.171  -6.078
  338    HD2  PRO  50           HD2      PRO  50  18.987 -16.038  -5.438
  339    HD3  PRO  50           HD1      PRO  50  19.390 -16.493  -7.137
  Start of MODEL   12
    1    H1   SER   1           HT1      SER   1  12.165 -29.516   6.048
    2    H2   SER   1           HT2      SER   1  11.340 -30.472   4.912
    3    H3   SER   1           HT3      SER   1  11.379 -30.939   6.544
    4    HA   SER   1           HA       SER   1   9.676 -29.077   5.191
    5    HB2  SER   1           HB2      SER   1   9.029 -31.224   6.528
    6    HB3  SER   1           HB1      SER   1   9.404 -30.259   8.012
    7    HG   SER   1           HG       SER   1   7.601 -29.294   7.781
    8    H    SER   2           HN       SER   2  10.726 -26.985   5.225
    9    HA   SER   2           HA       SER   2  10.377 -25.691   7.762
   10    HB2  SER   2           HB2      SER   2  12.670 -24.720   7.893
   11    HB3  SER   2           HB1      SER   2  12.789 -26.523   7.953
   12    HG   SER   2           HG       SER   2  12.751 -25.557   5.409
   13    H    THR   3           HN       THR   3  10.606 -23.257   7.469
   14    HA   THR   3           HA       THR   3   9.606 -22.638   4.856
   15    HB   THR   3           HB       THR   3  10.305 -20.776   7.172
   16    HG1  THR   3           HG1      THR   3   7.763 -20.890   6.862
   17   HG21  THR   3          HG21      THR   3  10.248 -19.696   4.904
   18   HG22  THR   3          HG22      THR   3   8.888 -19.142   5.950
   19   HG23  THR   3          HG23      THR   3   8.589 -20.352   4.648
   20    HA   PRO   4           HA       PRO   4  13.606 -21.870   3.196
   21    HB2  PRO   4           HB2      PRO   4  12.756 -20.307   1.038
   22    HB3  PRO   4           HB1      PRO   4  12.742 -22.121   1.061
   23    HG2  PRO   4           HG2      PRO   4  10.473 -20.154   1.587
   24    HG3  PRO   4           HG1      PRO   4  10.448 -21.734   0.702
   25    HD2  PRO   4           HD2      PRO   4   9.513 -21.476   3.270
   26    HD3  PRO   4           HD1      PRO   4  10.317 -22.988   2.681
   27    H    ASP   5           HN       ASP   5  11.451 -18.979   2.828
   28    HA   ASP   5           HA       ASP   5  13.093 -17.509   4.585
   29    HB2  ASP   5           HB2      ASP   5  14.331 -17.542   2.252
   30    HB3  ASP   5           HB1      ASP   5  12.991 -16.466   1.739
   31    H    GLY   6           HN       GLY   6  12.139 -15.153   2.607
   32    HA2  GLY   6           HA2      GLY   6   9.336 -15.312   2.739
   33    HA3  GLY   6           HA1      GLY   6  10.046 -14.295   4.073
   34    H    THR   7           HN       THR   7  12.430 -13.539   2.449
   35    HA   THR   7           HA       THR   7  11.032 -11.538   0.808
   36    HB   THR   7           HB       THR   7  13.908 -11.674   1.854
   37    HG1  THR   7           HG1      THR   7  12.439  -9.456   2.333
   38   HG21  THR   7          HG21      THR   7  12.512  -9.804  -0.147
   39   HG22  THR   7          HG22      THR   7  14.075 -10.688  -0.332
   40   HG23  THR   7          HG23      THR   7  13.961  -9.284   0.796
   41    H    TRP   8           HN       TRP   8  13.349 -14.193   0.856
   42    HA   TRP   8           HA       TRP   8  14.322 -13.872  -1.719
   43    HB2  TRP   8           HB2      TRP   8  15.569 -15.528  -0.707
   44    HB3  TRP   8           HB1      TRP   8  14.226 -16.010   0.347
   45    HD1  TRP   8           HD1      TRP   8  15.929 -16.998  -2.942
   46    HE1  TRP   8           HE1      TRP   8  14.814 -19.115  -3.811
   47    HE3  TRP   8           HE3      TRP   8  11.981 -17.205   0.241
   48    HZ2  TRP   8           HZ2      TRP   8  12.546 -20.660  -3.207
   49    HZ3  TRP   8           HZ3      TRP   8  10.371 -19.032   0.034
   50    HH2  TRP   8           HH2      TRP   8  10.655 -20.744  -1.682
   51    H    VAL   9           HN       VAL   9  11.340 -15.375  -0.383
   52    HA   VAL   9           HA       VAL   9  10.618 -16.606  -2.833
   53    HB   VAL   9           HB       VAL   9   9.651 -17.263  -0.605
   54   HG11  VAL   9          HG11      VAL   9   9.428 -14.614  -0.121
   55   HG12  VAL   9          HG12      VAL   9   8.296 -15.797   0.626
   56   HG13  VAL   9          HG13      VAL   9   7.793 -14.861  -0.832
   57   HG21  VAL   9          HG21      VAL   9   7.675 -16.310  -2.768
   58   HG22  VAL   9          HG22      VAL   9   7.367 -17.581  -1.518
   59   HG23  VAL   9          HG23      VAL   9   8.612 -17.859  -2.797
   60    H    LYS  10           HN       LYS  10  10.397 -13.323  -1.531
   61    HA   LYS  10           HA       LYS  10   8.247 -12.503  -3.149
   62    HB2  LYS  10           HB2      LYS  10  10.659 -10.890  -2.119
   63    HB3  LYS  10           HB1      LYS  10   9.232 -10.162  -2.934
   64    HG2  LYS  10           HG2      LYS  10   9.069 -11.829  -0.361
   65    HG3  LYS  10           HG1      LYS  10   9.205 -10.039  -0.390
   66    HD2  LYS  10           HD2      LYS  10   7.085  -9.933  -1.754
   67    HD3  LYS  10           HD1      LYS  10   6.941 -11.721  -1.637
   68    HE2  LYS  10           HE2      LYS  10   6.788 -11.544   0.867
   69    HE3  LYS  10           HE1      LYS  10   6.926  -9.741   0.743
   70    HZ1  LYS  10           HZ1      LYS  10   4.646 -11.232   0.644
   71    HZ2  LYS  10           HZ2      LYS  10   4.909 -10.810  -0.980
   72    HZ3  LYS  10           HZ3      LYS  10   4.815  -9.600   0.209
   73    H    CYS  11           HN       CYS  11  11.626 -13.281  -3.753
   74    HA   CYS  11           HA       CYS  11  11.758 -11.824  -6.194
   75    HB2  CYS  11           HB2      CYS  11  13.944 -12.284  -5.429
   76    HB3  CYS  11           HB1      CYS  11  13.474 -13.880  -4.802
   77    H    ARG  12           HN       ARG  12  11.054 -15.174  -5.112
   78    HA   ARG  12           HA       ARG  12  10.858 -16.310  -7.605
   79    HB2  ARG  12           HB2      ARG  12   9.153 -16.828  -5.121
   80    HB3  ARG  12           HB1      ARG  12   9.244 -17.893  -6.537
   81    HG2  ARG  12           HG2      ARG  12  11.777 -17.143  -5.089
   82    HG3  ARG  12           HG1      ARG  12  10.684 -18.387  -4.397
   83    HD2  ARG  12           HD2      ARG  12  10.812 -19.664  -6.592
   84    HD3  ARG  12           HD1      ARG  12  12.038 -18.448  -7.161
   85    HE   ARG  12           HE       ARG  12  13.062 -19.247  -4.733
   86   HH11  ARG  12          HH11      ARG  12  11.780 -20.960  -7.582
   87   HH12  ARG  12          HH12      ARG  12  12.824 -22.332  -7.422
   88   HH21  ARG  12          HH21      ARG  12  14.489 -21.125  -4.516
   89   HH22  ARG  12          HH22      ARG  12  14.388 -22.426  -5.652
   90    H    HIS  13           HN       HIS  13   8.508 -14.532  -5.577
   91    HA   HIS  13           HA       HIS  13   6.409 -14.856  -7.483
   92    HB2  HIS  13           HB2      HIS  13   5.766 -14.346  -5.182
   93    HB3  HIS  13           HB1      HIS  13   6.821 -12.888  -5.163
   94    HD2  HIS  13           HD2      HIS  13   5.547 -10.562  -5.876
   95    HE1  HIS  13           HE1      HIS  13   2.069 -12.360  -7.477
   96    HE2  HIS  13           HE2      HIS  13   3.206 -10.174  -6.848
   97    H    ASP  14           HN       ASP  14   8.920 -12.347  -6.832
   98    HA   ASP  14           HA       ASP  14   7.858 -10.392  -8.517
   99    HB2  ASP  14           HB2      ASP  14   9.937 -10.192  -6.941
  100    HB3  ASP  14           HB1      ASP  14  10.863 -10.934  -8.284
  101    H    CYS  15           HN       CYS  15  10.287 -13.026  -9.255
  102    HA   CYS  15           HA       CYS  15  10.306 -12.275 -12.012
  103    HB2  CYS  15           HB2      CYS  15  11.136 -14.911 -10.645
  104    HB3  CYS  15           HB1      CYS  15  11.391 -14.554 -12.382
  105    H    PHE  16           HN       PHE  16   8.288 -14.277  -9.933
  106    HA   PHE  16           HA       PHE  16   7.251 -15.901 -11.965
  107    HB2  PHE  16           HB2      PHE  16   6.821 -16.314  -9.538
  108    HB3  PHE  16           HB1      PHE  16   5.799 -14.840  -9.497
  109    HD1  PHE  16           HD1      PHE  16   6.180 -17.933 -11.562
  110    HD2  PHE  16           HD2      PHE  16   3.597 -15.172  -9.619
  111    HE1  PHE  16           HE1      PHE  16   4.237 -19.267 -12.227
  112    HE2  PHE  16           HE2      PHE  16   1.661 -16.515 -10.294
  113    HZ   PHE  16           HZ       PHE  16   1.983 -18.564 -11.596
  114    H    THR  17           HN       THR  17   6.220 -12.695 -10.624
  115    HA   THR  17           HA       THR  17   3.969 -12.529 -12.318
  116    HB   THR  17           HB       THR  17   4.084 -10.070 -11.942
  117    HG1  THR  17           HG1      THR  17   6.601 -10.823 -10.929
  118   HG21  THR  17          HG21      THR  17   4.779 -11.033  -9.223
  119   HG22  THR  17          HG22      THR  17   3.627 -12.120 -10.088
  120   HG23  THR  17          HG23      THR  17   3.223 -10.377  -9.853
  121    H    LYS  18           HN       LYS  18   7.444 -11.658 -12.708
  122    HA   LYS  18           HA       LYS  18   7.082 -10.367 -15.173
  123    HB2  LYS  18           HB2      LYS  18   9.450 -11.802 -13.902
  124    HB3  LYS  18           HB1      LYS  18   9.543 -11.226 -15.601
  125    HG2  LYS  18           HG2      LYS  18  10.399  -9.702 -13.596
  126    HG3  LYS  18           HG1      LYS  18   9.556  -8.982 -15.009
  127    HD2  LYS  18           HD2      LYS  18   7.551  -8.640 -13.803
  128    HD3  LYS  18           HD1      LYS  18   7.966  -9.864 -12.563
  129    HE2  LYS  18           HE2      LYS  18   9.726  -8.378 -11.642
  130    HE3  LYS  18           HE1      LYS  18   9.373  -7.149 -12.922
  131    HZ1  LYS  18           HZ1      LYS  18   8.223  -7.310 -10.479
  132    HZ2  LYS  18           HZ2      LYS  18   7.042  -8.011 -11.484
  133    HZ3  LYS  18           HZ3      LYS  18   7.623  -6.449 -11.815
  134    H    TYR  19           HN       TYR  19   7.263 -13.745 -14.129
  135    HA   TYR  19           HA       TYR  19   7.686 -14.731 -16.766
  136    HB2  TYR  19           HB2      TYR  19   8.313 -16.299 -15.126
  137    HB3  TYR  19           HB1      TYR  19   6.899 -15.936 -14.096
  138    HD1  TYR  19           HD1      TYR  19   7.887 -17.456 -17.338
  139    HD2  TYR  19           HD2      TYR  19   5.063 -17.248 -14.178
  140    HE1  TYR  19           HE1      TYR  19   6.717 -19.394 -18.264
  141    HE2  TYR  19           HE2      TYR  19   3.902 -19.182 -15.108
  142    HH   TYR  19           HH       TYR  19   3.633 -20.446 -17.037
  143    H    LYS  20           HN       LYS  20   4.866 -14.405 -14.522
  144    HA   LYS  20           HA       LYS  20   3.000 -15.508 -16.250
  145    HB2  LYS  20           HB2      LYS  20   2.575 -13.109 -14.380
  146    HB3  LYS  20           HB1      LYS  20   1.297 -14.174 -15.042
  147    HG2  LYS  20           HG2      LYS  20   3.450 -15.630 -13.613
  148    HG3  LYS  20           HG1      LYS  20   2.541 -14.476 -12.586
  149    HD2  LYS  20           HD2      LYS  20   1.281 -16.438 -12.359
  150    HD3  LYS  20           HD1      LYS  20   0.396 -15.580 -13.646
  151    HE2  LYS  20           HE2      LYS  20   2.583 -17.383 -14.646
  152    HE3  LYS  20           HE1      LYS  20   1.218 -18.229 -13.806
  153    HZ1  LYS  20           HZ1      LYS  20   0.677 -16.152 -15.830
  154    HZ2  LYS  20           HZ2      LYS  20  -0.278 -17.464 -15.333
  155    HZ3  LYS  20           HZ3      LYS  20   1.093 -17.731 -16.309
  156    H    SER  21           HN       SER  21   4.472 -12.263 -16.013
  157    HA   SER  21           HA       SER  21   2.713 -11.064 -17.884
  158    HB2  SER  21           HB2      SER  21   4.285  -9.698 -16.423
  159    HB3  SER  21           HB1      SER  21   5.675 -10.373 -17.363
  160    HG   SER  21           HG       SER  21   4.272  -9.535 -19.225
  161    H    CYS  22           HN       CYS  22   5.682 -13.056 -18.138
  162    HA   CYS  22           HA       CYS  22   6.090 -12.535 -20.886
  163    HB2  CYS  22           HB2      CYS  22   7.735 -13.670 -19.187
  164    HB3  CYS  22           HB1      CYS  22   6.773 -15.153 -19.486
  165    H    GLN  23           HN       GLN  23   4.139 -14.906 -19.024
  166    HA   GLN  23           HA       GLN  23   3.463 -16.420 -21.330
  167    HB2  GLN  23           HB2      GLN  23   2.406 -16.231 -18.485
  168    HB3  GLN  23           HB1      GLN  23   1.342 -16.971 -19.735
  169    HG2  GLN  23           HG2      GLN  23   3.381 -18.503 -20.339
  170    HG3  GLN  23           HG1      GLN  23   4.094 -17.935 -18.775
  171   HE21  GLN  23          HE21      GLN  23   2.120 -20.295 -20.185
  172   HE22  GLN  23          HE22      GLN  23   1.263 -20.827 -18.778
  173    H    MET  24           HN       MET  24   2.431 -13.344 -19.963
  174    HA   MET  24           HA       MET  24  -0.081 -13.446 -21.391
  175    HB2  MET  24           HB2      MET  24   1.328 -11.201 -19.866
  176    HB3  MET  24           HB1      MET  24  -0.265 -11.034 -20.665
  177    HG2  MET  24           HG2      MET  24   0.323 -13.128 -18.532
  178    HG3  MET  24           HG1      MET  24  -0.289 -11.499 -18.162
  179    HE1  MET  24           HE1      MET  24  -2.485 -15.244 -19.300
  180    HE2  MET  24           HE2      MET  24  -1.064 -14.893 -18.257
  181    HE3  MET  24           HE3      MET  24  -0.888 -14.888 -20.045
  182    H    SER  25           HN       SER  25   3.231 -12.724 -21.934
  183    HA   SER  25           HA       SER  25   2.806 -10.677 -23.851
  184    HB2  SER  25           HB2      SER  25   5.167 -12.631 -23.560
  185    HB3  SER  25           HB1      SER  25   5.149 -11.177 -24.640
  186    HG   SER  25           HG       SER  25   4.535 -10.943 -21.898
  187    H    ASP  26           HN       ASP  26   3.310 -10.982 -26.234
  188    HA   ASP  26           HA       ASP  26   1.825 -13.302 -27.110
  189    HB2  ASP  26           HB2      ASP  26   2.988 -10.883 -28.579
  190    HB3  ASP  26           HB1      ASP  26   2.182 -12.252 -29.423
  191    H    SER  27           HN       SER  27   4.768 -13.078 -25.974
  192    HA   SER  27           HA       SER  27   6.257 -13.975 -28.259
  193    HB2  SER  27           HB2      SER  27   6.986 -13.990 -25.262
  194    HB3  SER  27           HB1      SER  27   8.120 -14.414 -26.608
  195    HG   SER  27           HG       SER  27   8.511 -12.363 -26.374
  196    H    CYS  28           HN       CYS  28   3.938 -15.235 -26.153
  197    HA   CYS  28           HA       CYS  28   5.137 -17.867 -26.116
  198    HB2  CYS  28           HB2      CYS  28   3.734 -17.020 -24.162
  199    HB3  CYS  28           HB1      CYS  28   2.333 -16.973 -25.282
  200    H    HIS  29           HN       HIS  29   5.318 -18.031 -28.506
  201    HA   HIS  29           HA       HIS  29   2.782 -18.039 -29.903
  202    HB2  HIS  29           HB2      HIS  29   5.457 -19.014 -31.025
  203    HB3  HIS  29           HB1      HIS  29   4.033 -18.387 -31.941
  204    HD2  HIS  29           HD2      HIS  29   7.079 -17.008 -29.788
  205    HE1  HIS  29           HE1      HIS  29   5.266 -13.839 -31.923
  206    HE2  HIS  29           HE2      HIS  29   7.217 -14.534 -30.447
  207    H    ASP  30           HN       ASP  30   5.126 -20.254 -28.392
  208    HA   ASP  30           HA       ASP  30   3.240 -22.380 -29.007
  209    HB2  ASP  30           HB2      ASP  30   5.600 -22.277 -30.457
  210    HB3  ASP  30           HB1      ASP  30   6.144 -23.170 -28.991
  211    H    GLU  31           HN       GLU  31   4.084 -24.434 -27.606
  212    HA   GLU  31           HA       GLU  31   3.970 -23.518 -24.946
  213    HB2  GLU  31           HB2      GLU  31   4.741 -26.260 -26.103
  214    HB3  GLU  31           HB1      GLU  31   4.571 -25.935 -24.340
  215    HG2  GLU  31           HG2      GLU  31   2.163 -25.361 -24.620
  216    HG3  GLU  31           HG1      GLU  31   2.308 -25.576 -26.412
  217    H    GLN  32           HN       GLN  32   6.610 -24.578 -27.151
  218    HA   GLN  32           HA       GLN  32   8.593 -24.685 -25.168
  219    HB2  GLN  32           HB2      GLN  32   8.864 -25.560 -27.531
  220    HB3  GLN  32           HB1      GLN  32   8.908 -23.863 -28.096
  221    HG2  GLN  32           HG2      GLN  32  10.962 -23.417 -26.789
  222    HG3  GLN  32           HG1      GLN  32  10.902 -25.089 -26.099
  223   HE21  GLN  32          HE21      GLN  32  13.198 -24.623 -27.357
  224   HE22  GLN  32          HE22      GLN  32  13.257 -25.328 -28.936
  225    H    SER  33           HN       SER  33   7.281 -22.052 -27.241
  226    HA   SER  33           HA       SER  33   9.190 -20.151 -26.477
  227    HB2  SER  33           HB2      SER  33   6.233 -19.708 -27.212
  228    HB3  SER  33           HB1      SER  33   7.489 -18.412 -27.119
  229    HG   SER  33           HG       SER  33   8.523 -19.285 -28.813
  230    H    CYS  34           HN       CYS  34   6.034 -21.214 -25.041
  231    HA   CYS  34           HA       CYS  34   6.135 -19.226 -23.004
  232    HB2  CYS  34           HB2      CYS  34   4.438 -21.603 -23.640
  233    HB3  CYS  34           HB1      CYS  34   4.708 -21.374 -21.878
  234    H    HIS  35           HN       HIS  35   7.525 -22.472 -23.508
  235    HA   HIS  35           HA       HIS  35   8.147 -22.922 -20.789
  236    HB2  HIS  35           HB2      HIS  35   8.301 -24.781 -22.438
  237    HB3  HIS  35           HB1      HIS  35   9.586 -23.884 -23.322
  238    HD2  HIS  35           HD2      HIS  35  12.081 -24.691 -22.618
  239    HE1  HIS  35           HE1      HIS  35  11.116 -26.189 -18.783
  240    HE2  HIS  35           HE2      HIS  35  12.948 -25.880 -20.519
  241    H    GLN  36           HN       GLN  36   9.725 -21.167 -23.496
  242    HA   GLN  36           HA       GLN  36  12.186 -20.792 -22.218
  243    HB2  GLN  36           HB2      GLN  36  10.663 -18.993 -24.162
  244    HB3  GLN  36           HB1      GLN  36  12.334 -18.660 -23.615
  245    HG2  GLN  36           HG2      GLN  36  11.644 -21.366 -24.864
  246    HG3  GLN  36           HG1      GLN  36  11.971 -19.918 -25.899
  247   HE21  GLN  36          HE21      GLN  36  13.341 -22.225 -23.576
  248   HE22  GLN  36          HE22      GLN  36  14.988 -21.756 -23.771
  249    H    CYS  37           HN       CYS  37   9.040 -19.125 -22.009
  250    HA   CYS  37           HA       CYS  37   9.980 -16.940 -20.514
  251    HB2  CYS  37           HB2      CYS  37   7.267 -18.347 -20.513
  252    HB3  CYS  37           HB1      CYS  37   7.603 -16.854 -19.599
  253    H    HIS  38           HN       HIS  38   8.921 -20.222 -19.696
  254    HA   HIS  38           HA       HIS  38   8.986 -19.753 -16.902
  255    HB2  HIS  38           HB2      HIS  38   7.693 -21.657 -17.966
  256    HB3  HIS  38           HB1      HIS  38   9.275 -22.411 -18.386
  257    HD2  HIS  38           HD2      HIS  38  10.799 -23.299 -16.114
  258    HE1  HIS  38           HE1      HIS  38   7.437 -23.158 -13.546
  259    HE2  HIS  38           HE2      HIS  38   9.828 -23.986 -13.837
  260    H    VAL  39           HN       VAL  39  11.223 -20.944 -19.388
  261    HA   VAL  39           HA       VAL  39  13.192 -21.767 -17.549
  262    HB   VAL  39           HB       VAL  39  13.365 -20.807 -20.434
  263   HG11  VAL  39          HG11      VAL  39  15.479 -21.816 -18.450
  264   HG12  VAL  39          HG12      VAL  39  15.523 -20.346 -19.496
  265   HG13  VAL  39          HG13      VAL  39  15.687 -21.986 -20.233
  266   HG21  VAL  39          HG21      VAL  39  12.694 -23.329 -19.012
  267   HG22  VAL  39          HG22      VAL  39  14.031 -23.534 -20.211
  268   HG23  VAL  39          HG23      VAL  39  12.441 -22.866 -20.740
  269    H    LYS  40           HN       LYS  40  12.351 -18.644 -19.146
  270    HA   LYS  40           HA       LYS  40  14.712 -17.335 -18.280
  271    HB2  LYS  40           HB2      LYS  40  11.903 -16.263 -18.913
  272    HB3  LYS  40           HB1      LYS  40  13.279 -15.196 -18.460
  273    HG2  LYS  40           HG2      LYS  40  14.337 -15.437 -20.485
  274    HG3  LYS  40           HG1      LYS  40  13.836 -17.153 -20.674
  275    HD2  LYS  40           HD2      LYS  40  12.294 -16.457 -22.164
  276    HD3  LYS  40           HD1      LYS  40  11.413 -15.682 -20.806
  277    HE2  LYS  40           HE2      LYS  40  12.629 -13.550 -21.181
  278    HE3  LYS  40           HE1      LYS  40  13.623 -14.322 -22.486
  279    HZ1  LYS  40           HZ1      LYS  40  10.697 -14.454 -22.678
  280    HZ2  LYS  40           HZ2      LYS  40  11.880 -14.351 -23.893
  281    HZ3  LYS  40           HZ3      LYS  40  11.465 -12.972 -22.994
  282    H    HIS  41           HN       HIS  41  11.506 -18.022 -16.889
  283    HA   HIS  41           HA       HIS  41  11.820 -16.395 -14.631
  284    HB2  HIS  41           HB2      HIS  41   9.628 -17.359 -15.146
  285    HB3  HIS  41           HB1      HIS  41  10.294 -19.012 -15.035
  286    HD2  HIS  41           HD2      HIS  41   9.259 -16.032 -12.613
  287    HE1  HIS  41           HE1      HIS  41   9.791 -19.570 -10.389
  288    HE2  HIS  41           HE2      HIS  41   9.028 -17.149 -10.326
  289    H    THR  42           HN       THR  42  12.724 -19.776 -15.435
  290    HA   THR  42           HA       THR  42  13.557 -20.462 -12.874
  291    HB   THR  42           HB       THR  42  14.564 -21.381 -15.615
  292    HG1  THR  42           HG1      THR  42  12.361 -21.791 -14.916
  293   HG21  THR  42          HG21      THR  42  15.221 -23.415 -13.966
  294   HG22  THR  42          HG22      THR  42  15.353 -22.070 -12.775
  295   HG23  THR  42          HG23      THR  42  16.339 -22.041 -14.283
  296    H    ASP  43           HN       ASP  43  15.322 -18.934 -15.666
  297    HA   ASP  43           HA       ASP  43  17.775 -18.840 -14.221
  298    HB2  ASP  43           HB2      ASP  43  16.771 -17.246 -16.646
  299    HB3  ASP  43           HB1      ASP  43  18.426 -17.054 -15.959
  300    H    CYS  44           HN       CYS  44  14.927 -16.724 -14.530
  301    HA   CYS  44           HA       CYS  44  16.156 -14.427 -13.420
  302    HB2  CYS  44           HB2      CYS  44  13.882 -14.461 -14.665
  303    HB3  CYS  44           HB1      CYS  44  13.199 -15.216 -13.190
  304    H    VAL  45           HN       VAL  45  14.474 -17.280 -12.183
  305    HA   VAL  45           HA       VAL  45  14.446 -16.273  -9.536
  306    HB   VAL  45           HB       VAL  45  13.825 -18.866 -10.902
  307   HG11  VAL  45          HG11      VAL  45  14.519 -18.532  -7.908
  308   HG12  VAL  45          HG12      VAL  45  15.320 -19.629  -9.106
  309   HG13  VAL  45          HG13      VAL  45  13.618 -19.938  -8.584
  310   HG21  VAL  45          HG21      VAL  45  12.019 -17.266 -10.655
  311   HG22  VAL  45          HG22      VAL  45  12.441 -16.950  -8.926
  312   HG23  VAL  45          HG23      VAL  45  11.747 -18.543  -9.408
  313    H    ASN  46           HN       ASN  46  16.513 -18.370 -11.508
  314    HA   ASN  46           HA       ASN  46  18.071 -19.268  -9.364
  315    HB2  ASN  46           HB2      ASN  46  18.527 -18.943 -12.336
  316    HB3  ASN  46           HB1      ASN  46  19.875 -19.427 -11.254
  317   HD21  ASN  46          HD21      ASN  46  18.281 -20.855 -13.448
  318   HD22  ASN  46          HD22      ASN  46  17.790 -22.340 -12.724
  319    H    THR  47           HN       THR  47  18.059 -16.244 -11.223
  320    HA   THR  47           HA       THR  47  20.628 -15.562 -10.047
  321    HB   THR  47           HB       THR  47  18.810 -13.921 -11.870
  322    HG1  THR  47           HG1      THR  47  19.659 -15.709 -12.905
  323   HG21  THR  47          HG21      THR  47  20.170 -12.378 -10.648
  324   HG22  THR  47          HG22      THR  47  21.101 -12.669 -12.166
  325   HG23  THR  47          HG23      THR  47  21.588 -13.492 -10.637
  326    H    GLY  48           HN       GLY  48  17.175 -14.475 -10.044
  327    HA2  GLY  48           HA2      GLY  48  17.755 -12.405  -8.169
  328    HA3  GLY  48           HA1      GLY  48  16.131 -13.046  -8.669
  329    H    CYS  49           HN       CYS  49  16.577 -15.840  -7.909
  330    HA   CYS  49           HA       CYS  49  17.177 -15.648  -5.070
  331    HB2  CYS  49           HB2      CYS  49  14.907 -17.084  -4.799
  332    HB3  CYS  49           HB1      CYS  49  14.927 -15.308  -4.616
  333    HA   PRO  50           HA       PRO  50  18.669 -19.370  -7.464
  334    HB2  PRO  50           HB2      PRO  50  20.862 -19.481  -5.608
  335    HB3  PRO  50           HB1      PRO  50  20.916 -18.876  -7.319
  336    HG2  PRO  50           HG2      PRO  50  20.645 -17.326  -4.719
  337    HG3  PRO  50           HG1      PRO  50  21.429 -16.842  -6.280
  338    HD2  PRO  50           HD2      PRO  50  19.014 -15.835  -5.534
  339    HD3  PRO  50           HD1      PRO  50  19.383 -16.201  -7.262
  Start of MODEL   13
    1    H1   SER   1           HT1      SER   1  10.214 -30.100   4.997
    2    H2   SER   1           HT2      SER   1  10.907 -30.641   6.451
    3    H3   SER   1           HT3      SER   1  11.424 -29.179   5.756
    4    HA   SER   1           HA       SER   1   8.794 -28.770   5.997
    5    HB2  SER   1           HB2      SER   1   8.726 -30.967   7.374
    6    HB3  SER   1           HB1      SER   1   9.723 -30.097   8.608
    7    HG   SER   1           HG       SER   1   8.097 -28.731   8.974
    8    H    SER   2           HN       SER   2  10.433 -26.897   5.516
    9    HA   SER   2           HA       SER   2  10.640 -25.438   7.989
   10    HB2  SER   2           HB2      SER   2  12.915 -26.580   7.874
   11    HB3  SER   2           HB1      SER   2  13.134 -25.868   6.224
   12    HG   SER   2           HG       SER   2  13.317 -23.923   7.066
   13    H    THR   3           HN       THR   3  10.622 -23.141   7.583
   14    HA   THR   3           HA       THR   3   9.654 -22.558   4.957
   15    HB   THR   3           HB       THR   3  10.349 -20.648   7.236
   16    HG1  THR   3           HG1      THR   3   7.806 -20.797   6.961
   17   HG21  THR   3          HG21      THR   3   8.602 -20.302   4.722
   18   HG22  THR   3          HG22      THR   3  10.253 -19.615   4.948
   19   HG23  THR   3          HG23      THR   3   8.894 -19.061   5.994
   20    HA   PRO   4           HA       PRO   4  13.653 -21.803   3.294
   21    HB2  PRO   4           HB2      PRO   4  12.808 -20.277   1.109
   22    HB3  PRO   4           HB1      PRO   4  12.794 -22.090   1.162
   23    HG2  PRO   4           HG2      PRO   4  10.524 -20.116   1.652
   24    HG3  PRO   4           HG1      PRO   4  10.502 -21.709   0.790
   25    HD2  PRO   4           HD2      PRO   4   9.560 -21.413   3.351
   26    HD3  PRO   4           HD1      PRO   4  10.366 -22.933   2.787
   27    H    ASP   5           HN       ASP   5  11.499 -18.922   2.859
   28    HA   ASP   5           HA       ASP   5  13.134 -17.419   4.600
   29    HB2  ASP   5           HB2      ASP   5  14.364 -17.485   2.263
   30    HB3  ASP   5           HB1      ASP   5  13.021 -16.420   1.739
   31    H    GLY   6           HN       GLY   6  12.164 -15.100   2.586
   32    HA2  GLY   6           HA2      GLY   6   9.364 -15.270   2.725
   33    HA3  GLY   6           HA1      GLY   6  10.069 -14.230   4.042
   34    H    THR   7           HN       THR   7  12.449 -13.485   2.405
   35    HA   THR   7           HA       THR   7  11.039 -11.520   0.734
   36    HB   THR   7           HB       THR   7  13.918 -11.617   1.774
   37    HG1  THR   7           HG1      THR   7  12.934  -9.456   2.505
   38   HG21  THR   7          HG21      THR   7  14.091 -10.638  -0.400
   39   HG22  THR   7          HG22      THR   7  13.903  -9.218   0.699
   40   HG23  THR   7          HG23      THR   7  12.493  -9.812  -0.258
   41    H    TRP   8           HN       TRP   8  13.375 -14.156   0.826
   42    HA   TRP   8           HA       TRP   8  14.348 -13.868  -1.753
   43    HB2  TRP   8           HB2      TRP   8  15.600 -15.508  -0.720
   44    HB3  TRP   8           HB1      TRP   8  14.258 -15.980   0.341
   45    HD1  TRP   8           HD1      TRP   8  15.961 -17.006  -2.939
   46    HE1  TRP   8           HE1      TRP   8  14.852 -19.141  -3.775
   47    HE3  TRP   8           HE3      TRP   8  12.022 -17.187   0.258
   48    HZ2  TRP   8           HZ2      TRP   8  12.595 -20.686  -3.144
   49    HZ3  TRP   8           HZ3      TRP   8  10.421 -19.024   0.081
   50    HH2  TRP   8           HH2      TRP   8  10.709 -20.760  -1.612
   51    H    VAL   9           HN       VAL   9  11.370 -15.360  -0.400
   52    HA   VAL   9           HA       VAL   9  10.651 -16.616  -2.840
   53    HB   VAL   9           HB       VAL   9   9.696 -17.264  -0.603
   54   HG11  VAL   9          HG11      VAL   9   7.816 -14.882  -0.846
   55   HG12  VAL   9          HG12      VAL   9   9.451 -14.610  -0.143
   56   HG13  VAL   9          HG13      VAL   9   8.332 -15.798   0.617
   57   HG21  VAL   9          HG21      VAL   9   8.661 -17.892  -2.785
   58   HG22  VAL   9          HG22      VAL   9   7.713 -16.345  -2.774
   59   HG23  VAL   9          HG23      VAL   9   7.415 -17.604  -1.512
   60    H    LYS  10           HN       LYS  10  10.418 -13.327  -1.554
   61    HA   LYS  10           HA       LYS  10   8.253 -12.523  -3.161
   62    HB2  LYS  10           HB2      LYS  10  10.667 -10.914  -2.129
   63    HB3  LYS  10           HB1      LYS  10   9.276 -10.176  -2.994
   64    HG2  LYS  10           HG2      LYS  10   7.725 -10.982  -1.218
   65    HG3  LYS  10           HG1      LYS  10   9.104 -11.734  -0.350
   66    HD2  LYS  10           HD2      LYS  10  10.169  -9.483  -0.088
   67    HD3  LYS  10           HD1      LYS  10   8.792  -8.729  -0.962
   68    HE2  LYS  10           HE2      LYS  10   7.221  -9.493   0.840
   69    HE3  LYS  10           HE1      LYS  10   8.604 -10.269   1.718
   70    HZ1  LYS  10           HZ1      LYS  10   9.536  -8.224   2.163
   71    HZ2  LYS  10           HZ2      LYS  10   7.875  -7.945   2.378
   72    HZ3  LYS  10           HZ3      LYS  10   8.651  -7.407   0.967
   73    H    CYS  11           HN       CYS  11  11.628 -13.299  -3.789
   74    HA   CYS  11           HA       CYS  11  11.735 -11.862  -6.243
   75    HB2  CYS  11           HB2      CYS  11  13.931 -12.311  -5.507
   76    HB3  CYS  11           HB1      CYS  11  13.469 -13.894  -4.840
   77    H    ARG  12           HN       ARG  12  11.045 -15.202  -5.125
   78    HA   ARG  12           HA       ARG  12  10.835 -16.364  -7.606
   79    HB2  ARG  12           HB2      ARG  12   9.135 -16.861  -5.111
   80    HB3  ARG  12           HB1      ARG  12   9.234 -17.943  -6.514
   81    HG2  ARG  12           HG2      ARG  12  11.762 -17.162  -5.072
   82    HG3  ARG  12           HG1      ARG  12  10.676 -18.403  -4.367
   83    HD2  ARG  12           HD2      ARG  12  10.817 -19.711  -6.542
   84    HD3  ARG  12           HD1      ARG  12  12.030 -18.492  -7.130
   85    HE   ARG  12           HE       ARG  12  13.070 -19.243  -4.696
   86   HH11  ARG  12          HH11      ARG  12  11.784 -21.020  -7.503
   87   HH12  ARG  12          HH12      ARG  12  12.834 -22.384  -7.319
   88   HH21  ARG  12          HH21      ARG  12  14.505 -21.111  -4.445
   89   HH22  ARG  12          HH22      ARG  12  14.405 -22.436  -5.553
   90    H    HIS  13           HN       HIS  13   8.495 -14.567  -5.585
   91    HA   HIS  13           HA       HIS  13   6.392 -14.907  -7.486
   92    HB2  HIS  13           HB2      HIS  13   5.743 -14.393  -5.190
   93    HB3  HIS  13           HB1      HIS  13   6.801 -12.939  -5.169
   94    HD2  HIS  13           HD2      HIS  13   5.535 -10.608  -5.881
   95    HE1  HIS  13           HE1      HIS  13   2.055 -12.399  -7.485
   96    HE2  HIS  13           HE2      HIS  13   3.196 -10.214  -6.854
   97    H    ASP  14           HN       ASP  14   8.902 -12.398  -6.845
   98    HA   ASP  14           HA       ASP  14   7.839 -10.445  -8.530
   99    HB2  ASP  14           HB2      ASP  14   9.899 -10.208  -6.961
  100    HB3  ASP  14           HB1      ASP  14  10.840 -11.008  -8.260
  101    H    CYS  15           HN       CYS  15  10.270 -13.078  -9.265
  102    HA   CYS  15           HA       CYS  15  10.292 -12.332 -12.023
  103    HB2  CYS  15           HB2      CYS  15  11.121 -14.964 -10.645
  104    HB3  CYS  15           HB1      CYS  15  11.367 -14.621 -12.386
  105    H    PHE  16           HN       PHE  16   8.277 -14.340  -9.944
  106    HA   PHE  16           HA       PHE  16   7.238 -15.953 -11.982
  107    HB2  PHE  16           HB2      PHE  16   6.804 -16.381  -9.561
  108    HB3  PHE  16           HB1      PHE  16   5.793 -14.899  -9.506
  109    HD1  PHE  16           HD1      PHE  16   6.142 -17.960 -11.628
  110    HD2  PHE  16           HD2      PHE  16   3.590 -15.233  -9.594
  111    HE1  PHE  16           HE1      PHE  16   4.187 -19.274 -12.298
  112    HE2  PHE  16           HE2      PHE  16   1.643 -16.559 -10.275
  113    HZ   PHE  16           HZ       PHE  16   1.944 -18.579 -11.624
  114    H    THR  17           HN       THR  17   6.208 -12.754 -10.628
  115    HA   THR  17           HA       THR  17   3.963 -12.579 -12.329
  116    HB   THR  17           HB       THR  17   4.073 -10.122 -11.935
  117    HG1  THR  17           HG1      THR  17   6.590 -10.888 -10.947
  118   HG21  THR  17          HG21      THR  17   3.593 -12.186 -10.108
  119   HG22  THR  17          HG22      THR  17   3.195 -10.444  -9.854
  120   HG23  THR  17          HG23      THR  17   4.742 -11.118  -9.219
  121    H    LYS  18           HN       LYS  18   7.438 -11.713 -12.701
  122    HA   LYS  18           HA       LYS  18   7.079 -10.393 -15.152
  123    HB2  LYS  18           HB2      LYS  18   9.446 -11.812 -13.867
  124    HB3  LYS  18           HB1      LYS  18   9.549 -11.260 -15.574
  125    HG2  LYS  18           HG2      LYS  18  10.386  -9.704 -13.587
  126    HG3  LYS  18           HG1      LYS  18   9.547  -9.007 -15.013
  127    HD2  LYS  18           HD2      LYS  18   7.528  -8.672 -13.824
  128    HD3  LYS  18           HD1      LYS  18   7.957  -9.864 -12.557
  129    HE2  LYS  18           HE2      LYS  18   8.113  -7.541 -11.683
  130    HE3  LYS  18           HE1      LYS  18   9.750  -8.312 -11.717
  131    HZ1  LYS  18           HZ1      LYS  18   8.961  -5.946 -12.886
  132    HZ2  LYS  18           HZ2      LYS  18   9.182  -7.025 -14.177
  133    HZ3  LYS  18           HZ3      LYS  18  10.441  -6.756 -13.070
  134    H    TYR  19           HN       TYR  19   7.268 -13.777 -14.137
  135    HA   TYR  19           HA       TYR  19   7.697 -14.736 -16.783
  136    HB2  TYR  19           HB2      TYR  19   8.322 -16.324 -15.164
  137    HB3  TYR  19           HB1      TYR  19   6.911 -15.969 -14.126
  138    HD1  TYR  19           HD1      TYR  19   7.896 -17.473 -17.377
  139    HD2  TYR  19           HD2      TYR  19   5.060 -17.265 -14.227
  140    HE1  TYR  19           HE1      TYR  19   6.720 -19.398 -18.322
  141    HE2  TYR  19           HE2      TYR  19   3.890 -19.187 -15.174
  142    HH   TYR  19           HH       TYR  19   4.862 -21.310 -16.886
  143    H    LYS  20           HN       LYS  20   4.880 -14.413 -14.541
  144    HA   LYS  20           HA       LYS  20   3.010 -15.499 -16.275
  145    HB2  LYS  20           HB2      LYS  20   2.595 -13.104 -14.398
  146    HB3  LYS  20           HB1      LYS  20   1.313 -14.165 -15.063
  147    HG2  LYS  20           HG2      LYS  20   3.449 -15.650 -13.651
  148    HG3  LYS  20           HG1      LYS  20   2.584 -14.473 -12.610
  149    HD2  LYS  20           HD2      LYS  20   1.311 -16.439 -12.375
  150    HD3  LYS  20           HD1      LYS  20   0.394 -15.516 -13.591
  151    HE2  LYS  20           HE2      LYS  20   2.488 -17.351 -14.735
  152    HE3  LYS  20           HE1      LYS  20   1.120 -18.176 -13.878
  153    HZ1  LYS  20           HZ1      LYS  20   0.814 -16.107 -15.995
  154    HZ2  LYS  20           HZ2      LYS  20  -0.419 -17.008 -15.253
  155    HZ3  LYS  20           HZ3      LYS  20   0.724 -17.784 -16.239
  156    H    SER  21           HN       SER  21   4.512 -12.270 -16.028
  157    HA   SER  21           HA       SER  21   2.766 -11.040 -17.886
  158    HB2  SER  21           HB2      SER  21   4.371  -9.700 -16.437
  159    HB3  SER  21           HB1      SER  21   5.743 -10.402 -17.385
  160    HG   SER  21           HG       SER  21   4.273  -9.537 -19.224
  161    H    CYS  22           HN       CYS  22   5.728 -13.051 -18.165
  162    HA   CYS  22           HA       CYS  22   6.077 -12.559 -20.929
  163    HB2  CYS  22           HB2      CYS  22   7.759 -13.670 -19.236
  164    HB3  CYS  22           HB1      CYS  22   6.808 -15.161 -19.528
  165    H    GLN  23           HN       GLN  23   4.169 -14.877 -18.983
  166    HA   GLN  23           HA       GLN  23   3.455 -16.468 -21.215
  167    HB2  GLN  23           HB2      GLN  23   2.085 -16.052 -18.492
  168    HB3  GLN  23           HB1      GLN  23   1.497 -17.220 -19.727
  169    HG2  GLN  23           HG2      GLN  23   4.331 -17.288 -18.490
  170    HG3  GLN  23           HG1      GLN  23   2.931 -18.293 -17.931
  171   HE21  GLN  23          HE21      GLN  23   1.795 -19.626 -19.655
  172   HE22  GLN  23          HE22      GLN  23   2.766 -20.339 -20.896
  173    H    MET  24           HN       MET  24   2.425 -13.341 -19.926
  174    HA   MET  24           HA       MET  24  -0.071 -13.467 -21.380
  175    HB2  MET  24           HB2      MET  24   1.322 -11.185 -19.896
  176    HB3  MET  24           HB1      MET  24  -0.272 -11.049 -20.700
  177    HG2  MET  24           HG2      MET  24   0.340 -13.078 -18.513
  178    HG3  MET  24           HG1      MET  24  -0.309 -11.452 -18.194
  179    HE1  MET  24           HE1      MET  24  -1.081 -14.960 -20.156
  180    HE2  MET  24           HE2      MET  24  -2.401 -15.261 -18.974
  181    HE3  MET  24           HE3      MET  24  -0.760 -14.820 -18.392
  182    H    SER  25           HN       SER  25   3.250 -12.744 -21.904
  183    HA   SER  25           HA       SER  25   2.875 -10.719 -23.836
  184    HB2  SER  25           HB2      SER  25   5.165 -12.760 -23.565
  185    HB3  SER  25           HB1      SER  25   5.190 -11.317 -24.659
  186    HG   SER  25           HG       SER  25   4.599 -11.003 -21.927
  187    H    ASP  26           HN       ASP  26   3.315 -11.025 -26.226
  188    HA   ASP  26           HA       ASP  26   1.657 -13.192 -27.112
  189    HB2  ASP  26           HB2      ASP  26   3.289 -11.146 -28.708
  190    HB3  ASP  26           HB1      ASP  26   2.080 -12.285 -29.404
  191    H    SER  27           HN       SER  27   4.757 -13.091 -26.013
  192    HA   SER  27           HA       SER  27   5.981 -14.515 -28.188
  193    HB2  SER  27           HB2      SER  27   6.920 -14.106 -25.278
  194    HB3  SER  27           HB1      SER  27   7.906 -14.876 -26.586
  195    HG   SER  27           HG       SER  27   8.309 -13.006 -27.370
  196    H    CYS  28           HN       CYS  28   3.759 -15.143 -25.687
  197    HA   CYS  28           HA       CYS  28   4.663 -17.881 -25.371
  198    HB2  CYS  28           HB2      CYS  28   3.686 -16.485 -23.414
  199    HB3  CYS  28           HB1      CYS  28   2.120 -16.562 -24.284
  200    H    HIS  29           HN       HIS  29   4.389 -18.051 -27.855
  201    HA   HIS  29           HA       HIS  29   1.553 -18.576 -28.405
  202    HB2  HIS  29           HB2      HIS  29   2.186 -18.402 -30.853
  203    HB3  HIS  29           HB1      HIS  29   2.404 -16.854 -29.968
  204    HD2  HIS  29           HD2      HIS  29   5.137 -16.071 -29.567
  205    HE1  HIS  29           HE1      HIS  29   6.667 -18.988 -32.210
  206    HE2  HIS  29           HE2      HIS  29   7.180 -16.889 -30.871
  207    H    ASP  30           HN       ASP  30   4.926 -19.700 -28.462
  208    HA   ASP  30           HA       ASP  30   3.924 -22.282 -29.376
  209    HB2  ASP  30           HB2      ASP  30   6.496 -20.828 -29.790
  210    HB3  ASP  30           HB1      ASP  30   6.725 -22.510 -29.189
  211    H    GLU  31           HN       GLU  31   4.673 -24.188 -28.160
  212    HA   GLU  31           HA       GLU  31   4.460 -23.708 -25.397
  213    HB2  GLU  31           HB2      GLU  31   5.411 -26.191 -26.943
  214    HB3  GLU  31           HB1      GLU  31   5.204 -26.151 -25.154
  215    HG2  GLU  31           HG2      GLU  31   2.765 -25.659 -25.402
  216    HG3  GLU  31           HG1      GLU  31   2.948 -25.627 -27.202
  217    H    GLN  32           HN       GLN  32   7.205 -24.294 -27.660
  218    HA   GLN  32           HA       GLN  32   9.122 -24.510 -25.595
  219    HB2  GLN  32           HB2      GLN  32   9.509 -25.229 -27.996
  220    HB3  GLN  32           HB1      GLN  32   9.517 -23.498 -28.451
  221    HG2  GLN  32           HG2      GLN  32  11.500 -23.075 -27.023
  222    HG3  GLN  32           HG1      GLN  32  11.477 -24.795 -26.465
  223   HE21  GLN  32          HE21      GLN  32  13.799 -24.172 -27.585
  224   HE22  GLN  32          HE22      GLN  32  13.945 -24.744 -29.211
  225    H    SER  33           HN       SER  33   7.861 -21.793 -27.619
  226    HA   SER  33           HA       SER  33   9.657 -19.894 -26.593
  227    HB2  SER  33           HB2      SER  33   6.779 -19.485 -27.615
  228    HB3  SER  33           HB1      SER  33   7.962 -18.153 -27.304
  229    HG   SER  33           HG       SER  33   8.420 -18.521 -29.296
  230    H    CYS  34           HN       CYS  34   6.405 -21.062 -25.529
  231    HA   CYS  34           HA       CYS  34   6.230 -19.171 -23.426
  232    HB2  CYS  34           HB2      CYS  34   4.963 -21.964 -23.712
  233    HB3  CYS  34           HB1      CYS  34   4.551 -20.792 -22.412
  234    H    HIS  35           HN       HIS  35   7.687 -22.435 -23.835
  235    HA   HIS  35           HA       HIS  35   8.160 -22.864 -21.087
  236    HB2  HIS  35           HB2      HIS  35   8.439 -24.723 -22.712
  237    HB3  HIS  35           HB1      HIS  35   9.756 -23.811 -23.532
  238    HD2  HIS  35           HD2      HIS  35  12.224 -24.581 -22.700
  239    HE1  HIS  35           HE1      HIS  35  11.081 -26.106 -18.924
  240    HE2  HIS  35           HE2      HIS  35  12.995 -25.769 -20.563
  241    H    GLN  36           HN       GLN  36   9.884 -21.060 -23.667
  242    HA   GLN  36           HA       GLN  36  12.273 -20.691 -22.265
  243    HB2  GLN  36           HB2      GLN  36  10.828 -18.868 -24.239
  244    HB3  GLN  36           HB1      GLN  36  12.456 -18.515 -23.593
  245    HG2  GLN  36           HG2      GLN  36  11.891 -21.202 -24.937
  246    HG3  GLN  36           HG1      GLN  36  12.249 -19.726 -25.919
  247   HE21  GLN  36          HE21      GLN  36  13.541 -22.127 -23.686
  248   HE22  GLN  36          HE22      GLN  36  15.180 -21.600 -23.732
  249    H    CYS  37           HN       CYS  37   9.097 -19.076 -22.115
  250    HA   CYS  37           HA       CYS  37   9.955 -16.897 -20.566
  251    HB2  CYS  37           HB2      CYS  37   7.276 -18.365 -20.637
  252    HB3  CYS  37           HB1      CYS  37   7.560 -16.884 -19.687
  253    H    HIS  38           HN       HIS  38   8.957 -20.213 -19.812
  254    HA   HIS  38           HA       HIS  38   8.985 -19.770 -17.010
  255    HB2  HIS  38           HB2      HIS  38   7.717 -21.675 -18.106
  256    HB3  HIS  38           HB1      HIS  38   9.311 -22.411 -18.515
  257    HD2  HIS  38           HD2      HIS  38  10.828 -23.284 -16.225
  258    HE1  HIS  38           HE1      HIS  38   7.428 -23.219 -13.703
  259    HE2  HIS  38           HE2      HIS  38   9.837 -24.004 -13.965
  260    H    VAL  39           HN       VAL  39  11.253 -20.915 -19.492
  261    HA   VAL  39           HA       VAL  39  13.213 -21.746 -17.650
  262    HB   VAL  39           HB       VAL  39  13.411 -20.724 -20.511
  263   HG11  VAL  39          HG11      VAL  39  15.742 -21.894 -20.296
  264   HG12  VAL  39          HG12      VAL  39  15.506 -21.746 -18.513
  265   HG13  VAL  39          HG13      VAL  39  15.553 -20.266 -19.545
  266   HG21  VAL  39          HG21      VAL  39  12.771 -23.295 -19.143
  267   HG22  VAL  39          HG22      VAL  39  14.093 -23.439 -20.370
  268   HG23  VAL  39          HG23      VAL  39  12.485 -22.780 -20.852
  269    H    LYS  40           HN       LYS  40  12.350 -18.604 -19.185
  270    HA   LYS  40           HA       LYS  40  14.689 -17.285 -18.286
  271    HB2  LYS  40           HB2      LYS  40  11.867 -16.235 -18.894
  272    HB3  LYS  40           HB1      LYS  40  13.234 -15.161 -18.424
  273    HG2  LYS  40           HG2      LYS  40  14.291 -15.358 -20.455
  274    HG3  LYS  40           HG1      LYS  40  13.794 -17.071 -20.680
  275    HD2  LYS  40           HD2      LYS  40  12.261 -16.336 -22.161
  276    HD3  LYS  40           HD1      LYS  40  11.362 -15.631 -20.777
  277    HE2  LYS  40           HE2      LYS  40  12.506 -13.460 -21.072
  278    HE3  LYS  40           HE1      LYS  40  13.566 -14.157 -22.366
  279    HZ1  LYS  40           HZ1      LYS  40  11.886 -14.161 -23.835
  280    HZ2  LYS  40           HZ2      LYS  40  11.361 -12.860 -22.879
  281    HZ3  LYS  40           HZ3      LYS  40  10.665 -14.396 -22.680
  282    H    HIS  41           HN       HIS  41  11.489 -18.038 -16.913
  283    HA   HIS  41           HA       HIS  41  11.798 -16.457 -14.620
  284    HB2  HIS  41           HB2      HIS  41   9.607 -17.419 -15.174
  285    HB3  HIS  41           HB1      HIS  41  10.278 -19.072 -15.066
  286    HD2  HIS  41           HD2      HIS  41   9.249 -16.095 -12.626
  287    HE1  HIS  41           HE1      HIS  41   9.725 -19.659 -10.431
  288    HE2  HIS  41           HE2      HIS  41   8.991 -17.231 -10.350
  289    H    THR  42           HN       THR  42  12.708 -19.818 -15.502
  290    HA   THR  42           HA       THR  42  13.536 -20.564 -12.956
  291    HB   THR  42           HB       THR  42  14.559 -21.416 -15.714
  292    HG1  THR  42           HG1      THR  42  12.346 -21.836 -15.028
  293   HG21  THR  42          HG21      THR  42  15.206 -23.492 -14.121
  294   HG22  THR  42          HG22      THR  42  15.316 -22.188 -12.883
  295   HG23  THR  42          HG23      THR  42  16.323 -22.105 -14.375
  296    H    ASP  43           HN       ASP  43  15.317 -18.985 -15.712
  297    HA   ASP  43           HA       ASP  43  17.757 -18.911 -14.239
  298    HB2  ASP  43           HB2      ASP  43  16.781 -17.301 -16.665
  299    HB3  ASP  43           HB1      ASP  43  18.427 -17.108 -15.956
  300    H    CYS  44           HN       CYS  44  14.911 -16.796 -14.556
  301    HA   CYS  44           HA       CYS  44  16.128 -14.506 -13.421
  302    HB2  CYS  44           HB2      CYS  44  13.855 -14.552 -14.684
  303    HB3  CYS  44           HB1      CYS  44  13.168 -15.293 -13.204
  304    H    VAL  45           HN       VAL  45  14.460 -17.380 -12.216
  305    HA   VAL  45           HA       VAL  45  14.417 -16.385  -9.560
  306    HB   VAL  45           HB       VAL  45  13.768 -18.954 -10.951
  307   HG11  VAL  45          HG11      VAL  45  13.568 -20.062  -8.648
  308   HG12  VAL  45          HG12      VAL  45  14.491 -18.678  -7.959
  309   HG13  VAL  45          HG13      VAL  45  15.268 -19.764  -9.183
  310   HG21  VAL  45          HG21      VAL  45  11.708 -18.635  -9.428
  311   HG22  VAL  45          HG22      VAL  45  11.979 -17.347 -10.665
  312   HG23  VAL  45          HG23      VAL  45  12.422 -17.054  -8.938
  313    H    ASN  46           HN       ASN  46  16.475 -18.483 -11.545
  314    HA   ASN  46           HA       ASN  46  18.025 -19.422  -9.413
  315    HB2  ASN  46           HB2      ASN  46  18.491 -19.041 -12.376
  316    HB3  ASN  46           HB1      ASN  46  19.843 -19.532 -11.303
  317   HD21  ASN  46          HD21      ASN  46  18.259 -20.933 -13.521
  318   HD22  ASN  46          HD22      ASN  46  17.782 -22.435 -12.822
  319    H    THR  47           HN       THR  47  18.071 -16.366 -11.241
  320    HA   THR  47           HA       THR  47  20.612 -15.725  -9.965
  321    HB   THR  47           HB       THR  47  18.913 -14.071 -11.888
  322    HG1  THR  47           HG1      THR  47  19.773 -15.858 -12.888
  323   HG21  THR  47          HG21      THR  47  21.221 -12.846 -12.078
  324   HG22  THR  47          HG22      THR  47  21.641 -13.680 -10.534
  325   HG23  THR  47          HG23      THR  47  20.237 -12.548 -10.595
  326    H    GLY  48           HN       GLY  48  17.172 -14.624 -10.103
  327    HA2  GLY  48           HA2      GLY  48  17.677 -12.509  -8.271
  328    HA3  GLY  48           HA1      GLY  48  16.074 -13.198  -8.774
  329    H    CYS  49           HN       CYS  49  16.542 -15.953  -7.943
  330    HA   CYS  49           HA       CYS  49  17.152 -15.708  -5.115
  331    HB2  CYS  49           HB2      CYS  49  14.869 -17.112  -4.793
  332    HB3  CYS  49           HB1      CYS  49  14.909 -15.332  -4.645
  333    HA   PRO  50           HA       PRO  50  18.652 -19.437  -7.499
  334    HB2  PRO  50           HB2      PRO  50  20.698 -19.573  -5.441
  335    HB3  PRO  50           HB1      PRO  50  20.903 -19.090  -7.178
  336    HG2  PRO  50           HG2      PRO  50  20.572 -17.357  -4.719
  337    HG3  PRO  50           HG1      PRO  50  21.376 -16.981  -6.298
  338    HD2  PRO  50           HD2      PRO  50  18.959 -15.907  -5.621
  339    HD3  PRO  50           HD1      PRO  50  19.356 -16.346  -7.326
  Start of MODEL   14
    1    H1   SER   1           HT1      SER   1   9.609 -29.001   4.976
    2    H2   SER   1           HT2      SER   1   8.568 -30.309   5.281
    3    H3   SER   1           HT3      SER   1   9.129 -29.352   6.568
    4    HA   SER   1           HA       SER   1   7.480 -28.305   4.364
    5    HB2  SER   1           HB2      SER   1   6.305 -30.129   5.785
    6    HB3  SER   1           HB1      SER   1   6.507 -29.010   7.193
    7    HG   SER   1           HG       SER   1   5.154 -27.618   6.303
    8    H    SER   2           HN       SER   2   9.172 -26.515   4.525
    9    HA   SER   2           HA       SER   2   8.194 -24.616   6.457
   10    HB2  SER   2           HB2      SER   2  10.110 -25.718   7.731
   11    HB3  SER   2           HB1      SER   2  11.199 -25.314   6.343
   12    HG   SER   2           HG       SER   2  11.075 -23.246   6.822
   13    H    THR   3           HN       THR   3   8.618 -22.424   5.738
   14    HA   THR   3           HA       THR   3   9.118 -22.355   2.930
   15    HB   THR   3           HB       THR   3   8.900 -20.002   4.857
   16    HG1  THR   3           HG1      THR   3   6.719 -20.314   3.464
   17   HG21  THR   3          HG21      THR   3   8.480 -20.295   1.819
   18   HG22  THR   3          HG22      THR   3   9.871 -19.481   2.626
   19   HG23  THR   3          HG23      THR   3   8.214 -18.789   2.771
   20    HA   PRO   4           HA       PRO   4  13.501 -22.107   3.167
   21    HB2  PRO   4           HB2      PRO   4  13.099 -20.359   0.740
   22    HB3  PRO   4           HB1      PRO   4  14.178 -21.791   0.959
   23    HG2  PRO   4           HG2      PRO   4  11.881 -22.018  -0.427
   24    HG3  PRO   4           HG1      PRO   4  12.417 -23.334   0.681
   25    HD2  PRO   4           HD2      PRO   4  10.252 -21.231   1.079
   26    HD3  PRO   4           HD1      PRO   4  10.292 -22.962   1.607
   27    H    ASP   5           HN       ASP   5  11.681 -19.087   2.396
   28    HA   ASP   5           HA       ASP   5  13.150 -17.775   4.450
   29    HB2  ASP   5           HB2      ASP   5  14.526 -17.594   2.200
   30    HB3  ASP   5           HB1      ASP   5  13.206 -16.488   1.703
   31    H    GLY   6           HN       GLY   6  12.286 -15.267   2.635
   32    HA2  GLY   6           HA2      GLY   6   9.465 -15.485   2.660
   33    HA3  GLY   6           HA1      GLY   6  10.145 -14.487   4.022
   34    H    THR   7           HN       THR   7  12.543 -13.665   2.457
   35    HA   THR   7           HA       THR   7  11.140 -11.665   0.816
   36    HB   THR   7           HB       THR   7  13.997 -11.745   1.920
   37    HG1  THR   7           HG1      THR   7  12.667  -9.573   2.539
   38   HG21  THR   7          HG21      THR   7  14.181 -10.678  -0.214
   39   HG22  THR   7          HG22      THR   7  13.957  -9.309   0.941
   40   HG23  THR   7          HG23      THR   7  12.569  -9.884  -0.061
   41    H    TRP   8           HN       TRP   8  13.546 -14.245   0.888
   42    HA   TRP   8           HA       TRP   8  14.555 -13.856  -1.665
   43    HB2  TRP   8           HB2      TRP   8  15.845 -15.477  -0.656
   44    HB3  TRP   8           HB1      TRP   8  14.508 -16.017   0.377
   45    HD1  TRP   8           HD1      TRP   8  16.289 -16.917  -2.898
   46    HE1  TRP   8           HE1      TRP   8  15.261 -19.067  -3.796
   47    HE3  TRP   8           HE3      TRP   8  12.305 -17.290   0.228
   48    HZ2  TRP   8           HZ2      TRP   8  13.043 -20.696  -3.237
   49    HZ3  TRP   8           HZ3      TRP   8  10.764 -19.171  -0.012
   50    HH2  TRP   8           HH2      TRP   8  11.138 -20.856  -1.740
   51    H    VAL   9           HN       VAL   9  11.602 -15.465  -0.400
   52    HA   VAL   9           HA       VAL   9  10.970 -16.693  -2.878
   53    HB   VAL   9           HB       VAL   9   9.994 -17.419  -0.673
   54   HG11  VAL   9          HG11      VAL   9   9.657 -14.792  -0.155
   55   HG12  VAL   9          HG12      VAL   9   8.553 -16.027   0.547
   56   HG13  VAL   9          HG13      VAL   9   8.049 -15.088  -0.908
   57   HG21  VAL   9          HG21      VAL   9   9.022 -18.031  -2.890
   58   HG22  VAL   9          HG22      VAL   9   8.022 -16.518  -2.861
   59   HG23  VAL   9          HG23      VAL   9   7.743 -17.815  -1.634
   60    H    LYS  10           HN       LYS  10  10.600 -13.441  -1.526
   61    HA   LYS  10           HA       LYS  10   8.443 -12.674  -3.161
   62    HB2  LYS  10           HB2      LYS  10  10.774 -11.026  -2.010
   63    HB3  LYS  10           HB1      LYS  10   9.426 -10.294  -2.945
   64    HG2  LYS  10           HG2      LYS  10   7.782 -11.039  -1.278
   65    HG3  LYS  10           HG1      LYS  10   9.046 -11.943  -0.379
   66    HD2  LYS  10           HD2      LYS  10   8.655  -9.863   0.804
   67    HD3  LYS  10           HD1      LYS  10  10.263  -9.741   0.011
   68    HE2  LYS  10           HE2      LYS  10   9.284  -8.361  -1.825
   69    HE3  LYS  10           HE1      LYS  10   7.634  -8.532  -1.094
   70    HZ1  LYS  10           HZ1      LYS  10   8.322  -6.566  -0.253
   71    HZ2  LYS  10           HZ2      LYS  10   9.962  -6.998  -0.168
   72    HZ3  LYS  10           HZ3      LYS  10   8.865  -7.596   0.982
   73    H    CYS  11           HN       CYS  11  11.856 -13.317  -3.740
   74    HA   CYS  11           HA       CYS  11  11.954 -11.835  -6.167
   75    HB2  CYS  11           HB2      CYS  11  14.152 -12.225  -5.406
   76    HB3  CYS  11           HB1      CYS  11  13.732 -13.832  -4.772
   77    H    ARG  12           HN       ARG  12  11.363 -15.218  -5.124
   78    HA   ARG  12           HA       ARG  12  11.224 -16.336  -7.629
   79    HB2  ARG  12           HB2      ARG  12   9.504 -16.941  -5.171
   80    HB3  ARG  12           HB1      ARG  12   9.667 -17.991  -6.591
   81    HG2  ARG  12           HG2      ARG  12  12.146 -17.150  -5.103
   82    HG3  ARG  12           HG1      ARG  12  11.089 -18.428  -4.419
   83    HD2  ARG  12           HD2      ARG  12  11.294 -19.712  -6.604
   84    HD3  ARG  12           HD1      ARG  12  12.481 -18.455  -7.165
   85    HE   ARG  12           HE       ARG  12  13.521 -19.189  -4.734
   86   HH11  ARG  12          HH11      ARG  12  12.272 -21.015  -7.528
   87   HH12  ARG  12          HH12      ARG  12  13.347 -22.358  -7.330
   88   HH21  ARG  12          HH21      ARG  12  14.991 -21.029  -4.468
   89   HH22  ARG  12          HH22      ARG  12  14.916 -22.365  -5.564
   90    H    HIS  13           HN       HIS  13   8.803 -14.660  -5.601
   91    HA   HIS  13           HA       HIS  13   6.730 -15.029  -7.520
   92    HB2  HIS  13           HB2      HIS  13   6.048 -14.563  -5.225
   93    HB3  HIS  13           HB1      HIS  13   7.070 -13.084  -5.175
   94    HD2  HIS  13           HD2      HIS  13   5.762 -10.770  -5.891
   95    HE1  HIS  13           HE1      HIS  13   2.313 -12.623  -7.489
   96    HE2  HIS  13           HE2      HIS  13   3.414 -10.420  -6.854
   97    H    ASP  14           HN       ASP  14   9.171 -12.472  -6.849
   98    HA   ASP  14           HA       ASP  14   8.060 -10.520  -8.503
   99    HB2  ASP  14           HB2      ASP  14  10.128 -10.272  -6.936
  100    HB3  ASP  14           HB1      ASP  14  11.075 -11.012  -8.266
  101    H    CYS  15           HN       CYS  15  10.571 -13.068  -9.296
  102    HA   CYS  15           HA       CYS  15  10.543 -12.285 -12.046
  103    HB2  CYS  15           HB2      CYS  15  11.466 -14.914 -10.722
  104    HB3  CYS  15           HB1      CYS  15  11.693 -14.529 -12.457
  105    H    PHE  16           HN       PHE  16   8.623 -14.395  -9.984
  106    HA   PHE  16           HA       PHE  16   7.609 -16.024 -12.014
  107    HB2  PHE  16           HB2      PHE  16   7.208 -16.457  -9.588
  108    HB3  PHE  16           HB1      PHE  16   6.164 -15.000  -9.524
  109    HD1  PHE  16           HD1      PHE  16   6.523 -17.989 -11.752
  110    HD2  PHE  16           HD2      PHE  16   3.984 -15.466  -9.454
  111    HE1  PHE  16           HE1      PHE  16   4.592 -19.365 -12.355
  112    HE2  PHE  16           HE2      PHE  16   2.060 -16.854 -10.069
  113    HZ   PHE  16           HZ       PHE  16   2.362 -18.801 -11.516
  114    H    THR  17           HN       THR  17   6.456 -12.881 -10.623
  115    HA   THR  17           HA       THR  17   4.217 -12.774 -12.341
  116    HB   THR  17           HB       THR  17   4.217 -10.321 -11.893
  117    HG1  THR  17           HG1      THR  17   6.753 -11.003 -10.895
  118   HG21  THR  17          HG21      THR  17   3.310 -10.749  -9.848
  119   HG22  THR  17          HG22      THR  17   4.887 -11.320  -9.187
  120   HG23  THR  17          HG23      THR  17   3.831 -12.456 -10.108
  121    H    LYS  18           HN       LYS  18   7.652 -11.760 -12.677
  122    HA   LYS  18           HA       LYS  18   7.257 -10.362 -15.078
  123    HB2  LYS  18           HB2      LYS  18   9.663 -11.740 -13.832
  124    HB3  LYS  18           HB1      LYS  18   9.755 -11.133 -15.520
  125    HG2  LYS  18           HG2      LYS  18  10.524  -9.613 -13.475
  126    HG3  LYS  18           HG1      LYS  18   9.680  -8.903 -14.892
  127    HD2  LYS  18           HD2      LYS  18   7.640  -8.661 -13.721
  128    HD3  LYS  18           HD1      LYS  18   8.084  -9.883 -12.489
  129    HE2  LYS  18           HE2      LYS  18   8.161  -7.584 -11.536
  130    HE3  LYS  18           HE1      LYS  18   9.817  -8.313 -11.565
  131    HZ1  LYS  18           HZ1      LYS  18  10.505  -6.801 -12.997
  132    HZ2  LYS  18           HZ2      LYS  18   9.127  -5.911 -12.559
  133    HZ3  LYS  18           HZ3      LYS  18   9.108  -6.872 -13.959
  134    H    TYR  19           HN       TYR  19   7.447 -13.775 -14.209
  135    HA   TYR  19           HA       TYR  19   7.920 -14.549 -16.938
  136    HB2  TYR  19           HB2      TYR  19   8.745 -16.191 -15.480
  137    HB3  TYR  19           HB1      TYR  19   7.392 -15.992 -14.322
  138    HD1  TYR  19           HD1      TYR  19   8.310 -17.310 -17.668
  139    HD2  TYR  19           HD2      TYR  19   5.546 -17.322 -14.442
  140    HE1  TYR  19           HE1      TYR  19   7.180 -19.240 -18.654
  141    HE2  TYR  19           HE2      TYR  19   4.415 -19.250 -15.426
  142    HH   TYR  19           HH       TYR  19   5.262 -21.243 -17.111
  143    H    LYS  20           HN       LYS  20   5.185 -14.549 -14.563
  144    HA   LYS  20           HA       LYS  20   3.329 -15.706 -16.281
  145    HB2  LYS  20           HB2      LYS  20   2.859 -13.511 -14.211
  146    HB3  LYS  20           HB1      LYS  20   1.593 -14.548 -14.942
  147    HG2  LYS  20           HG2      LYS  20   3.953 -15.583 -13.330
  148    HG3  LYS  20           HG1      LYS  20   2.330 -15.268 -12.671
  149    HD2  LYS  20           HD2      LYS  20   2.490 -17.021 -15.118
  150    HD3  LYS  20           HD1      LYS  20   3.121 -17.706 -13.588
  151    HE2  LYS  20           HE2      LYS  20   0.937 -17.318 -12.473
  152    HE3  LYS  20           HE1      LYS  20   0.295 -16.515 -13.963
  153    HZ1  LYS  20           HZ1      LYS  20  -0.440 -18.611 -14.233
  154    HZ2  LYS  20           HZ2      LYS  20   0.870 -19.341 -13.438
  155    HZ3  LYS  20           HZ3      LYS  20   1.056 -18.762 -15.029
  156    H    SER  21           HN       SER  21   4.701 -12.481 -16.043
  157    HA   SER  21           HA       SER  21   2.754 -11.151 -17.553
  158    HB2  SER  21           HB2      SER  21   4.703  -9.942 -16.436
  159    HB3  SER  21           HB1      SER  21   5.804 -10.681 -17.667
  160    HG   SER  21           HG       SER  21   4.069  -9.689 -19.155
  161    H    CYS  22           HN       CYS  22   5.446 -13.357 -18.436
  162    HA   CYS  22           HA       CYS  22   5.263 -12.817 -21.217
  163    HB2  CYS  22           HB2      CYS  22   7.287 -13.912 -20.257
  164    HB3  CYS  22           HB1      CYS  22   6.274 -15.293 -19.738
  165    H    GLN  23           HN       GLN  23   3.780 -15.203 -18.971
  166    HA   GLN  23           HA       GLN  23   2.532 -16.673 -21.022
  167    HB2  GLN  23           HB2      GLN  23   1.800 -16.294 -18.059
  168    HB3  GLN  23           HB1      GLN  23   0.856 -17.356 -19.165
  169    HG2  GLN  23           HG2      GLN  23   3.091 -18.600 -19.671
  170    HG3  GLN  23           HG1      GLN  23   3.775 -17.696 -18.258
  171   HE21  GLN  23          HE21      GLN  23   2.147 -20.525 -19.188
  172   HE22  GLN  23          HE22      GLN  23   1.484 -20.985 -17.658
  173    H    MET  24           HN       MET  24   1.862 -13.575 -19.437
  174    HA   MET  24           HA       MET  24  -0.859 -13.570 -20.378
  175    HB2  MET  24           HB2      MET  24   0.918 -11.361 -19.221
  176    HB3  MET  24           HB1      MET  24  -0.799 -11.138 -19.683
  177    HG2  MET  24           HG2      MET  24   0.152 -13.205 -17.646
  178    HG3  MET  24           HG1      MET  24  -0.353 -11.550 -17.217
  179    HE1  MET  24           HE1      MET  24  -1.767 -15.063 -16.867
  180    HE2  MET  24           HE2      MET  24  -0.910 -14.879 -18.435
  181    HE3  MET  24           HE3      MET  24  -2.666 -15.255 -18.412
  182    H    SER  25           HN       SER  25   2.363 -12.779 -21.480
  183    HA   SER  25           HA       SER  25   1.456 -10.922 -23.455
  184    HB2  SER  25           HB2      SER  25   4.092 -12.503 -23.271
  185    HB3  SER  25           HB1      SER  25   3.759 -11.181 -24.464
  186    HG   SER  25           HG       SER  25   3.571 -10.892 -21.639
  187    H    ASP  26           HN       ASP  26   2.006 -11.446 -25.879
  188    HA   ASP  26           HA       ASP  26   0.627 -13.935 -26.409
  189    HB2  ASP  26           HB2      ASP  26   1.641 -11.756 -28.310
  190    HB3  ASP  26           HB1      ASP  26   0.646 -13.176 -28.792
  191    H    SER  27           HN       SER  27   3.634 -13.300 -25.502
  192    HA   SER  27           HA       SER  27   5.052 -14.436 -27.727
  193    HB2  SER  27           HB2      SER  27   5.952 -13.953 -24.816
  194    HB3  SER  27           HB1      SER  27   7.036 -14.494 -26.160
  195    HG   SER  27           HG       SER  27   7.281 -12.426 -26.311
  196    H    CYS  28           HN       CYS  28   3.011 -15.508 -25.228
  197    HA   CYS  28           HA       CYS  28   4.380 -18.063 -25.027
  198    HB2  CYS  28           HB2      CYS  28   3.305 -16.960 -22.971
  199    HB3  CYS  28           HB1      CYS  28   1.722 -17.169 -23.793
  200    H    HIS  29           HN       HIS  29   3.960 -18.012 -27.562
  201    HA   HIS  29           HA       HIS  29   1.227 -18.940 -28.040
  202    HB2  HIS  29           HB2      HIS  29   1.907 -18.812 -30.504
  203    HB3  HIS  29           HB1      HIS  29   1.883 -17.223 -29.665
  204    HD2  HIS  29           HD2      HIS  29   4.511 -16.138 -29.102
  205    HE1  HIS  29           HE1      HIS  29   6.436 -18.771 -31.783
  206    HE2  HIS  29           HE2      HIS  29   6.667 -16.669 -30.372
  207    H    ASP  30           HN       ASP  30   4.675 -19.803 -28.051
  208    HA   ASP  30           HA       ASP  30   3.854 -22.489 -28.847
  209    HB2  ASP  30           HB2      ASP  30   6.559 -21.055 -29.054
  210    HB3  ASP  30           HB1      ASP  30   6.413 -22.843 -29.175
  211    H    GLU  31           HN       GLU  31   4.658 -24.255 -27.555
  212    HA   GLU  31           HA       GLU  31   4.704 -23.611 -24.821
  213    HB2  GLU  31           HB2      GLU  31   5.530 -26.175 -26.304
  214    HB3  GLU  31           HB1      GLU  31   5.493 -26.033 -24.509
  215    HG2  GLU  31           HG2      GLU  31   3.042 -25.593 -24.534
  216    HG3  GLU  31           HG1      GLU  31   3.043 -25.613 -26.344
  217    H    GLN  32           HN       GLN  32   7.223 -24.283 -27.306
  218    HA   GLN  32           HA       GLN  32   9.342 -24.406 -25.447
  219    HB2  GLN  32           HB2      GLN  32   9.497 -25.186 -27.852
  220    HB3  GLN  32           HB1      GLN  32   9.426 -23.472 -28.355
  221    HG2  GLN  32           HG2      GLN  32  11.538 -22.972 -27.154
  222    HG3  GLN  32           HG1      GLN  32  11.605 -24.676 -26.545
  223   HE21  GLN  32          HE21      GLN  32  13.786 -24.027 -27.927
  224   HE22  GLN  32          HE22      GLN  32  13.774 -24.655 -29.539
  225    H    SER  33           HN       SER  33   7.831 -21.754 -27.389
  226    HA   SER  33           HA       SER  33   9.697 -19.803 -26.620
  227    HB2  SER  33           HB2      SER  33   6.713 -19.480 -27.323
  228    HB3  SER  33           HB1      SER  33   7.871 -18.102 -27.134
  229    HG   SER  33           HG       SER  33   8.003 -18.501 -29.200
  230    H    CYS  34           HN       CYS  34   6.598 -20.970 -25.158
  231    HA   CYS  34           HA       CYS  34   6.708 -19.037 -23.073
  232    HB2  CYS  34           HB2      CYS  34   4.800 -20.918 -23.915
  233    HB3  CYS  34           HB1      CYS  34   5.427 -21.644 -22.395
  234    H    HIS  35           HN       HIS  35   8.102 -22.283 -23.659
  235    HA   HIS  35           HA       HIS  35   8.787 -22.767 -20.961
  236    HB2  HIS  35           HB2      HIS  35   8.896 -24.591 -22.667
  237    HB3  HIS  35           HB1      HIS  35  10.204 -23.694 -23.519
  238    HD2  HIS  35           HD2      HIS  35  12.691 -24.529 -22.793
  239    HE1  HIS  35           HE1      HIS  35  11.649 -26.143 -19.026
  240    HE2  HIS  35           HE2      HIS  35  13.512 -25.791 -20.719
  241    H    GLN  36           HN       GLN  36  10.351 -21.004 -23.677
  242    HA   GLN  36           HA       GLN  36  12.824 -20.670 -22.415
  243    HB2  GLN  36           HB2      GLN  36  11.311 -18.831 -24.332
  244    HB3  GLN  36           HB1      GLN  36  12.991 -18.523 -23.791
  245    HG2  GLN  36           HG2      GLN  36  12.296 -21.225 -25.034
  246    HG3  GLN  36           HG1      GLN  36  12.556 -19.777 -26.089
  247   HE21  GLN  36          HE21      GLN  36  14.049 -21.941 -23.666
  248   HE22  GLN  36          HE22      GLN  36  15.681 -21.475 -23.969
  249    H    CYS  37           HN       CYS  37   9.721 -18.915 -22.203
  250    HA   CYS  37           HA       CYS  37  10.765 -16.829 -20.620
  251    HB2  CYS  37           HB2      CYS  37   7.963 -17.981 -20.920
  252    HB3  CYS  37           HB1      CYS  37   8.328 -16.625 -19.815
  253    H    HIS  38           HN       HIS  38   9.483 -20.061 -19.964
  254    HA   HIS  38           HA       HIS  38   9.394 -19.670 -17.159
  255    HB2  HIS  38           HB2      HIS  38   8.136 -21.532 -18.326
  256    HB3  HIS  38           HB1      HIS  38   9.725 -22.292 -18.706
  257    HD2  HIS  38           HD2      HIS  38  11.154 -23.252 -16.388
  258    HE1  HIS  38           HE1      HIS  38   7.674 -23.207 -13.978
  259    HE2  HIS  38           HE2      HIS  38  10.078 -24.020 -14.185
  260    H    VAL  39           HN       VAL  39  11.754 -20.816 -19.546
  261    HA   VAL  39           HA       VAL  39  13.620 -21.694 -17.616
  262    HB   VAL  39           HB       VAL  39  13.935 -20.714 -20.486
  263   HG11  VAL  39          HG11      VAL  39  16.046 -20.268 -19.443
  264   HG12  VAL  39          HG12      VAL  39  16.241 -21.900 -20.188
  265   HG13  VAL  39          HG13      VAL  39  15.950 -21.744 -18.414
  266   HG21  VAL  39          HG21      VAL  39  13.190 -23.245 -19.119
  267   HG22  VAL  39          HG22      VAL  39  14.584 -23.444 -20.253
  268   HG23  VAL  39          HG23      VAL  39  13.023 -22.768 -20.852
  269    H    LYS  40           HN       LYS  40  12.854 -18.555 -19.210
  270    HA   LYS  40           HA       LYS  40  15.180 -17.260 -18.254
  271    HB2  LYS  40           HB2      LYS  40  12.393 -16.199 -18.981
  272    HB3  LYS  40           HB1      LYS  40  13.726 -15.123 -18.431
  273    HG2  LYS  40           HG2      LYS  40  14.898 -15.306 -20.401
  274    HG3  LYS  40           HG1      LYS  40  14.414 -17.017 -20.666
  275    HD2  LYS  40           HD2      LYS  40  12.824 -16.362 -22.119
  276    HD3  LYS  40           HD1      LYS  40  12.028 -15.386 -20.840
  277    HE2  LYS  40           HE2      LYS  40  13.400 -13.420 -21.399
  278    HE3  LYS  40           HE1      LYS  40  14.391 -14.391 -22.564
  279    HZ1  LYS  40           HZ1      LYS  40  11.599 -14.603 -23.097
  280    HZ2  LYS  40           HZ2      LYS  40  12.875 -14.109 -24.103
  281    HZ3  LYS  40           HZ3      LYS  40  12.106 -12.983 -23.091
  282    H    HIS  41           HN       HIS  41  11.934 -17.972 -16.966
  283    HA   HIS  41           HA       HIS  41  12.190 -16.374 -14.679
  284    HB2  HIS  41           HB2      HIS  41  10.008 -17.322 -15.245
  285    HB3  HIS  41           HB1      HIS  41  10.670 -18.981 -15.164
  286    HD2  HIS  41           HD2      HIS  41   9.597 -16.061 -12.689
  287    HE1  HIS  41           HE1      HIS  41  10.096 -19.649 -10.539
  288    HE2  HIS  41           HE2      HIS  41   9.331 -17.231 -10.432
  289    H    THR  42           HN       THR  42  13.122 -19.741 -15.508
  290    HA   THR  42           HA       THR  42  13.894 -20.463 -12.937
  291    HB   THR  42           HB       THR  42  14.974 -21.341 -15.665
  292    HG1  THR  42           HG1      THR  42  12.748 -21.760 -15.016
  293   HG21  THR  42          HG21      THR  42  15.611 -23.397 -14.059
  294   HG22  THR  42          HG22      THR  42  15.662 -22.100 -12.808
  295   HG23  THR  42          HG23      THR  42  16.715 -21.991 -14.267
  296    H    ASP  43           HN       ASP  43  15.733 -18.904 -15.670
  297    HA   ASP  43           HA       ASP  43  18.141 -18.812 -14.142
  298    HB2  ASP  43           HB2      ASP  43  17.218 -17.226 -16.606
  299    HB3  ASP  43           HB1      ASP  43  18.848 -17.026 -15.862
  300    H    CYS  44           HN       CYS  44  15.294 -16.711 -14.542
  301    HA   CYS  44           HA       CYS  44  16.472 -14.400 -13.407
  302    HB2  CYS  44           HB2      CYS  44  14.216 -14.481 -14.704
  303    HB3  CYS  44           HB1      CYS  44  13.517 -15.211 -13.223
  304    H    VAL  45           HN       VAL  45  14.812 -17.275 -12.204
  305    HA   VAL  45           HA       VAL  45  14.719 -16.262  -9.559
  306    HB   VAL  45           HB       VAL  45  14.121 -18.845 -10.942
  307   HG11  VAL  45          HG11      VAL  45  15.597 -19.637  -9.152
  308   HG12  VAL  45          HG12      VAL  45  13.893 -19.935  -8.629
  309   HG13  VAL  45          HG13      VAL  45  14.809 -18.543  -7.947
  310   HG21  VAL  45          HG21      VAL  45  12.298 -17.285 -10.701
  311   HG22  VAL  45          HG22      VAL  45  12.728 -16.928  -8.982
  312   HG23  VAL  45          HG23      VAL  45  12.043 -18.536  -9.425
  313    H    ASN  46           HN       ASN  46  16.830 -18.352 -11.498
  314    HA   ASN  46           HA       ASN  46  18.362 -19.244  -9.330
  315    HB2  ASN  46           HB2      ASN  46  18.856 -18.921 -12.295
  316    HB3  ASN  46           HB1      ASN  46  20.198 -19.382 -11.199
  317   HD21  ASN  46          HD21      ASN  46  18.647 -20.837 -13.406
  318   HD22  ASN  46          HD22      ASN  46  18.170 -22.328 -12.682
  319    H    THR  47           HN       THR  47  18.382 -16.222 -11.205
  320    HA   THR  47           HA       THR  47  20.920 -15.529  -9.957
  321    HB   THR  47           HB       THR  47  19.165 -13.907 -11.858
  322    HG1  THR  47           HG1      THR  47  20.038 -15.688 -12.861
  323   HG21  THR  47          HG21      THR  47  21.905 -13.469 -10.546
  324   HG22  THR  47          HG22      THR  47  20.486 -12.356 -10.596
  325   HG23  THR  47          HG23      THR  47  21.456 -12.653 -12.090
  326    H    GLY  48           HN       GLY  48  17.464 -14.473 -10.059
  327    HA2  GLY  48           HA2      GLY  48  17.964 -12.356  -8.225
  328    HA3  GLY  48           HA1      GLY  48  16.364 -13.057  -8.721
  329    H    CYS  49           HN       CYS  49  16.866 -15.812  -7.903
  330    HA   CYS  49           HA       CYS  49  17.473 -15.560  -5.071
  331    HB2  CYS  49           HB2      CYS  49  15.216 -17.023  -4.774
  332    HB3  CYS  49           HB1      CYS  49  15.226 -15.245  -4.596
  333    HA   PRO  50           HA       PRO  50  19.054 -19.258  -7.453
  334    HB2  PRO  50           HB2      PRO  50  21.116 -19.349  -5.413
  335    HB3  PRO  50           HB1      PRO  50  21.298 -18.847  -7.147
  336    HG2  PRO  50           HG2      PRO  50  20.929 -17.143  -4.670
  337    HG3  PRO  50           HG1      PRO  50  21.728 -16.737  -6.243
  338    HD2  PRO  50           HD2      PRO  50  19.288 -15.721  -5.568
  339    HD3  PRO  50           HD1      PRO  50  19.695 -16.144  -7.274
  Start of MODEL   15
    1    H1   SER   1           HT1      SER   1  11.356 -29.418   5.061
    2    H2   SER   1           HT2      SER   1  10.370 -30.801   5.134
    3    H3   SER   1           HT3      SER   1  11.416 -30.436   6.422
    4    HA   SER   1           HA       SER   1   9.045 -28.904   5.569
    5    HB2  SER   1           HB2      SER   1   8.710 -31.066   6.958
    6    HB3  SER   1           HB1      SER   1   9.626 -30.234   8.278
    7    HG   SER   1           HG       SER   1   8.045 -28.814   8.504
    8    H    SER   2           HN       SER   2  10.535 -26.993   5.252
    9    HA   SER   2           HA       SER   2  10.761 -25.638   7.779
   10    HB2  SER   2           HB2      SER   2  13.048 -26.750   7.593
   11    HB3  SER   2           HB1      SER   2  13.241 -25.968   5.973
   12    HG   SER   2           HG       SER   2  13.408 -24.056   6.893
   13    H    THR   3           HN       THR   3  10.707 -23.328   7.468
   14    HA   THR   3           HA       THR   3   9.694 -22.645   4.887
   15    HB   THR   3           HB       THR   3  10.439 -20.827   7.226
   16    HG1  THR   3           HG1      THR   3   7.903 -20.938   7.014
   17   HG21  THR   3          HG21      THR   3   8.980 -19.180   6.074
   18   HG22  THR   3          HG22      THR   3   8.652 -20.366   4.758
   19   HG23  THR   3          HG23      THR   3  10.313 -19.702   4.979
   20    HA   PRO   4           HA       PRO   4  13.658 -21.814   3.178
   21    HB2  PRO   4           HB2      PRO   4  12.772 -20.260   1.038
   22    HB3  PRO   4           HB1      PRO   4  12.756 -22.074   1.060
   23    HG2  PRO   4           HG2      PRO   4  10.498 -20.104   1.622
   24    HG3  PRO   4           HG1      PRO   4  10.458 -21.681   0.732
   25    HD2  PRO   4           HD2      PRO   4   9.566 -21.423   3.320
   26    HD3  PRO   4           HD1      PRO   4  10.341 -22.939   2.706
   27    H    ASP   5           HN       ASP   5  11.484 -18.939   2.808
   28    HA   ASP   5           HA       ASP   5  13.105 -17.457   4.575
   29    HB2  ASP   5           HB2      ASP   5  14.354 -17.491   2.247
   30    HB3  ASP   5           HB1      ASP   5  13.015 -16.418   1.729
   31    H    GLY   6           HN       GLY   6  12.156 -15.109   2.593
   32    HA2  GLY   6           HA2      GLY   6   9.351 -15.278   2.708
   33    HA3  GLY   6           HA1      GLY   6  10.051 -14.251   4.038
   34    H    THR   7           HN       THR   7  12.441 -13.494   2.421
   35    HA   THR   7           HA       THR   7  11.043 -11.511   0.762
   36    HB   THR   7           HB       THR   7  13.918 -11.629   1.812
   37    HG1  THR   7           HG1      THR   7  12.566  -9.402   2.332
   38   HG21  THR   7          HG21      THR   7  12.511  -9.783  -0.201
   39   HG22  THR   7          HG22      THR   7  14.087 -10.647  -0.370
   40   HG23  THR   7          HG23      THR   7  13.946  -9.237   0.747
   41    H    TRP   8           HN       TRP   8  13.362 -14.159   0.835
   42    HA   TRP   8           HA       TRP   8  14.344 -13.852  -1.738
   43    HB2  TRP   8           HB2      TRP   8  15.586 -15.506  -0.717
   44    HB3  TRP   8           HB1      TRP   8  14.242 -15.978   0.340
   45    HD1  TRP   8           HD1      TRP   8  15.945 -16.993  -2.941
   46    HE1  TRP   8           HE1      TRP   8  14.825 -19.115  -3.794
   47    HE3  TRP   8           HE3      TRP   8  11.994 -17.169   0.242
   48    HZ2  TRP   8           HZ2      TRP   8  12.554 -20.651  -3.182
   49    HZ3  TRP   8           HZ3      TRP   8  10.380 -18.995   0.047
   50    HH2  TRP   8           HH2      TRP   8  10.662 -20.720  -1.657
   51    H    VAL   9           HN       VAL   9  11.351 -15.331  -0.403
   52    HA   VAL   9           HA       VAL   9  10.635 -16.574  -2.852
   53    HB   VAL   9           HB       VAL   9   9.668 -17.223  -0.619
   54   HG11  VAL   9          HG11      VAL   9   7.790 -14.843  -0.861
   55   HG12  VAL   9          HG12      VAL   9   9.427 -14.564  -0.166
   56   HG13  VAL   9          HG13      VAL   9   8.317 -15.753   0.602
   57   HG21  VAL   9          HG21      VAL   9   7.704 -16.294  -2.801
   58   HG22  VAL   9          HG22      VAL   9   7.386 -17.549  -1.539
   59   HG23  VAL   9          HG23      VAL   9   8.639 -17.843  -2.806
   60    H    LYS  10           HN       LYS  10  10.415 -13.288  -1.555
   61    HA   LYS  10           HA       LYS  10   8.262 -12.466  -3.166
   62    HB2  LYS  10           HB2      LYS  10  10.684 -10.874  -2.122
   63    HB3  LYS  10           HB1      LYS  10   9.300 -10.125  -2.989
   64    HG2  LYS  10           HG2      LYS  10   7.738 -10.931  -1.217
   65    HG3  LYS  10           HG1      LYS  10   9.115 -11.687  -0.347
   66    HD2  LYS  10           HD2      LYS  10  10.183  -9.438  -0.081
   67    HD3  LYS  10           HD1      LYS  10   8.810  -8.680  -0.959
   68    HE2  LYS  10           HE2      LYS  10   7.233  -9.443   0.839
   69    HE3  LYS  10           HE1      LYS  10   8.613 -10.220   1.721
   70    HZ1  LYS  10           HZ1      LYS  10   9.201  -8.282   2.532
   71    HZ2  LYS  10           HZ2      LYS  10   7.736  -7.645   1.955
   72    HZ3  LYS  10           HZ3      LYS  10   9.150  -7.501   1.026
   73    H    CYS  11           HN       CYS  11  11.633 -13.261  -3.788
   74    HA   CYS  11           HA       CYS  11  11.752 -11.821  -6.240
   75    HB2  CYS  11           HB2      CYS  11  13.944 -12.278  -5.498
   76    HB3  CYS  11           HB1      CYS  11  13.475 -13.858  -4.832
   77    H    ARG  12           HN       ARG  12  11.056 -15.162  -5.129
   78    HA   ARG  12           HA       ARG  12  10.838 -16.316  -7.612
   79    HB2  ARG  12           HB2      ARG  12   9.149 -16.817  -5.112
   80    HB3  ARG  12           HB1      ARG  12   9.234 -17.894  -6.519
   81    HG2  ARG  12           HG2      ARG  12  11.778 -17.130  -5.100
   82    HG3  ARG  12           HG1      ARG  12  10.690 -18.360  -4.380
   83    HD2  ARG  12           HD2      ARG  12  10.796 -19.669  -6.558
   84    HD3  ARG  12           HD1      ARG  12  12.022 -18.467  -7.152
   85    HE   ARG  12           HE       ARG  12  13.054 -19.235  -4.716
   86   HH11  ARG  12          HH11      ARG  12  11.766 -20.975  -7.547
   87   HH12  ARG  12          HH12      ARG  12  12.809 -22.347  -7.373
   88   HH21  ARG  12          HH21      ARG  12  14.478 -21.113  -4.481
   89   HH22  ARG  12          HH22      ARG  12  14.374 -22.428  -5.603
   90    H    HIS  13           HN       HIS  13   8.500 -14.527  -5.578
   91    HA   HIS  13           HA       HIS  13   6.386 -14.868  -7.463
   92    HB2  HIS  13           HB2      HIS  13   5.756 -14.342  -5.166
   93    HB3  HIS  13           HB1      HIS  13   6.815 -12.888  -5.160
   94    HD2  HIS  13           HD2      HIS  13   5.547 -10.560  -5.879
   95    HE1  HIS  13           HE1      HIS  13   2.049 -12.352  -7.440
   96    HE2  HIS  13           HE2      HIS  13   3.201 -10.167  -6.832
   97    H    ASP  14           HN       ASP  14   8.898 -12.354  -6.858
   98    HA   ASP  14           HA       ASP  14   7.815 -10.414  -8.548
   99    HB2  ASP  14           HB2      ASP  14   9.878 -10.147  -6.999
  100    HB3  ASP  14           HB1      ASP  14  10.818 -10.971  -8.283
  101    H    CYS  15           HN       CYS  15  10.257 -13.038  -9.286
  102    HA   CYS  15           HA       CYS  15  10.245 -12.307 -12.050
  103    HB2  CYS  15           HB2      CYS  15  11.114 -14.926 -10.673
  104    HB3  CYS  15           HB1      CYS  15  11.351 -14.578 -12.415
  105    H    PHE  16           HN       PHE  16   8.262 -14.306  -9.940
  106    HA   PHE  16           HA       PHE  16   7.225 -15.967 -11.938
  107    HB2  PHE  16           HB2      PHE  16   6.794 -16.338  -9.507
  108    HB3  PHE  16           HB1      PHE  16   5.786 -14.855  -9.483
  109    HD1  PHE  16           HD1      PHE  16   6.106 -17.936 -11.580
  110    HD2  PHE  16           HD2      PHE  16   3.584 -15.222  -9.493
  111    HE1  PHE  16           HE1      PHE  16   4.147 -19.272 -12.188
  112    HE2  PHE  16           HE2      PHE  16   1.632 -16.570 -10.110
  113    HZ   PHE  16           HZ       PHE  16   1.913 -18.594 -11.456
  114    H    THR  17           HN       THR  17   6.146 -12.760 -10.635
  115    HA   THR  17           HA       THR  17   3.909 -12.639 -12.357
  116    HB   THR  17           HB       THR  17   3.988 -10.172 -11.989
  117    HG1  THR  17           HG1      THR  17   6.490 -10.895 -10.920
  118   HG21  THR  17          HG21      THR  17   3.530 -12.230 -10.139
  119   HG22  THR  17          HG22      THR  17   3.080 -10.496  -9.924
  120   HG23  THR  17          HG23      THR  17   4.636 -11.114  -9.255
  121    H    LYS  18           HN       LYS  18   7.374 -11.721 -12.720
  122    HA   LYS  18           HA       LYS  18   7.000 -10.426 -15.185
  123    HB2  LYS  18           HB2      LYS  18   9.389 -11.764 -13.862
  124    HB3  LYS  18           HB1      LYS  18   9.494 -11.242 -15.578
  125    HG2  LYS  18           HG2      LYS  18  10.285  -9.623 -13.641
  126    HG3  LYS  18           HG1      LYS  18   9.396  -8.975 -15.059
  127    HD2  LYS  18           HD2      LYS  18   7.399  -8.677 -13.840
  128    HD3  LYS  18           HD1      LYS  18   7.867  -9.865 -12.582
  129    HE2  LYS  18           HE2      LYS  18   7.978  -7.535 -11.707
  130    HE3  LYS  18           HE1      LYS  18   9.627  -8.278 -11.747
  131    HZ1  LYS  18           HZ1      LYS  18   9.164  -7.062 -14.211
  132    HZ2  LYS  18           HZ2      LYS  18  10.256  -6.614 -12.992
  133    HZ3  LYS  18           HZ3      LYS  18   8.691  -5.957 -13.013
  134    H    TYR  19           HN       TYR  19   7.230 -13.798 -14.146
  135    HA   TYR  19           HA       TYR  19   7.734 -14.758 -16.784
  136    HB2  TYR  19           HB2      TYR  19   8.369 -16.347 -15.188
  137    HB3  TYR  19           HB1      TYR  19   6.978 -15.990 -14.125
  138    HD1  TYR  19           HD1      TYR  19   7.892 -17.505 -17.397
  139    HD2  TYR  19           HD2      TYR  19   5.142 -17.309 -14.175
  140    HE1  TYR  19           HE1      TYR  19   6.702 -19.437 -18.308
  141    HE2  TYR  19           HE2      TYR  19   3.954 -19.240 -15.085
  142    HH   TYR  19           HH       TYR  19   3.631 -20.345 -17.321
  143    H    LYS  20           HN       LYS  20   4.876 -14.527 -14.586
  144    HA   LYS  20           HA       LYS  20   3.091 -15.663 -16.386
  145    HB2  LYS  20           HB2      LYS  20   2.562 -13.372 -14.420
  146    HB3  LYS  20           HB1      LYS  20   1.321 -14.424 -15.172
  147    HG2  LYS  20           HG2      LYS  20   3.564 -15.433 -13.375
  148    HG3  LYS  20           HG1      LYS  20   1.920 -15.037 -12.813
  149    HD2  LYS  20           HD2      LYS  20   2.115 -16.920 -15.159
  150    HD3  LYS  20           HD1      LYS  20   2.702 -17.545 -13.580
  151    HE2  LYS  20           HE2      LYS  20   0.476 -16.930 -12.544
  152    HE3  LYS  20           HE1      LYS  20  -0.105 -16.394 -14.174
  153    HZ1  LYS  20           HZ1      LYS  20  -0.202 -18.914 -13.120
  154    HZ2  LYS  20           HZ2      LYS  20   1.064 -18.995 -14.248
  155    HZ3  LYS  20           HZ3      LYS  20  -0.475 -18.468 -14.734
  156    H    SER  21           HN       SER  21   4.418 -12.371 -15.996
  157    HA   SER  21           HA       SER  21   2.650 -11.197 -17.882
  158    HB2  SER  21           HB2      SER  21   5.530 -10.403 -17.114
  159    HB3  SER  21           HB1      SER  21   4.427  -9.388 -18.129
  160    HG   SER  21           HG       SER  21   4.104 -10.215 -15.430
  161    H    CYS  22           HN       CYS  22   5.566 -13.208 -18.103
  162    HA   CYS  22           HA       CYS  22   6.120 -12.521 -20.806
  163    HB2  CYS  22           HB2      CYS  22   7.729 -13.700 -19.111
  164    HB3  CYS  22           HB1      CYS  22   6.784 -15.179 -19.467
  165    H    GLN  23           HN       GLN  23   4.148 -14.989 -19.105
  166    HA   GLN  23           HA       GLN  23   3.548 -16.384 -21.505
  167    HB2  GLN  23           HB2      GLN  23   2.452 -16.391 -18.669
  168    HB3  GLN  23           HB1      GLN  23   1.418 -17.071 -19.977
  169    HG2  GLN  23           HG2      GLN  23   3.483 -18.536 -20.646
  170    HG3  GLN  23           HG1      GLN  23   4.184 -18.040 -19.050
  171   HE21  GLN  23          HE21      GLN  23   1.896 -20.110 -20.677
  172   HE22  GLN  23          HE22      GLN  23   1.183 -20.827 -19.274
  173    H    MET  24           HN       MET  24   2.444 -13.422 -19.960
  174    HA   MET  24           HA       MET  24  -0.052 -13.465 -21.406
  175    HB2  MET  24           HB2      MET  24   1.351 -11.283 -19.787
  176    HB3  MET  24           HB1      MET  24  -0.241 -11.082 -20.582
  177    HG2  MET  24           HG2      MET  24   0.356 -13.254 -18.528
  178    HG3  MET  24           HG1      MET  24  -0.288 -11.648 -18.109
  179    HE1  MET  24           HE1      MET  24  -2.397 -15.393 -19.154
  180    HE2  MET  24           HE2      MET  24  -0.769 -15.000 -18.501
  181    HE3  MET  24           HE3      MET  24  -1.043 -15.019 -20.277
  182    H    SER  25           HN       SER  25   3.260 -12.680 -21.904
  183    HA   SER  25           HA       SER  25   2.817 -10.575 -23.747
  184    HB2  SER  25           HB2      SER  25   5.199 -12.508 -23.494
  185    HB3  SER  25           HB1      SER  25   5.171 -11.041 -24.555
  186    HG   SER  25           HG       SER  25   4.577 -10.890 -21.795
  187    H    ASP  26           HN       ASP  26   3.387 -10.807 -26.142
  188    HA   ASP  26           HA       ASP  26   1.876 -13.066 -27.111
  189    HB2  ASP  26           HB2      ASP  26   3.148 -10.653 -28.490
  190    HB3  ASP  26           HB1      ASP  26   2.331 -11.978 -29.388
  191    H    SER  27           HN       SER  27   4.670 -13.165 -25.828
  192    HA   SER  27           HA       SER  27   6.212 -14.028 -28.125
  193    HB2  SER  27           HB2      SER  27   6.939 -13.989 -25.129
  194    HB3  SER  27           HB1      SER  27   8.063 -14.456 -26.467
  195    HG   SER  27           HG       SER  27   8.457 -12.379 -26.112
  196    H    CYS  28           HN       CYS  28   3.830 -15.125 -26.059
  197    HA   CYS  28           HA       CYS  28   4.923 -17.782 -25.867
  198    HB2  CYS  28           HB2      CYS  28   2.801 -16.222 -24.560
  199    HB3  CYS  28           HB1      CYS  28   2.165 -17.739 -25.207
  200    H    HIS  29           HN       HIS  29   5.139 -17.928 -28.318
  201    HA   HIS  29           HA       HIS  29   2.576 -18.003 -29.686
  202    HB2  HIS  29           HB2      HIS  29   5.225 -18.873 -30.928
  203    HB3  HIS  29           HB1      HIS  29   3.778 -18.174 -31.748
  204    HD2  HIS  29           HD2      HIS  29   6.980 -16.983 -29.728
  205    HE1  HIS  29           HE1      HIS  29   5.054 -13.641 -31.460
  206    HE2  HIS  29           HE2      HIS  29   7.108 -14.470 -30.210
  207    H    ASP  30           HN       ASP  30   5.112 -20.142 -28.346
  208    HA   ASP  30           HA       ASP  30   3.303 -22.339 -28.965
  209    HB2  ASP  30           HB2      ASP  30   5.644 -22.069 -30.429
  210    HB3  ASP  30           HB1      ASP  30   6.237 -22.990 -29.003
  211    H    GLU  31           HN       GLU  31   4.199 -24.379 -27.637
  212    HA   GLU  31           HA       GLU  31   4.128 -23.533 -24.950
  213    HB2  GLU  31           HB2      GLU  31   4.878 -26.242 -26.196
  214    HB3  GLU  31           HB1      GLU  31   4.741 -25.963 -24.422
  215    HG2  GLU  31           HG2      GLU  31   2.324 -25.376 -24.650
  216    HG3  GLU  31           HG1      GLU  31   2.441 -25.566 -26.448
  217    H    GLN  32           HN       GLN  32   6.719 -24.492 -27.252
  218    HA   GLN  32           HA       GLN  32   8.745 -24.676 -25.317
  219    HB2  GLN  32           HB2      GLN  32   8.979 -25.448 -27.716
  220    HB3  GLN  32           HB1      GLN  32   8.989 -23.730 -28.213
  221    HG2  GLN  32           HG2      GLN  32  11.065 -23.311 -26.917
  222    HG3  GLN  32           HG1      GLN  32  11.047 -25.021 -26.325
  223   HE21  GLN  32          HE21      GLN  32  13.303 -24.409 -27.618
  224   HE22  GLN  32          HE22      GLN  32  13.337 -25.033 -29.230
  225    H    SER  33           HN       SER  33   7.439 -21.955 -27.304
  226    HA   SER  33           HA       SER  33   9.341 -20.093 -26.417
  227    HB2  SER  33           HB2      SER  33   6.410 -19.603 -27.227
  228    HB3  SER  33           HB1      SER  33   7.670 -18.320 -27.049
  229    HG   SER  33           HG       SER  33   8.713 -19.084 -28.763
  230    H    CYS  34           HN       CYS  34   6.139 -21.182 -25.140
  231    HA   CYS  34           HA       CYS  34   6.119 -19.287 -23.043
  232    HB2  CYS  34           HB2      CYS  34   4.804 -22.060 -23.273
  233    HB3  CYS  34           HB1      CYS  34   4.530 -20.943 -21.892
  234    H    HIS  35           HN       HIS  35   7.527 -22.558 -23.510
  235    HA   HIS  35           HA       HIS  35   8.175 -22.955 -20.799
  236    HB2  HIS  35           HB2      HIS  35   8.338 -24.827 -22.429
  237    HB3  HIS  35           HB1      HIS  35   9.618 -23.932 -23.324
  238    HD2  HIS  35           HD2      HIS  35  12.121 -24.710 -22.611
  239    HE1  HIS  35           HE1      HIS  35  11.161 -26.207 -18.775
  240    HE2  HIS  35           HE2      HIS  35  12.994 -25.889 -20.509
  241    H    GLN  36           HN       GLN  36   9.756 -21.206 -23.514
  242    HA   GLN  36           HA       GLN  36  12.216 -20.823 -22.240
  243    HB2  GLN  36           HB2      GLN  36  10.688 -19.021 -24.176
  244    HB3  GLN  36           HB1      GLN  36  12.358 -18.686 -23.631
  245    HG2  GLN  36           HG2      GLN  36  11.699 -21.400 -24.865
  246    HG3  GLN  36           HG1      GLN  36  11.962 -19.954 -25.920
  247   HE21  GLN  36          HE21      GLN  36  13.441 -22.160 -23.551
  248   HE22  GLN  36          HE22      GLN  36  15.071 -21.664 -23.806
  249    H    CYS  37           HN       CYS  37   9.071 -19.141 -22.028
  250    HA   CYS  37           HA       CYS  37  10.029 -16.973 -20.513
  251    HB2  CYS  37           HB2      CYS  37   7.298 -18.343 -20.554
  252    HB3  CYS  37           HB1      CYS  37   7.643 -16.877 -19.603
  253    H    HIS  38           HN       HIS  38   8.933 -20.253 -19.722
  254    HA   HIS  38           HA       HIS  38   8.980 -19.804 -16.925
  255    HB2  HIS  38           HB2      HIS  38   7.707 -21.711 -18.012
  256    HB3  HIS  38           HB1      HIS  38   9.299 -22.454 -18.418
  257    HD2  HIS  38           HD2      HIS  38  10.809 -23.333 -16.131
  258    HE1  HIS  38           HE1      HIS  38   7.418 -23.231 -13.599
  259    HE2  HIS  38           HE2      HIS  38   9.820 -24.035 -13.866
  260    H    VAL  39           HN       VAL  39  11.241 -20.971 -19.398
  261    HA   VAL  39           HA       VAL  39  13.203 -21.783 -17.547
  262    HB   VAL  39           HB       VAL  39  13.391 -20.812 -20.427
  263   HG11  VAL  39          HG11      VAL  39  15.493 -21.812 -18.428
  264   HG12  VAL  39          HG12      VAL  39  15.536 -20.338 -19.470
  265   HG13  VAL  39          HG13      VAL  39  15.719 -21.975 -20.210
  266   HG21  VAL  39          HG21      VAL  39  12.733 -23.349 -19.019
  267   HG22  VAL  39          HG22      VAL  39  14.073 -23.533 -20.220
  268   HG23  VAL  39          HG23      VAL  39  12.477 -22.876 -20.744
  269    H    LYS  40           HN       LYS  40  12.321 -18.670 -19.123
  270    HA   LYS  40           HA       LYS  40  14.660 -17.326 -18.267
  271    HB2  LYS  40           HB2      LYS  40  11.826 -16.318 -18.893
  272    HB3  LYS  40           HB1      LYS  40  13.161 -15.215 -18.405
  273    HG2  LYS  40           HG2      LYS  40  14.208 -15.340 -20.436
  274    HG3  LYS  40           HG1      LYS  40  13.852 -17.092 -20.637
  275    HD2  LYS  40           HD2      LYS  40  11.986 -16.688 -21.870
  276    HD3  LYS  40           HD1      LYS  40  11.407 -15.410 -20.750
  277    HE2  LYS  40           HE2      LYS  40  12.990 -13.767 -21.821
  278    HE3  LYS  40           HE1      LYS  40  13.534 -15.062 -22.968
  279    HZ1  LYS  40           HZ1      LYS  40  11.503 -13.353 -23.373
  280    HZ2  LYS  40           HZ2      LYS  40  10.670 -14.720 -22.806
  281    HZ3  LYS  40           HZ3      LYS  40  11.698 -14.849 -24.152
  282    H    HIS  41           HN       HIS  41  11.478 -18.084 -16.859
  283    HA   HIS  41           HA       HIS  41  11.784 -16.469 -14.588
  284    HB2  HIS  41           HB2      HIS  41   9.604 -17.476 -15.127
  285    HB3  HIS  41           HB1      HIS  41  10.299 -19.112 -14.976
  286    HD2  HIS  41           HD2      HIS  41   9.233 -16.087 -12.612
  287    HE1  HIS  41           HE1      HIS  41   9.740 -19.591 -10.330
  288    HE2  HIS  41           HE2      HIS  41   8.984 -17.169 -10.311
  289    H    THR  42           HN       THR  42  12.718 -19.833 -15.424
  290    HA   THR  42           HA       THR  42  13.576 -20.530 -12.875
  291    HB   THR  42           HB       THR  42  14.580 -21.417 -15.628
  292    HG1  THR  42           HG1      THR  42  12.379 -21.848 -14.916
  293   HG21  THR  42          HG21      THR  42  15.257 -23.460 -13.995
  294   HG22  THR  42          HG22      THR  42  15.385 -22.121 -12.796
  295   HG23  THR  42          HG23      THR  42  16.364 -22.078 -14.308
  296    H    ASP  43           HN       ASP  43  15.316 -18.977 -15.669
  297    HA   ASP  43           HA       ASP  43  17.768 -18.862 -14.221
  298    HB2  ASP  43           HB2      ASP  43  16.757 -17.288 -16.657
  299    HB3  ASP  43           HB1      ASP  43  18.411 -17.083 -15.969
  300    H    CYS  44           HN       CYS  44  14.905 -16.765 -14.550
  301    HA   CYS  44           HA       CYS  44  16.117 -14.454 -13.447
  302    HB2  CYS  44           HB2      CYS  44  13.842 -14.519 -14.701
  303    HB3  CYS  44           HB1      CYS  44  13.162 -15.254 -13.214
  304    H    VAL  45           HN       VAL  45  14.454 -17.315 -12.200
  305    HA   VAL  45           HA       VAL  45  14.412 -16.290  -9.558
  306    HB   VAL  45           HB       VAL  45  13.784 -18.882 -10.914
  307   HG11  VAL  45          HG11      VAL  45  13.597 -19.959  -8.594
  308   HG12  VAL  45          HG12      VAL  45  14.510 -18.560  -7.926
  309   HG13  VAL  45          HG13      VAL  45  15.293 -19.658  -9.136
  310   HG21  VAL  45          HG21      VAL  45  12.421 -16.984  -8.912
  311   HG22  VAL  45          HG22      VAL  45  11.719 -18.567  -9.412
  312   HG23  VAL  45          HG23      VAL  45  11.990 -17.271 -10.642
  313    H    ASN  46           HN       ASN  46  16.488 -18.392 -11.515
  314    HA   ASN  46           HA       ASN  46  18.046 -19.275  -9.365
  315    HB2  ASN  46           HB2      ASN  46  18.501 -18.964 -12.339
  316    HB3  ASN  46           HB1      ASN  46  19.861 -19.415 -11.256
  317   HD21  ASN  46          HD21      ASN  46  18.288 -20.888 -13.434
  318   HD22  ASN  46          HD22      ASN  46  17.824 -22.376 -12.696
  319    H    THR  47           HN       THR  47  18.043 -16.264 -11.254
  320    HA   THR  47           HA       THR  47  20.597 -15.563 -10.058
  321    HB   THR  47           HB       THR  47  18.778 -13.922 -11.878
  322    HG1  THR  47           HG1      THR  47  19.623 -15.723 -12.909
  323   HG21  THR  47          HG21      THR  47  20.149 -12.386 -10.661
  324   HG22  THR  47          HG22      THR  47  21.078 -12.682 -12.180
  325   HG23  THR  47          HG23      THR  47  21.560 -13.509 -10.651
  326    H    GLY  48           HN       GLY  48  17.145 -14.475 -10.081
  327    HA2  GLY  48           HA2      GLY  48  17.704 -12.402  -8.212
  328    HA3  GLY  48           HA1      GLY  48  16.086 -13.064  -8.703
  329    H    CYS  49           HN       CYS  49  16.550 -15.844  -7.928
  330    HA   CYS  49           HA       CYS  49  17.177 -15.636  -5.095
  331    HB2  CYS  49           HB2      CYS  49  14.918 -17.079  -4.788
  332    HB3  CYS  49           HB1      CYS  49  14.927 -15.299  -4.624
  333    HA   PRO  50           HA       PRO  50  18.691 -19.343  -7.494
  334    HB2  PRO  50           HB2      PRO  50  20.856 -19.448  -5.596
  335    HB3  PRO  50           HB1      PRO  50  20.937 -18.862  -7.312
  336    HG2  PRO  50           HG2      PRO  50  20.636 -17.284  -4.733
  337    HG3  PRO  50           HG1      PRO  50  21.424 -16.811  -6.295
  338    HD2  PRO  50           HD2      PRO  50  19.000 -15.809  -5.569
  339    HD3  PRO  50           HD1      PRO  50  19.380 -16.189  -7.292
  Start of MODEL   16
    1    H1   SER   1           HT1      SER   1   6.897 -28.893   3.830
    2    H2   SER   1           HT2      SER   1   8.515 -28.495   3.497
    3    H3   SER   1           HT3      SER   1   7.408 -27.273   3.906
    4    HA   SER   1           HA       SER   1   7.180 -28.887   6.007
    5    HB2  SER   1           HB2      SER   1   9.234 -30.165   4.948
    6    HB3  SER   1           HB1      SER   1  10.193 -28.728   5.487
    7    HG   SER   1           HG       SER   1   9.857 -30.668   6.927
    8    H    SER   2           HN       SER   2   9.532 -26.514   4.589
    9    HA   SER   2           HA       SER   2   8.592 -24.599   6.521
   10    HB2  SER   2           HB2      SER   2  10.526 -25.690   7.775
   11    HB3  SER   2           HB1      SER   2  11.591 -25.306   6.364
   12    HG   SER   2           HG       SER   2  11.489 -23.234   6.824
   13    H    THR   3           HN       THR   3   8.988 -22.418   5.766
   14    HA   THR   3           HA       THR   3   9.465 -22.380   2.951
   15    HB   THR   3           HB       THR   3   9.236 -20.004   4.850
   16    HG1  THR   3           HG1      THR   3   7.043 -20.327   3.510
   17   HG21  THR   3          HG21      THR   3   8.783 -20.341   1.820
   18   HG22  THR   3          HG22      THR   3  10.183 -19.514   2.598
   19   HG23  THR   3          HG23      THR   3   8.526 -18.825   2.758
   20    HA   PRO   4           HA       PRO   4  13.846 -22.081   3.146
   21    HB2  PRO   4           HB2      PRO   4  13.401 -20.344   0.718
   22    HB3  PRO   4           HB1      PRO   4  14.501 -21.761   0.933
   23    HG2  PRO   4           HG2      PRO   4  12.196 -22.026  -0.433
   24    HG3  PRO   4           HG1      PRO   4  12.757 -23.330   0.678
   25    HD2  PRO   4           HD2      PRO   4  10.570 -21.250   1.082
   26    HD3  PRO   4           HD1      PRO   4  10.635 -22.978   1.620
   27    H    ASP   5           HN       ASP   5  11.988 -19.082   2.386
   28    HA   ASP   5           HA       ASP   5  13.477 -17.752   4.418
   29    HB2  ASP   5           HB2      ASP   5  14.744 -17.568   2.058
   30    HB3  ASP   5           HB1      ASP   5  13.440 -16.386   1.719
   31    H    GLY   6           HN       GLY   6  12.568 -15.209   2.769
   32    HA2  GLY   6           HA2      GLY   6   9.736 -15.491   2.805
   33    HA3  GLY   6           HA1      GLY   6  10.437 -14.487   4.150
   34    H    THR   7           HN       THR   7  12.778 -13.623   2.520
   35    HA   THR   7           HA       THR   7  11.300 -11.632   0.938
   36    HB   THR   7           HB       THR   7  14.197 -11.688   1.937
   37    HG1  THR   7           HG1      THR   7  12.883  -9.537   2.631
   38   HG21  THR   7          HG21      THR   7  14.286 -10.604  -0.197
   39   HG22  THR   7          HG22      THR   7  14.097  -9.247   0.979
   40   HG23  THR   7          HG23      THR   7  12.675  -9.824   0.030
   41    H    TRP   8           HN       TRP   8  13.732 -14.187   0.905
   42    HA   TRP   8           HA       TRP   8  14.645 -13.767  -1.680
   43    HB2  TRP   8           HB2      TRP   8  15.999 -15.370  -0.728
   44    HB3  TRP   8           HB1      TRP   8  14.713 -15.933   0.354
   45    HD1  TRP   8           HD1      TRP   8  16.383 -16.801  -2.984
   46    HE1  TRP   8           HE1      TRP   8  15.356 -18.967  -3.849
   47    HE3  TRP   8           HE3      TRP   8  12.523 -17.242   0.284
   48    HZ2  TRP   8           HZ2      TRP   8  13.187 -20.632  -3.212
   49    HZ3  TRP   8           HZ3      TRP   8  11.005 -19.148   0.098
   50    HH2  TRP   8           HH2      TRP   8  11.342 -20.824  -1.645
   51    H    VAL   9           HN       VAL   9  11.769 -15.430  -0.311
   52    HA   VAL   9           HA       VAL   9  11.066 -16.668  -2.763
   53    HB   VAL   9           HB       VAL   9  10.184 -17.400  -0.520
   54   HG11  VAL   9          HG11      VAL   9   9.814 -14.768  -0.016
   55   HG12  VAL   9          HG12      VAL   9   8.774 -16.023   0.748
   56   HG13  VAL   9          HG13      VAL   9   8.181 -15.114  -0.692
   57   HG21  VAL   9          HG21      VAL   9   9.146 -18.037  -2.702
   58   HG22  VAL   9          HG22      VAL   9   8.118 -16.543  -2.639
   59   HG23  VAL   9          HG23      VAL   9   7.911 -17.842  -1.401
   60    H    LYS  10           HN       LYS  10  10.713 -13.415  -1.421
   61    HA   LYS  10           HA       LYS  10   8.478 -12.684  -2.964
   62    HB2  LYS  10           HB2      LYS  10  10.844 -10.985  -1.965
   63    HB3  LYS  10           HB1      LYS  10   9.403 -10.296  -2.789
   64    HG2  LYS  10           HG2      LYS  10   7.929 -11.197  -0.989
   65    HG3  LYS  10           HG1      LYS  10   9.363 -11.893  -0.162
   66    HD2  LYS  10           HD2      LYS  10  10.325  -9.598   0.105
   67    HD3  LYS  10           HD1      LYS  10   8.897  -8.899  -0.731
   68    HE2  LYS  10           HE2      LYS  10   7.402  -9.759   1.096
   69    HE3  LYS  10           HE1      LYS  10   8.841 -10.473   1.936
   70    HZ1  LYS  10           HZ1      LYS  10   9.669  -7.996   1.617
   71    HZ2  LYS  10           HZ2      LYS  10   8.749  -8.502   2.952
   72    HZ3  LYS  10           HZ3      LYS  10   8.000  -7.694   1.660
   73    H    CYS  11           HN       CYS  11  11.868 -13.298  -3.687
   74    HA   CYS  11           HA       CYS  11  11.843 -11.830  -6.124
   75    HB2  CYS  11           HB2      CYS  11  14.076 -12.184  -5.453
   76    HB3  CYS  11           HB1      CYS  11  13.705 -13.791  -4.790
   77    H    ARG  12           HN       ARG  12  11.339 -15.209  -5.031
   78    HA   ARG  12           HA       ARG  12  11.112 -16.351  -7.519
   79    HB2  ARG  12           HB2      ARG  12   9.513 -16.956  -4.983
   80    HB3  ARG  12           HB1      ARG  12   9.616 -18.014  -6.403
   81    HG2  ARG  12           HG2      ARG  12  12.151 -17.139  -5.031
   82    HG3  ARG  12           HG1      ARG  12  11.143 -18.434  -4.306
   83    HD2  ARG  12           HD2      ARG  12  11.272 -19.712  -6.496
   84    HD3  ARG  12           HD1      ARG  12  12.407 -18.433  -7.114
   85    HE   ARG  12           HE       ARG  12  13.572 -19.150  -4.733
   86   HH11  ARG  12          HH11      ARG  12  12.241 -20.983  -7.484
   87   HH12  ARG  12          HH12      ARG  12  13.353 -22.303  -7.345
   88   HH21  ARG  12          HH21      ARG  12  15.093 -20.959  -4.545
   89   HH22  ARG  12          HH22      ARG  12  14.999 -22.289  -5.648
   90    H    HIS  13           HN       HIS  13   8.750 -14.690  -5.409
   91    HA   HIS  13           HA       HIS  13   6.606 -15.108  -7.245
   92    HB2  HIS  13           HB2      HIS  13   6.008 -14.631  -4.928
   93    HB3  HIS  13           HB1      HIS  13   7.005 -13.134  -4.932
   94    HD2  HIS  13           HD2      HIS  13   5.627 -10.853  -5.602
   95    HE1  HIS  13           HE1      HIS  13   2.164 -12.778  -7.083
   96    HE2  HIS  13           HE2      HIS  13   3.242 -10.551  -6.491
   97    H    ASP  14           HN       ASP  14   9.023 -12.495  -6.678
   98    HA   ASP  14           HA       ASP  14   7.817 -10.587  -8.321
   99    HB2  ASP  14           HB2      ASP  14   9.916 -10.261  -6.819
  100    HB3  ASP  14           HB1      ASP  14  10.848 -11.013  -8.152
  101    H    CYS  15           HN       CYS  15  10.345 -13.103  -9.145
  102    HA   CYS  15           HA       CYS  15  10.237 -12.353 -11.901
  103    HB2  CYS  15           HB2      CYS  15  11.237 -14.946 -10.564
  104    HB3  CYS  15           HB1      CYS  15  11.413 -14.584 -12.308
  105    H    PHE  16           HN       PHE  16   8.386 -14.447  -9.762
  106    HA   PHE  16           HA       PHE  16   7.359 -16.125 -11.752
  107    HB2  PHE  16           HB2      PHE  16   7.011 -16.537  -9.313
  108    HB3  PHE  16           HB1      PHE  16   5.947 -15.094  -9.245
  109    HD1  PHE  16           HD1      PHE  16   6.329 -18.142 -11.381
  110    HD2  PHE  16           HD2      PHE  16   3.763 -15.546  -9.201
  111    HE1  PHE  16           HE1      PHE  16   4.407 -19.549 -11.950
  112    HE2  PHE  16           HE2      PHE  16   1.847 -16.963  -9.778
  113    HZ   PHE  16           HZ       PHE  16   2.170 -18.962 -11.151
  114    H    THR  17           HN       THR  17   6.199 -12.974 -10.384
  115    HA   THR  17           HA       THR  17   3.912 -12.918 -12.039
  116    HB   THR  17           HB       THR  17   3.907 -10.457 -11.644
  117    HG1  THR  17           HG1      THR  17   6.478 -11.090 -10.697
  118   HG21  THR  17          HG21      THR  17   3.073 -10.847  -9.561
  119   HG22  THR  17          HG22      THR  17   4.680 -11.376  -8.939
  120   HG23  THR  17          HG23      THR  17   3.610 -12.552  -9.793
  121    H    LYS  18           HN       LYS  18   7.331 -11.870 -12.490
  122    HA   LYS  18           HA       LYS  18   6.840 -10.567 -14.932
  123    HB2  LYS  18           HB2      LYS  18   9.315 -11.834 -13.695
  124    HB3  LYS  18           HB1      LYS  18   9.349 -11.280 -15.403
  125    HG2  LYS  18           HG2      LYS  18  10.136  -9.668 -13.451
  126    HG3  LYS  18           HG1      LYS  18   9.200  -9.028 -14.843
  127    HD2  LYS  18           HD2      LYS  18   7.213  -8.823 -13.582
  128    HD3  LYS  18           HD1      LYS  18   7.755  -9.999 -12.343
  129    HE2  LYS  18           HE2      LYS  18   7.798  -7.679 -11.447
  130    HE3  LYS  18           HE1      LYS  18   9.475  -8.350 -11.541
  131    HZ1  LYS  18           HZ1      LYS  18   9.836  -6.423 -12.558
  132    HZ2  LYS  18           HZ2      LYS  18   8.222  -6.197 -13.032
  133    HZ3  LYS  18           HZ3      LYS  18   9.236  -7.220 -13.931
  134    H    TYR  19           HN       TYR  19   7.211 -13.934 -13.929
  135    HA   TYR  19           HA       TYR  19   7.679 -14.858 -16.586
  136    HB2  TYR  19           HB2      TYR  19   8.415 -16.430 -15.015
  137    HB3  TYR  19           HB1      TYR  19   7.038 -16.133 -13.917
  138    HD1  TYR  19           HD1      TYR  19   7.932 -17.596 -17.214
  139    HD2  TYR  19           HD2      TYR  19   5.250 -17.516 -13.931
  140    HE1  TYR  19           HE1      TYR  19   6.796 -19.569 -18.108
  141    HE2  TYR  19           HE2      TYR  19   4.114 -19.488 -14.824
  142    HH   TYR  19           HH       TYR  19   3.783 -20.601 -17.048
  143    H    LYS  20           HN       LYS  20   4.872 -14.746 -14.309
  144    HA   LYS  20           HA       LYS  20   3.075 -15.930 -16.067
  145    HB2  LYS  20           HB2      LYS  20   2.526 -13.668 -14.074
  146    HB3  LYS  20           HB1      LYS  20   1.299 -14.755 -14.796
  147    HG2  LYS  20           HG2      LYS  20   3.622 -15.692 -13.062
  148    HG3  LYS  20           HG1      LYS  20   1.975 -15.368 -12.463
  149    HD2  LYS  20           HD2      LYS  20   2.188 -17.220 -14.829
  150    HD3  LYS  20           HD1      LYS  20   2.852 -17.836 -13.279
  151    HE2  LYS  20           HE2      LYS  20   0.650 -17.389 -12.158
  152    HE3  LYS  20           HE1      LYS  20  -0.018 -16.771 -13.724
  153    HZ1  LYS  20           HZ1      LYS  20   0.314 -19.439 -12.809
  154    HZ2  LYS  20           HZ2      LYS  20   1.102 -19.214 -14.296
  155    HZ3  LYS  20           HZ3      LYS  20  -0.547 -18.839 -14.143
  156    H    SER  21           HN       SER  21   4.310 -12.604 -15.701
  157    HA   SER  21           HA       SER  21   2.458 -11.469 -17.522
  158    HB2  SER  21           HB2      SER  21   5.343 -10.613 -16.850
  159    HB3  SER  21           HB1      SER  21   4.188  -9.624 -17.830
  160    HG   SER  21           HG       SER  21   3.951 -10.463 -15.125
  161    H    CYS  22           HN       CYS  22   5.504 -13.301 -17.846
  162    HA   CYS  22           HA       CYS  22   5.893 -12.642 -20.575
  163    HB2  CYS  22           HB2      CYS  22   7.628 -13.719 -18.951
  164    HB3  CYS  22           HB1      CYS  22   6.733 -15.246 -19.223
  165    H    GLN  23           HN       GLN  23   4.108 -15.193 -18.786
  166    HA   GLN  23           HA       GLN  23   3.489 -16.644 -21.149
  167    HB2  GLN  23           HB2      GLN  23   2.492 -16.661 -18.278
  168    HB3  GLN  23           HB1      GLN  23   1.439 -17.397 -19.539
  169    HG2  GLN  23           HG2      GLN  23   3.625 -18.726 -20.265
  170    HG3  GLN  23           HG1      GLN  23   4.221 -18.274 -18.618
  171   HE21  GLN  23          HE21      GLN  23   2.082 -20.343 -20.450
  172   HE22  GLN  23          HE22      GLN  23   1.344 -21.159 -19.115
  173    H    MET  24           HN       MET  24   2.322 -13.689 -19.641
  174    HA   MET  24           HA       MET  24  -0.199 -13.893 -21.042
  175    HB2  MET  24           HB2      MET  24   1.063 -11.785 -19.267
  176    HB3  MET  24           HB1      MET  24  -0.446 -11.493 -20.187
  177    HG2  MET  24           HG2      MET  24  -1.253 -13.738 -19.070
  178    HG3  MET  24           HG1      MET  24   0.059 -13.412 -17.901
  179    HE1  MET  24           HE1      MET  24  -0.514  -9.876 -18.688
  180    HE2  MET  24           HE2      MET  24   0.545 -10.851 -17.611
  181    HE3  MET  24           HE3      MET  24  -0.671  -9.730 -16.903
  182    H    SER  25           HN       SER  25   2.978 -13.199 -21.751
  183    HA   SER  25           HA       SER  25   2.434 -10.941 -23.435
  184    HB2  SER  25           HB2      SER  25   4.894 -12.789 -23.313
  185    HB3  SER  25           HB1      SER  25   4.781 -11.283 -24.309
  186    HG   SER  25           HG       SER  25   4.229 -11.236 -21.543
  187    H    ASP  26           HN       ASP  26   2.980 -11.098 -25.852
  188    HA   ASP  26           HA       ASP  26   1.535 -13.400 -26.843
  189    HB2  ASP  26           HB2      ASP  26   2.628 -10.880 -28.191
  190    HB3  ASP  26           HB1      ASP  26   1.843 -12.220 -29.097
  191    H    SER  27           HN       SER  27   4.479 -13.158 -25.711
  192    HA   SER  27           HA       SER  27   5.963 -13.916 -28.054
  193    HB2  SER  27           HB2      SER  27   6.745 -13.990 -25.074
  194    HB3  SER  27           HB1      SER  27   7.868 -14.343 -26.448
  195    HG   SER  27           HG       SER  27   8.200 -12.306 -26.368
  196    H    CYS  28           HN       CYS  28   3.717 -15.325 -25.968
  197    HA   CYS  28           HA       CYS  28   5.017 -17.906 -25.999
  198    HB2  CYS  28           HB2      CYS  28   3.554 -17.155 -24.040
  199    HB3  CYS  28           HB1      CYS  28   2.163 -17.167 -25.176
  200    H    HIS  29           HN       HIS  29   5.222 -17.983 -28.396
  201    HA   HIS  29           HA       HIS  29   2.696 -18.085 -29.807
  202    HB2  HIS  29           HB2      HIS  29   5.416 -18.877 -30.958
  203    HB3  HIS  29           HB1      HIS  29   3.966 -18.273 -31.846
  204    HD2  HIS  29           HD2      HIS  29   6.964 -16.860 -29.651
  205    HE1  HIS  29           HE1      HIS  29   4.989 -13.677 -31.615
  206    HE2  HIS  29           HE2      HIS  29   6.985 -14.355 -30.192
  207    H    ASP  30           HN       ASP  30   5.155 -20.205 -28.350
  208    HA   ASP  30           HA       ASP  30   3.403 -22.417 -29.050
  209    HB2  ASP  30           HB2      ASP  30   5.770 -22.132 -30.465
  210    HB3  ASP  30           HB1      ASP  30   6.350 -23.034 -29.021
  211    H    GLU  31           HN       GLU  31   4.325 -24.455 -27.692
  212    HA   GLU  31           HA       GLU  31   4.153 -23.609 -25.011
  213    HB2  GLU  31           HB2      GLU  31   5.038 -26.290 -26.229
  214    HB3  GLU  31           HB1      GLU  31   4.846 -26.014 -24.459
  215    HG2  GLU  31           HG2      GLU  31   2.418 -25.525 -24.743
  216    HG3  GLU  31           HG1      GLU  31   2.582 -25.699 -26.537
  217    H    GLN  32           HN       GLN  32   6.842 -24.503 -27.226
  218    HA   GLN  32           HA       GLN  32   8.819 -24.580 -25.234
  219    HB2  GLN  32           HB2      GLN  32   9.138 -25.384 -27.616
  220    HB3  GLN  32           HB1      GLN  32   9.116 -23.672 -28.138
  221    HG2  GLN  32           HG2      GLN  32  11.142 -23.177 -26.801
  222    HG3  GLN  32           HG1      GLN  32  11.148 -24.869 -26.160
  223   HE21  GLN  32          HE21      GLN  32  13.430 -24.270 -27.388
  224   HE22  GLN  32          HE22      GLN  32  13.529 -24.926 -28.985
  225    H    SER  33           HN       SER  33   7.409 -21.952 -27.248
  226    HA   SER  33           HA       SER  33   9.231 -19.993 -26.424
  227    HB2  SER  33           HB2      SER  33   6.262 -19.655 -27.163
  228    HB3  SER  33           HB1      SER  33   7.461 -18.310 -27.031
  229    HG   SER  33           HG       SER  33   8.545 -19.106 -28.737
  230    H    CYS  34           HN       CYS  34   6.119 -21.227 -25.033
  231    HA   CYS  34           HA       CYS  34   6.124 -19.288 -22.946
  232    HB2  CYS  34           HB2      CYS  34   4.528 -21.708 -23.658
  233    HB3  CYS  34           HB1      CYS  34   4.793 -21.536 -21.888
  234    H    HIS  35           HN       HIS  35   7.646 -22.467 -23.516
  235    HA   HIS  35           HA       HIS  35   8.288 -22.940 -20.802
  236    HB2  HIS  35           HB2      HIS  35   8.504 -24.770 -22.474
  237    HB3  HIS  35           HB1      HIS  35   9.746 -23.813 -23.358
  238    HD2  HIS  35           HD2      HIS  35  12.280 -24.521 -22.682
  239    HE1  HIS  35           HE1      HIS  35  11.405 -26.126 -18.869
  240    HE2  HIS  35           HE2      HIS  35  13.211 -25.711 -20.611
  241    H    GLN  36           HN       GLN  36   9.784 -21.075 -23.477
  242    HA   GLN  36           HA       GLN  36  12.241 -20.640 -22.220
  243    HB2  GLN  36           HB2      GLN  36  10.629 -18.850 -24.094
  244    HB3  GLN  36           HB1      GLN  36  12.291 -18.467 -23.558
  245    HG2  GLN  36           HG2      GLN  36  11.696 -21.166 -24.866
  246    HG3  GLN  36           HG1      GLN  36  11.942 -19.682 -25.871
  247   HE21  GLN  36          HE21      GLN  36  13.450 -21.985 -23.636
  248   HE22  GLN  36          HE22      GLN  36  15.071 -21.437 -23.841
  249    H    CYS  37           HN       CYS  37   9.036 -19.106 -21.912
  250    HA   CYS  37           HA       CYS  37   9.918 -16.924 -20.382
  251    HB2  CYS  37           HB2      CYS  37   7.264 -18.436 -20.367
  252    HB3  CYS  37           HB1      CYS  37   7.558 -16.959 -19.413
  253    H    HIS  38           HN       HIS  38   9.006 -20.265 -19.621
  254    HA   HIS  38           HA       HIS  38   9.118 -19.857 -16.819
  255    HB2  HIS  38           HB2      HIS  38   7.885 -21.794 -17.900
  256    HB3  HIS  38           HB1      HIS  38   9.491 -22.468 -18.366
  257    HD2  HIS  38           HD2      HIS  38  11.102 -23.323 -16.138
  258    HE1  HIS  38           HE1      HIS  38   7.785 -23.402 -13.509
  259    HE2  HIS  38           HE2      HIS  38  10.208 -24.104 -13.859
  260    H    VAL  39           HN       VAL  39  11.344 -20.902 -19.378
  261    HA   VAL  39           HA       VAL  39  13.391 -21.670 -17.600
  262    HB   VAL  39           HB       VAL  39  13.453 -20.645 -20.468
  263   HG11  VAL  39          HG11      VAL  39  15.654 -21.593 -18.550
  264   HG12  VAL  39          HG12      VAL  39  15.610 -20.106 -19.571
  265   HG13  VAL  39          HG13      VAL  39  15.831 -21.724 -20.340
  266   HG21  VAL  39          HG21      VAL  39  14.237 -23.334 -20.346
  267   HG22  VAL  39          HG22      VAL  39  12.591 -22.735 -20.776
  268   HG23  VAL  39          HG23      VAL  39  12.957 -23.235 -19.076
  269    H    LYS  40           HN       LYS  40  12.363 -18.560 -19.105
  270    HA   LYS  40           HA       LYS  40  14.682 -17.158 -18.278
  271    HB2  LYS  40           HB2      LYS  40  11.808 -16.212 -18.804
  272    HB3  LYS  40           HB1      LYS  40  13.145 -15.089 -18.372
  273    HG2  LYS  40           HG2      LYS  40  14.159 -15.252 -20.430
  274    HG3  LYS  40           HG1      LYS  40  13.706 -16.979 -20.647
  275    HD2  LYS  40           HD2      LYS  40  12.097 -16.297 -22.069
  276    HD3  LYS  40           HD1      LYS  40  11.234 -15.589 -20.664
  277    HE2  LYS  40           HE2      LYS  40  12.347 -13.406 -21.021
  278    HE3  LYS  40           HE1      LYS  40  13.351 -14.103 -22.358
  279    HZ1  LYS  40           HZ1      LYS  40  10.387 -14.159 -22.401
  280    HZ2  LYS  40           HZ2      LYS  40  11.482 -14.364 -23.683
  281    HZ3  LYS  40           HZ3      LYS  40  11.285 -12.835 -22.972
  282    H    HIS  41           HN       HIS  41  11.558 -18.032 -16.807
  283    HA   HIS  41           HA       HIS  41  11.866 -16.433 -14.527
  284    HB2  HIS  41           HB2      HIS  41   9.708 -17.505 -15.017
  285    HB3  HIS  41           HB1      HIS  41  10.460 -19.121 -14.909
  286    HD2  HIS  41           HD2      HIS  41   9.360 -16.166 -12.471
  287    HE1  HIS  41           HE1      HIS  41  10.054 -19.679 -10.255
  288    HE2  HIS  41           HE2      HIS  41   9.215 -17.286 -10.179
  289    H    THR  42           HN       THR  42  12.900 -19.750 -15.430
  290    HA   THR  42           HA       THR  42  13.847 -20.447 -12.912
  291    HB   THR  42           HB       THR  42  14.805 -21.262 -15.705
  292    HG1  THR  42           HG1      THR  42  12.648 -21.791 -14.936
  293   HG21  THR  42          HG21      THR  42  15.717 -21.979 -12.907
  294   HG22  THR  42          HG22      THR  42  16.655 -21.854 -14.439
  295   HG23  THR  42          HG23      THR  42  15.620 -23.294 -14.132
  296    H    ASP  43           HN       ASP  43  15.457 -18.790 -15.729
  297    HA   ASP  43           HA       ASP  43  17.940 -18.601 -14.339
  298    HB2  ASP  43           HB2      ASP  43  16.811 -17.044 -16.733
  299    HB3  ASP  43           HB1      ASP  43  18.469 -16.776 -16.080
  300    H    CYS  44           HN       CYS  44  14.991 -16.614 -14.571
  301    HA   CYS  44           HA       CYS  44  16.138 -14.269 -13.476
  302    HB2  CYS  44           HB2      CYS  44  13.831 -14.421 -14.667
  303    HB3  CYS  44           HB1      CYS  44  13.226 -15.187 -13.163
  304    H    VAL  45           HN       VAL  45  14.641 -17.211 -12.216
  305    HA   VAL  45           HA       VAL  45  14.633 -16.211  -9.562
  306    HB   VAL  45           HB       VAL  45  14.056 -18.805 -10.933
  307   HG11  VAL  45          HG11      VAL  45  15.655 -19.554  -9.224
  308   HG12  VAL  45          HG12      VAL  45  13.990 -19.927  -8.628
  309   HG13  VAL  45          HG13      VAL  45  14.879 -18.506  -7.970
  310   HG21  VAL  45          HG21      VAL  45  12.697 -16.987  -8.855
  311   HG22  VAL  45          HG22      VAL  45  12.037 -18.590  -9.350
  312   HG23  VAL  45          HG23      VAL  45  12.213 -17.269 -10.571
  313    H    ASN  46           HN       ASN  46  16.728 -18.212 -11.609
  314    HA   ASN  46           HA       ASN  46  18.385 -19.077  -9.529
  315    HB2  ASN  46           HB2      ASN  46  18.738 -18.676 -12.505
  316    HB3  ASN  46           HB1      ASN  46  20.150 -19.090 -11.477
  317   HD21  ASN  46          HD21      ASN  46  18.559 -20.578 -13.640
  318   HD22  ASN  46          HD22      ASN  46  18.192 -22.104 -12.924
  319    H    THR  47           HN       THR  47  18.231 -16.018 -11.346
  320    HA   THR  47           HA       THR  47  20.775 -15.258 -10.144
  321    HB   THR  47           HB       THR  47  18.943 -13.683 -12.010
  322    HG1  THR  47           HG1      THR  47  19.866 -15.443 -13.023
  323   HG21  THR  47          HG21      THR  47  20.235 -12.104 -10.747
  324   HG22  THR  47          HG22      THR  47  21.179 -12.347 -12.267
  325   HG23  THR  47          HG23      THR  47  21.692 -13.167 -10.744
  326    H    GLY  48           HN       GLY  48  17.284 -14.331 -10.178
  327    HA2  GLY  48           HA2      GLY  48  17.735 -12.193  -8.358
  328    HA3  GLY  48           HA1      GLY  48  16.155 -12.963  -8.813
  329    H    CYS  49           HN       CYS  49  16.790 -15.690  -8.000
  330    HA   CYS  49           HA       CYS  49  17.472 -15.413  -5.191
  331    HB2  CYS  49           HB2      CYS  49  15.272 -16.929  -4.805
  332    HB3  CYS  49           HB1      CYS  49  15.231 -15.150  -4.649
  333    HA   PRO  50           HA       PRO  50  19.059 -19.079  -7.618
  334    HB2  PRO  50           HB2      PRO  50  21.219 -19.101  -5.685
  335    HB3  PRO  50           HB1      PRO  50  21.301 -18.589  -7.425
  336    HG2  PRO  50           HG2      PRO  50  20.992 -16.906  -4.923
  337    HG3  PRO  50           HG1      PRO  50  21.716 -16.473  -6.526
  338    HD2  PRO  50           HD2      PRO  50  19.278 -15.526  -5.752
  339    HD3  PRO  50           HD1      PRO  50  19.627 -15.938  -7.474
  Start of MODEL   17
    1    H1   SER   1           HT1      SER   1   9.446 -30.217   5.417
    2    H2   SER   1           HT2      SER   1   9.787 -29.225   6.753
    3    H3   SER   1           HT3      SER   1  10.284 -28.755   5.197
    4    HA   SER   1           HA       SER   1   8.075 -28.435   4.487
    5    HB2  SER   1           HB2      SER   1   7.156 -30.374   5.943
    6    HB3  SER   1           HB1      SER   1   7.165 -29.202   7.321
    7    HG   SER   1           HG       SER   1   5.652 -28.031   6.356
    8    H    SER   2           HN       SER   2   9.539 -26.429   4.657
    9    HA   SER   2           HA       SER   2   8.215 -24.610   6.439
   10    HB2  SER   2           HB2      SER   2  10.286 -23.698   7.486
   11    HB3  SER   2           HB1      SER   2  10.136 -25.452   7.908
   12    HG   SER   2           HG       SER   2  11.400 -25.085   5.538
   13    H    THR   3           HN       THR   3   8.885 -22.299   5.877
   14    HA   THR   3           HA       THR   3   9.294 -22.238   3.041
   15    HB   THR   3           HB       THR   3   9.146 -19.887   4.973
   16    HG1  THR   3           HG1      THR   3   6.932 -20.120   3.660
   17   HG21  THR   3          HG21      THR   3  10.085 -19.387   2.724
   18   HG22  THR   3          HG22      THR   3   8.445 -18.662   2.903
   19   HG23  THR   3          HG23      THR   3   8.664 -20.174   1.944
   20    HA   PRO   4           HA       PRO   4  13.684 -22.072   3.232
   21    HB2  PRO   4           HB2      PRO   4  13.280 -20.329   0.802
   22    HB3  PRO   4           HB1      PRO   4  14.341 -21.775   1.016
   23    HG2  PRO   4           HG2      PRO   4  12.027 -21.980  -0.342
   24    HG3  PRO   4           HG1      PRO   4  12.552 -23.294   0.770
   25    HD2  PRO   4           HD2      PRO   4  10.428 -21.150   1.175
   26    HD3  PRO   4           HD1      PRO   4  10.442 -22.878   1.712
   27    H    ASP   5           HN       ASP   5  11.901 -19.026   2.475
   28    HA   ASP   5           HA       ASP   5  13.438 -17.732   4.496
   29    HB2  ASP   5           HB2      ASP   5  14.740 -17.562   2.196
   30    HB3  ASP   5           HB1      ASP   5  13.418 -16.435   1.753
   31    H    GLY   6           HN       GLY   6  12.549 -15.207   2.728
   32    HA2  GLY   6           HA2      GLY   6   9.724 -15.402   2.846
   33    HA3  GLY   6           HA1      GLY   6  10.466 -14.402   4.174
   34    H    THR   7           HN       THR   7  12.807 -13.609   2.521
   35    HA   THR   7           HA       THR   7  11.365 -11.608   0.922
   36    HB   THR   7           HB       THR   7  14.258 -11.710   1.916
   37    HG1  THR   7           HG1      THR   7  13.130  -9.540   2.652
   38   HG21  THR   7          HG21      THR   7  12.777  -9.850  -0.025
   39   HG22  THR   7          HG22      THR   7  14.380 -10.654  -0.226
   40   HG23  THR   7          HG23      THR   7  14.200  -9.275   0.924
   41    H    TRP   8           HN       TRP   8  13.752 -14.205   0.916
   42    HA   TRP   8           HA       TRP   8  14.659 -13.833  -1.680
   43    HB2  TRP   8           HB2      TRP   8  15.990 -15.445  -0.701
   44    HB3  TRP   8           HB1      TRP   8  14.689 -15.985   0.377
   45    HD1  TRP   8           HD1      TRP   8  16.367 -16.894  -2.947
   46    HE1  TRP   8           HE1      TRP   8  15.311 -19.046  -3.808
   47    HE3  TRP   8           HE3      TRP   8  12.480 -17.255   0.298
   48    HZ2  TRP   8           HZ2      TRP   8  13.108 -20.672  -3.177
   49    HZ3  TRP   8           HZ3      TRP   8  10.931 -19.135   0.110
   50    HH2  TRP   8           HH2      TRP   8  11.250 -20.824  -1.622
   51    H    VAL   9           HN       VAL   9  11.758 -15.441  -0.287
   52    HA   VAL   9           HA       VAL   9  11.029 -16.693  -2.728
   53    HB   VAL   9           HB       VAL   9  10.136 -17.399  -0.484
   54   HG11  VAL   9          HG11      VAL   9   8.193 -15.059  -0.652
   55   HG12  VAL   9          HG12      VAL   9   9.833 -14.765   0.032
   56   HG13  VAL   9          HG13      VAL   9   8.751 -15.992   0.786
   57   HG21  VAL   9          HG21      VAL   9   8.074 -16.502  -2.590
   58   HG22  VAL   9          HG22      VAL   9   7.848 -17.798  -1.348
   59   HG23  VAL   9          HG23      VAL   9   9.070 -18.012  -2.661
   60    H    LYS  10           HN       LYS  10  10.707 -13.427  -1.401
   61    HA   LYS  10           HA       LYS  10   8.489 -12.682  -2.963
   62    HB2  LYS  10           HB2      LYS  10  10.858 -11.021  -1.914
   63    HB3  LYS  10           HB1      LYS  10   9.471 -10.300  -2.802
   64    HG2  LYS  10           HG2      LYS  10   7.896 -11.024  -1.070
   65    HG3  LYS  10           HG1      LYS  10   9.185 -11.940  -0.219
   66    HD2  LYS  10           HD2      LYS  10   8.847  -9.855   0.975
   67    HD3  LYS  10           HD1      LYS  10  10.432  -9.753   0.132
   68    HE2  LYS  10           HE2      LYS  10   9.418  -8.358  -1.669
   69    HE3  LYS  10           HE1      LYS  10   7.784  -8.518  -0.897
   70    HZ1  LYS  10           HZ1      LYS  10   8.318  -6.746   0.247
   71    HZ2  LYS  10           HZ2      LYS  10   9.931  -6.761  -0.285
   72    HZ3  LYS  10           HZ3      LYS  10   9.480  -7.654   1.088
   73    H    CYS  11           HN       CYS  11  11.877 -13.333  -3.665
   74    HA   CYS  11           HA       CYS  11  11.887 -11.865  -6.102
   75    HB2  CYS  11           HB2      CYS  11  14.111 -12.253  -5.420
   76    HB3  CYS  11           HB1      CYS  11  13.713 -13.856  -4.759
   77    H    ARG  12           HN       ARG  12  11.335 -15.243  -5.018
   78    HA   ARG  12           HA       ARG  12  11.102 -16.375  -7.510
   79    HB2  ARG  12           HB2      ARG  12   9.483 -16.967  -4.982
   80    HB3  ARG  12           HB1      ARG  12   9.583 -18.022  -6.403
   81    HG2  ARG  12           HG2      ARG  12  12.119 -17.178  -5.015
   82    HG3  ARG  12           HG1      ARG  12  11.092 -18.465  -4.300
   83    HD2  ARG  12           HD2      ARG  12  11.221 -19.737  -6.494
   84    HD3  ARG  12           HD1      ARG  12  12.374 -18.470  -7.099
   85    HE   ARG  12           HE       ARG  12  13.513 -19.211  -4.711
   86   HH11  ARG  12          HH11      ARG  12  12.188 -21.013  -7.483
   87   HH12  ARG  12          HH12      ARG  12  13.286 -22.345  -7.343
   88   HH21  ARG  12          HH21      ARG  12  15.012 -21.035  -4.520
   89   HH22  ARG  12          HH22      ARG  12  14.916 -22.358  -5.633
   90    H    HIS  13           HN       HIS  13   8.754 -14.687  -5.404
   91    HA   HIS  13           HA       HIS  13   6.608 -15.074  -7.243
   92    HB2  HIS  13           HB2      HIS  13   6.015 -14.586  -4.926
   93    HB3  HIS  13           HB1      HIS  13   7.032 -13.102  -4.930
   94    HD2  HIS  13           HD2      HIS  13   5.682 -10.804  -5.606
   95    HE1  HIS  13           HE1      HIS  13   2.196 -12.685  -7.089
   96    HE2  HIS  13           HE2      HIS  13   3.302 -10.472  -6.498
   97    H    ASP  14           HN       ASP  14   9.057 -12.490  -6.670
   98    HA   ASP  14           HA       ASP  14   7.879 -10.568  -8.318
   99    HB2  ASP  14           HB2      ASP  14   9.974 -10.263  -6.809
  100    HB3  ASP  14           HB1      ASP  14  10.903 -11.031  -8.135
  101    H    CYS  15           HN       CYS  15  10.373 -13.117  -9.127
  102    HA   CYS  15           HA       CYS  15  10.292 -12.370 -11.882
  103    HB2  CYS  15           HB2      CYS  15  11.244 -14.976 -10.540
  104    HB3  CYS  15           HB1      CYS  15  11.442 -14.611 -12.282
  105    H    PHE  16           HN       PHE  16   8.400 -14.436  -9.753
  106    HA   PHE  16           HA       PHE  16   7.360 -16.098 -11.748
  107    HB2  PHE  16           HB2      PHE  16   6.991 -16.508  -9.313
  108    HB3  PHE  16           HB1      PHE  16   5.948 -15.049  -9.251
  109    HD1  PHE  16           HD1      PHE  16   6.294 -18.096 -11.396
  110    HD2  PHE  16           HD2      PHE  16   3.758 -15.473  -9.213
  111    HE1  PHE  16           HE1      PHE  16   4.354 -19.471 -11.980
  112    HE2  PHE  16           HE2      PHE  16   1.824 -16.859  -9.806
  113    HZ   PHE  16           HZ       PHE  16   2.121 -18.855 -11.187
  114    H    THR  17           HN       THR  17   6.237 -12.932 -10.386
  115    HA   THR  17           HA       THR  17   3.965 -12.840 -12.057
  116    HB   THR  17           HB       THR  17   3.991 -10.382 -11.659
  117    HG1  THR  17           HG1      THR  17   6.549 -11.047 -10.699
  118   HG21  THR  17          HG21      THR  17   4.754 -11.341  -8.957
  119   HG22  THR  17          HG22      THR  17   3.634 -12.463  -9.819
  120   HG23  THR  17          HG23      THR  17   3.167 -10.739  -9.562
  121    H    LYS  18           HN       LYS  18   7.402 -11.836 -12.482
  122    HA   LYS  18           HA       LYS  18   6.955 -10.528 -14.926
  123    HB2  LYS  18           HB2      LYS  18   9.395 -11.848 -13.674
  124    HB3  LYS  18           HB1      LYS  18   9.452 -11.297 -15.383
  125    HG2  LYS  18           HG2      LYS  18  10.259  -9.699 -13.426
  126    HG3  LYS  18           HG1      LYS  18   9.350  -9.043 -14.828
  127    HD2  LYS  18           HD2      LYS  18   7.358  -8.783 -13.585
  128    HD3  LYS  18           HD1      LYS  18   7.856  -9.976 -12.343
  129    HE2  LYS  18           HE2      LYS  18   7.948  -7.656 -11.445
  130    HE3  LYS  18           HE1      LYS  18   9.608  -8.372 -11.517
  131    HZ1  LYS  18           HZ1      LYS  18  10.132  -6.577 -12.639
  132    HZ2  LYS  18           HZ2      LYS  18   8.517  -6.105 -12.869
  133    HZ3  LYS  18           HZ3      LYS  18   9.246  -7.192 -13.949
  134    H    TYR  19           HN       TYR  19   7.288 -13.907 -13.928
  135    HA   TYR  19           HA       TYR  19   7.738 -14.835 -16.583
  136    HB2  TYR  19           HB2      TYR  19   8.431 -16.419 -15.003
  137    HB3  TYR  19           HB1      TYR  19   7.043 -16.105 -13.924
  138    HD1  TYR  19           HD1      TYR  19   7.952 -17.558 -17.223
  139    HD2  TYR  19           HD2      TYR  19   5.242 -17.466 -13.962
  140    HE1  TYR  19           HE1      TYR  19   6.797 -19.508 -18.144
  141    HE2  TYR  19           HE2      TYR  19   4.086 -19.415 -14.879
  142    HH   TYR  19           HH       TYR  19   5.074 -21.492 -16.676
  143    H    LYS  20           HN       LYS  20   4.918 -14.689 -14.321
  144    HA   LYS  20           HA       LYS  20   3.110 -15.826 -16.094
  145    HB2  LYS  20           HB2      LYS  20   2.590 -13.556 -14.102
  146    HB3  LYS  20           HB1      LYS  20   1.349 -14.621 -14.835
  147    HG2  LYS  20           HG2      LYS  20   3.643 -15.603 -13.088
  148    HG3  LYS  20           HG1      LYS  20   2.002 -15.246 -12.496
  149    HD2  LYS  20           HD2      LYS  20   2.197 -17.106 -14.860
  150    HD3  LYS  20           HD1      LYS  20   2.825 -17.731 -13.297
  151    HE2  LYS  20           HE2      LYS  20   0.603 -17.168 -12.218
  152    HE3  LYS  20           HE1      LYS  20  -0.017 -16.641 -13.836
  153    HZ1  LYS  20           HZ1      LYS  20   1.219 -19.230 -13.874
  154    HZ2  LYS  20           HZ2      LYS  20  -0.299 -18.724 -14.441
  155    HZ3  LYS  20           HZ3      LYS  20  -0.099 -19.146 -12.808
  156    H    SER  21           HN       SER  21   4.416 -12.530 -15.721
  157    HA   SER  21           HA       SER  21   2.605 -11.335 -17.536
  158    HB2  SER  21           HB2      SER  21   4.150  -9.954 -16.061
  159    HB3  SER  21           HB1      SER  21   5.551 -10.566 -17.026
  160    HG   SER  21           HG       SER  21   4.053  -9.725 -18.846
  161    H    CYS  22           HN       CYS  22   5.670 -13.175 -17.887
  162    HA   CYS  22           HA       CYS  22   5.980 -12.604 -20.641
  163    HB2  CYS  22           HB2      CYS  22   7.739 -13.653 -19.011
  164    HB3  CYS  22           HB1      CYS  22   6.843 -15.185 -19.260
  165    H    GLN  23           HN       GLN  23   4.198 -15.058 -18.744
  166    HA   GLN  23           HA       GLN  23   3.546 -16.628 -21.012
  167    HB2  GLN  23           HB2      GLN  23   2.204 -16.363 -18.257
  168    HB3  GLN  23           HB1      GLN  23   1.645 -17.516 -19.518
  169    HG2  GLN  23           HG2      GLN  23   4.514 -17.500 -18.369
  170    HG3  GLN  23           HG1      GLN  23   3.173 -18.556 -17.764
  171   HE21  GLN  23          HE21      GLN  23   1.997 -19.891 -19.475
  172   HE22  GLN  23          HE22      GLN  23   2.945 -20.569 -20.753
  173    H    MET  24           HN       MET  24   2.462 -13.542 -19.739
  174    HA   MET  24           HA       MET  24  -0.075 -13.787 -21.107
  175    HB2  MET  24           HB2      MET  24   1.236 -11.596 -19.476
  176    HB3  MET  24           HB1      MET  24  -0.272 -11.336 -20.406
  177    HG2  MET  24           HG2      MET  24  -1.115 -13.487 -19.145
  178    HG3  MET  24           HG1      MET  24   0.211 -13.115 -18.007
  179    HE1  MET  24           HE1      MET  24  -0.446  -9.355 -17.252
  180    HE2  MET  24           HE2      MET  24  -0.314  -9.623 -19.024
  181    HE3  MET  24           HE3      MET  24   0.746 -10.540 -17.896
  182    H    SER  25           HN       SER  25   3.099 -13.257 -21.934
  183    HA   SER  25           HA       SER  25   2.688 -11.013 -23.649
  184    HB2  SER  25           HB2      SER  25   4.912 -11.433 -24.575
  185    HB3  SER  25           HB1      SER  25   5.026 -11.781 -22.801
  186    HG   SER  25           HG       SER  25   4.911 -13.923 -23.210
  187    H    ASP  26           HN       ASP  26   3.066 -11.255 -26.108
  188    HA   ASP  26           HA       ASP  26   1.196 -13.275 -26.970
  189    HB2  ASP  26           HB2      ASP  26   2.682 -11.033 -28.435
  190    HB3  ASP  26           HB1      ASP  26   1.614 -12.217 -29.272
  191    H    SER  27           HN       SER  27   4.391 -13.278 -26.148
  192    HA   SER  27           HA       SER  27   5.305 -14.681 -28.514
  193    HB2  SER  27           HB2      SER  27   6.703 -14.173 -25.813
  194    HB3  SER  27           HB1      SER  27   7.474 -14.962 -27.247
  195    HG   SER  27           HG       SER  27   8.012 -12.934 -27.500
  196    H    CYS  28           HN       CYS  28   3.456 -15.284 -25.752
  197    HA   CYS  28           HA       CYS  28   4.514 -17.950 -25.365
  198    HB2  CYS  28           HB2      CYS  28   3.525 -16.464 -23.457
  199    HB3  CYS  28           HB1      CYS  28   1.931 -16.763 -24.223
  200    H    HIS  29           HN       HIS  29   4.093 -18.179 -27.864
  201    HA   HIS  29           HA       HIS  29   1.296 -19.021 -28.175
  202    HB2  HIS  29           HB2      HIS  29   1.681 -18.824 -30.659
  203    HB3  HIS  29           HB1      HIS  29   1.857 -17.243 -29.824
  204    HD2  HIS  29           HD2      HIS  29   4.547 -16.246 -29.700
  205    HE1  HIS  29           HE1      HIS  29   6.037 -19.087 -32.445
  206    HE2  HIS  29           HE2      HIS  29   6.513 -16.929 -31.189
  207    H    ASP  30           HN       ASP  30   4.748 -19.788 -28.393
  208    HA   ASP  30           HA       ASP  30   4.004 -22.459 -29.287
  209    HB2  ASP  30           HB2      ASP  30   6.648 -20.916 -29.315
  210    HB3  ASP  30           HB1      ASP  30   6.635 -22.714 -29.388
  211    H    GLU  31           HN       GLU  31   4.772 -24.283 -28.047
  212    HA   GLU  31           HA       GLU  31   4.604 -23.807 -25.289
  213    HB2  GLU  31           HB2      GLU  31   5.641 -26.245 -26.846
  214    HB3  GLU  31           HB1      GLU  31   5.459 -26.213 -25.053
  215    HG2  GLU  31           HG2      GLU  31   3.000 -25.851 -25.257
  216    HG3  GLU  31           HG1      GLU  31   3.148 -25.777 -27.060
  217    H    GLN  32           HN       GLN  32   7.336 -24.264 -27.594
  218    HA   GLN  32           HA       GLN  32   9.296 -24.410 -25.569
  219    HB2  GLN  32           HB2      GLN  32   9.674 -25.084 -27.981
  220    HB3  GLN  32           HB1      GLN  32   9.593 -23.350 -28.418
  221    HG2  GLN  32           HG2      GLN  32  11.580 -22.846 -27.021
  222    HG3  GLN  32           HG1      GLN  32  11.648 -24.572 -26.479
  223   HE21  GLN  32          HE21      GLN  32  13.914 -23.782 -27.650
  224   HE22  GLN  32          HE22      GLN  32  14.058 -24.350 -29.277
  225    H    SER  33           HN       SER  33   7.901 -21.716 -27.547
  226    HA   SER  33           HA       SER  33   9.633 -19.760 -26.515
  227    HB2  SER  33           HB2      SER  33   6.730 -19.461 -27.506
  228    HB3  SER  33           HB1      SER  33   7.843 -18.075 -27.161
  229    HG   SER  33           HG       SER  33   8.615 -18.364 -29.036
  230    H    CYS  34           HN       CYS  34   6.429 -21.044 -25.431
  231    HA   CYS  34           HA       CYS  34   6.231 -19.198 -23.292
  232    HB2  CYS  34           HB2      CYS  34   5.045 -22.021 -23.616
  233    HB3  CYS  34           HB1      CYS  34   4.622 -20.893 -22.281
  234    H    HIS  35           HN       HIS  35   7.780 -22.414 -23.762
  235    HA   HIS  35           HA       HIS  35   8.301 -22.866 -21.027
  236    HB2  HIS  35           HB2      HIS  35   8.619 -24.691 -22.682
  237    HB3  HIS  35           HB1      HIS  35   9.897 -23.726 -23.503
  238    HD2  HIS  35           HD2      HIS  35  12.400 -24.430 -22.709
  239    HE1  HIS  35           HE1      HIS  35  11.351 -26.051 -18.947
  240    HE2  HIS  35           HE2      HIS  35  13.234 -25.627 -20.601
  241    H    GLN  36           HN       GLN  36   9.938 -20.967 -23.593
  242    HA   GLN  36           HA       GLN  36  12.332 -20.556 -22.214
  243    HB2  GLN  36           HB2      GLN  36  10.809 -18.739 -24.133
  244    HB3  GLN  36           HB1      GLN  36  12.434 -18.347 -23.498
  245    HG2  GLN  36           HG2      GLN  36  11.933 -21.023 -24.889
  246    HG3  GLN  36           HG1      GLN  36  12.238 -19.517 -25.845
  247   HE21  GLN  36          HE21      GLN  36  13.624 -21.934 -23.688
  248   HE22  GLN  36          HE22      GLN  36  15.247 -21.356 -23.735
  249    H    CYS  37           HN       CYS  37   9.113 -19.033 -21.984
  250    HA   CYS  37           HA       CYS  37   9.938 -16.859 -20.405
  251    HB2  CYS  37           HB2      CYS  37   7.298 -18.397 -20.466
  252    HB3  CYS  37           HB1      CYS  37   7.557 -16.933 -19.485
  253    H    HIS  38           HN       HIS  38   9.036 -20.216 -19.695
  254    HA   HIS  38           HA       HIS  38   9.095 -19.827 -16.888
  255    HB2  HIS  38           HB2      HIS  38   7.877 -21.752 -18.001
  256    HB3  HIS  38           HB1      HIS  38   9.489 -22.427 -18.446
  257    HD2  HIS  38           HD2      HIS  38  11.065 -23.295 -16.196
  258    HE1  HIS  38           HE1      HIS  38   7.704 -23.388 -13.623
  259    HE2  HIS  38           HE2      HIS  38  10.133 -24.089 -13.936
  260    H    VAL  39           HN       VAL  39  11.364 -20.860 -19.418
  261    HA   VAL  39           HA       VAL  39  13.380 -21.642 -17.612
  262    HB   VAL  39           HB       VAL  39  13.498 -20.591 -20.467
  263   HG11  VAL  39          HG11      VAL  39  15.638 -20.070 -19.531
  264   HG12  VAL  39          HG12      VAL  39  15.868 -21.685 -20.304
  265   HG13  VAL  39          HG13      VAL  39  15.658 -21.561 -18.517
  266   HG21  VAL  39          HG21      VAL  39  14.266 -23.279 -20.371
  267   HG22  VAL  39          HG22      VAL  39  12.624 -22.672 -20.807
  268   HG23  VAL  39          HG23      VAL  39  12.976 -23.196 -19.110
  269    H    LYS  40           HN       LYS  40  12.371 -18.523 -19.095
  270    HA   LYS  40           HA       LYS  40  14.678 -17.121 -18.246
  271    HB2  LYS  40           HB2      LYS  40  11.801 -16.202 -18.801
  272    HB3  LYS  40           HB1      LYS  40  13.099 -15.062 -18.296
  273    HG2  LYS  40           HG2      LYS  40  14.122 -15.087 -20.342
  274    HG3  LYS  40           HG1      LYS  40  13.838 -16.845 -20.587
  275    HD2  LYS  40           HD2      LYS  40  11.937 -16.489 -21.782
  276    HD3  LYS  40           HD1      LYS  40  11.327 -15.257 -20.629
  277    HE2  LYS  40           HE2      LYS  40  12.813 -13.531 -21.685
  278    HE3  LYS  40           HE1      LYS  40  13.423 -14.778 -22.850
  279    HZ1  LYS  40           HZ1      LYS  40  11.350 -13.172 -23.288
  280    HZ2  LYS  40           HZ2      LYS  40  10.536 -14.523 -22.658
  281    HZ3  LYS  40           HZ3      LYS  40  11.548 -14.695 -24.012
  282    H    HIS  41           HN       HIS  41  11.551 -18.016 -16.792
  283    HA   HIS  41           HA       HIS  41  11.858 -16.443 -14.494
  284    HB2  HIS  41           HB2      HIS  41   9.698 -17.508 -15.009
  285    HB3  HIS  41           HB1      HIS  41  10.448 -19.125 -14.901
  286    HD2  HIS  41           HD2      HIS  41   9.355 -16.169 -12.458
  287    HE1  HIS  41           HE1      HIS  41  10.004 -19.699 -10.254
  288    HE2  HIS  41           HE2      HIS  41   9.187 -17.297 -10.172
  289    H    THR  42           HN       THR  42  12.871 -19.759 -15.424
  290    HA   THR  42           HA       THR  42  13.806 -20.480 -12.909
  291    HB   THR  42           HB       THR  42  14.776 -21.285 -15.700
  292    HG1  THR  42           HG1      THR  42  12.597 -21.783 -14.942
  293   HG21  THR  42          HG21      THR  42  15.641 -22.033 -12.897
  294   HG22  THR  42          HG22      THR  42  16.600 -21.920 -14.418
  295   HG23  THR  42          HG23      THR  42  15.534 -23.342 -14.127
  296    H    ASP  43           HN       ASP  43  15.439 -18.826 -15.714
  297    HA   ASP  43           HA       ASP  43  17.923 -18.667 -14.320
  298    HB2  ASP  43           HB2      ASP  43  16.809 -17.079 -16.702
  299    HB3  ASP  43           HB1      ASP  43  18.472 -16.836 -16.048
  300    H    CYS  44           HN       CYS  44  14.995 -16.650 -14.541
  301    HA   CYS  44           HA       CYS  44  16.166 -14.326 -13.426
  302    HB2  CYS  44           HB2      CYS  44  13.865 -14.438 -14.628
  303    HB3  CYS  44           HB1      CYS  44  13.243 -15.214 -13.136
  304    H    VAL  45           HN       VAL  45  14.628 -17.258 -12.196
  305    HA   VAL  45           HA       VAL  45  14.621 -16.280  -9.535
  306    HB   VAL  45           HB       VAL  45  14.033 -18.864 -10.924
  307   HG11  VAL  45          HG11      VAL  45  15.613 -19.626  -9.203
  308   HG12  VAL  45          HG12      VAL  45  13.940 -19.993  -8.625
  309   HG13  VAL  45          HG13      VAL  45  14.829 -18.579  -7.953
  310   HG21  VAL  45          HG21      VAL  45  12.669 -17.033  -8.860
  311   HG22  VAL  45          HG22      VAL  45  12.002 -18.637  -9.347
  312   HG23  VAL  45          HG23      VAL  45  12.193 -17.326 -10.576
  313    H    ASN  46           HN       ASN  46  16.704 -18.293 -11.583
  314    HA   ASN  46           HA       ASN  46  18.344 -19.176  -9.498
  315    HB2  ASN  46           HB2      ASN  46  18.719 -18.770 -12.470
  316    HB3  ASN  46           HB1      ASN  46  20.112 -19.220 -11.433
  317   HD21  ASN  46          HD21      ASN  46  18.533 -20.667 -13.619
  318   HD22  ASN  46          HD22      ASN  46  18.118 -22.186 -12.916
  319    H    THR  47           HN       THR  47  18.217 -16.116 -11.313
  320    HA   THR  47           HA       THR  47  20.773 -15.377 -10.126
  321    HB   THR  47           HB       THR  47  18.934 -13.782 -11.967
  322    HG1  THR  47           HG1      THR  47  19.827 -15.528 -13.012
  323   HG21  THR  47          HG21      THR  47  20.254 -12.225 -10.694
  324   HG22  THR  47          HG22      THR  47  21.159 -12.446 -12.239
  325   HG23  THR  47          HG23      THR  47  21.708 -13.289 -10.742
  326    H    GLY  48           HN       GLY  48  17.291 -14.401 -10.133
  327    HA2  GLY  48           HA2      GLY  48  17.783 -12.288  -8.293
  328    HA3  GLY  48           HA1      GLY  48  16.190 -13.026  -8.751
  329    H    CYS  49           HN       CYS  49  16.777 -15.770  -7.965
  330    HA   CYS  49           HA       CYS  49  17.468 -15.526  -5.155
  331    HB2  CYS  49           HB2      CYS  49  15.250 -17.014  -4.777
  332    HB3  CYS  49           HB1      CYS  49  15.228 -15.236  -4.616
  333    HA   PRO  50           HA       PRO  50  19.198 -19.076  -7.668
  334    HB2  PRO  50           HB2      PRO  50  20.843 -19.129  -5.178
  335    HB3  PRO  50           HB1      PRO  50  21.375 -19.052  -6.911
  336    HG2  PRO  50           HG2      PRO  50  21.119 -16.837  -4.988
  337    HG3  PRO  50           HG1      PRO  50  21.680 -16.766  -6.708
  338    HD2  PRO  50           HD2      PRO  50  19.270 -15.650  -5.747
  339    HD3  PRO  50           HD1      PRO  50  19.599 -16.058  -7.472
  Start of MODEL   18
    1    H1   SER   1           HT1      SER   1  11.660 -29.078   5.733
    2    H2   SER   1           HT2      SER   1  10.563 -30.360   5.547
    3    H3   SER   1           HT3      SER   1  11.551 -30.282   6.927
    4    HA   SER   1           HA       SER   1   9.233 -28.636   6.212
    5    HB2  SER   1           HB2      SER   1   9.055 -30.775   7.669
    6    HB3  SER   1           HB1      SER   1  10.029 -29.882   8.905
    7    HG   SER   1           HG       SER   1   8.421 -28.522   9.218
    8    H    SER   2           HN       SER   2  10.763 -26.747   5.733
    9    HA   SER   2           HA       SER   2  11.056 -25.283   8.193
   10    HB2  SER   2           HB2      SER   2  13.335 -26.405   7.995
   11    HB3  SER   2           HB1      SER   2  13.485 -25.697   6.337
   12    HG   SER   2           HG       SER   2  13.636 -23.731   7.171
   13    H    THR   3           HN       THR   3  10.990 -22.991   7.787
   14    HA   THR   3           HA       THR   3   9.926 -22.422   5.194
   15    HB   THR   3           HB       THR   3  10.681 -20.498   7.444
   16    HG1  THR   3           HG1      THR   3   8.118 -20.704   7.232
   17   HG21  THR   3          HG21      THR   3   9.158 -18.935   6.253
   18   HG22  THR   3          HG22      THR   3   8.835 -20.184   4.995
   19   HG23  THR   3          HG23      THR   3  10.484 -19.474   5.159
   20    HA   PRO   4           HA       PRO   4  13.861 -21.628   3.400
   21    HB2  PRO   4           HB2      PRO   4  12.928 -20.135   1.229
   22    HB3  PRO   4           HB1      PRO   4  12.936 -21.948   1.300
   23    HG2  PRO   4           HG2      PRO   4  10.660 -19.994   1.844
   24    HG3  PRO   4           HG1      PRO   4  10.629 -21.596   0.998
   25    HD2  PRO   4           HD2      PRO   4   9.767 -21.285   3.587
   26    HD3  PRO   4           HD1      PRO   4  10.567 -22.803   3.009
   27    H    ASP   5           HN       ASP   5  11.668 -18.777   2.980
   28    HA   ASP   5           HA       ASP   5  13.316 -17.236   4.673
   29    HB2  ASP   5           HB2      ASP   5  14.516 -17.324   2.321
   30    HB3  ASP   5           HB1      ASP   5  13.157 -16.281   1.799
   31    H    GLY   6           HN       GLY   6  12.298 -14.958   2.634
   32    HA2  GLY   6           HA2      GLY   6   9.502 -15.146   2.820
   33    HA3  GLY   6           HA1      GLY   6  10.221 -14.078   4.108
   34    H    THR   7           HN       THR   7  12.570 -13.351   2.415
   35    HA   THR   7           HA       THR   7  11.120 -11.420   0.740
   36    HB   THR   7           HB       THR   7  14.018 -11.490   1.725
   37    HG1  THR   7           HG1      THR   7  12.782  -9.263   2.285
   38   HG21  THR   7          HG21      THR   7  12.546  -9.701  -0.292
   39   HG22  THR   7          HG22      THR   7  14.126 -10.553  -0.480
   40   HG23  THR   7          HG23      THR   7  13.997  -9.121   0.610
   41    H    TRP   8           HN       TRP   8  13.469 -14.046   0.829
   42    HA   TRP   8           HA       TRP   8  14.388 -13.797  -1.773
   43    HB2  TRP   8           HB2      TRP   8  15.668 -15.415  -0.738
   44    HB3  TRP   8           HB1      TRP   8  14.351 -15.873   0.358
   45    HD1  TRP   8           HD1      TRP   8  15.988 -16.949  -2.940
   46    HE1  TRP   8           HE1      TRP   8  14.872 -19.103  -3.714
   47    HE3  TRP   8           HE3      TRP   8  12.121 -17.091   0.344
   48    HZ2  TRP   8           HZ2      TRP   8  12.636 -20.649  -3.007
   49    HZ3  TRP   8           HZ3      TRP   8  10.526 -18.938   0.235
   50    HH2  TRP   8           HH2      TRP   8  10.784 -20.701  -1.434
   51    H    VAL   9           HN       VAL   9  11.443 -15.280  -0.336
   52    HA   VAL   9           HA       VAL   9  10.682 -16.578  -2.742
   53    HB   VAL   9           HB       VAL   9   9.775 -17.197  -0.476
   54   HG11  VAL   9          HG11      VAL   9   8.425 -15.722   0.748
   55   HG12  VAL   9          HG12      VAL   9   7.883 -14.824  -0.719
   56   HG13  VAL   9          HG13      VAL   9   9.529 -14.542  -0.046
   57   HG21  VAL   9          HG21      VAL   9   7.472 -17.551  -1.335
   58   HG22  VAL   9          HG22      VAL   9   8.698 -17.868  -2.622
   59   HG23  VAL   9          HG23      VAL   9   7.751 -16.319  -2.627
   60    H    LYS  10           HN       LYS  10  10.445 -13.271  -1.490
   61    HA   LYS  10           HA       LYS  10   8.255 -12.505  -3.081
   62    HB2  LYS  10           HB2      LYS  10  10.664 -10.871  -2.076
   63    HB3  LYS  10           HB1      LYS  10   9.280 -10.145  -2.962
   64    HG2  LYS  10           HG2      LYS  10   7.716 -10.936  -1.178
   65    HG3  LYS  10           HG1      LYS  10   9.101 -11.650  -0.286
   66    HD2  LYS  10           HD2      LYS  10  10.125  -9.408  -0.011
   67    HD3  LYS  10           HD1      LYS  10   8.822  -8.662  -0.999
   68    HE2  LYS  10           HE2      LYS  10   8.355  -8.285   1.404
   69    HE3  LYS  10           HE1      LYS  10   7.126  -9.444   0.748
   70    HZ1  LYS  10           HZ1      LYS  10   9.403  -9.928   2.548
   71    HZ2  LYS  10           HZ2      LYS  10   8.846 -11.188   1.550
   72    HZ3  LYS  10           HZ3      LYS  10   7.789 -10.444   2.654
   73    H    CYS  11           HN       CYS  11  11.626 -13.264  -3.743
   74    HA   CYS  11           HA       CYS  11  11.697 -11.856  -6.213
   75    HB2  CYS  11           HB2      CYS  11  13.903 -12.291  -5.497
   76    HB3  CYS  11           HB1      CYS  11  13.453 -13.871  -4.816
   77    H    ARG  12           HN       ARG  12  11.026 -15.185  -5.052
   78    HA   ARG  12           HA       ARG  12  10.790 -16.377  -7.514
   79    HB2  ARG  12           HB2      ARG  12   9.114 -16.844  -4.998
   80    HB3  ARG  12           HB1      ARG  12   9.206 -17.944  -6.387
   81    HG2  ARG  12           HG2      ARG  12  11.745 -17.140  -4.978
   82    HG3  ARG  12           HG1      ARG  12  10.665 -18.372  -4.245
   83    HD2  ARG  12           HD2      ARG  12  10.790 -19.713  -6.399
   84    HD3  ARG  12           HD1      ARG  12  11.992 -18.500  -7.021
   85    HE   ARG  12           HE       ARG  12  13.066 -19.207  -4.590
   86   HH11  ARG  12          HH11      ARG  12  11.744 -21.038  -7.345
   87   HH12  ARG  12          HH12      ARG  12  12.798 -22.397  -7.148
   88   HH21  ARG  12          HH21      ARG  12  14.506 -21.069  -4.323
   89   HH22  ARG  12          HH22      ARG  12  14.392 -22.416  -5.404
   90    H    HIS  13           HN       HIS  13   8.471 -14.556  -5.490
   91    HA   HIS  13           HA       HIS  13   6.345 -14.918  -7.359
   92    HB2  HIS  13           HB2      HIS  13   5.712 -14.369  -5.071
   93    HB3  HIS  13           HB1      HIS  13   6.790 -12.929  -5.067
   94    HD2  HIS  13           HD2      HIS  13   5.554 -10.584  -5.800
   95    HE1  HIS  13           HE1      HIS  13   2.028 -12.337  -7.345
   96    HE2  HIS  13           HE2      HIS  13   3.211 -10.164  -6.753
   97    H    ASP  14           HN       ASP  14   8.872 -12.413  -6.796
   98    HA   ASP  14           HA       ASP  14   7.787 -10.480  -8.494
   99    HB2  ASP  14           HB2      ASP  14   9.875 -10.236  -6.958
  100    HB3  ASP  14           HB1      ASP  14  10.789 -11.044  -8.270
  101    H    CYS  15           HN       CYS  15  10.204 -13.130  -9.229
  102    HA   CYS  15           HA       CYS  15  10.187 -12.426 -11.997
  103    HB2  CYS  15           HB2      CYS  15  11.030 -15.038 -10.594
  104    HB3  CYS  15           HB1      CYS  15  11.250 -14.723 -12.344
  105    H    PHE  16           HN       PHE  16   8.198 -14.392  -9.862
  106    HA   PHE  16           HA       PHE  16   7.124 -16.044 -11.844
  107    HB2  PHE  16           HB2      PHE  16   6.709 -16.400  -9.410
  108    HB3  PHE  16           HB1      PHE  16   5.724 -14.902  -9.382
  109    HD1  PHE  16           HD1      PHE  16   5.973 -17.985 -11.487
  110    HD2  PHE  16           HD2      PHE  16   3.520 -15.246  -9.353
  111    HE1  PHE  16           HE1      PHE  16   3.987 -19.294 -12.070
  112    HE2  PHE  16           HE2      PHE  16   1.541 -16.566  -9.944
  113    HZ   PHE  16           HZ       PHE  16   1.774 -18.588 -11.301
  114    H    THR  17           HN       THR  17   6.097 -12.817 -10.546
  115    HA   THR  17           HA       THR  17   3.854 -12.671 -12.252
  116    HB   THR  17           HB       THR  17   3.963 -10.208 -11.891
  117    HG1  THR  17           HG1      THR  17   6.483 -10.955 -10.894
  118   HG21  THR  17          HG21      THR  17   3.075 -10.520  -9.816
  119   HG22  THR  17          HG22      THR  17   4.636 -11.137  -9.158
  120   HG23  THR  17          HG23      THR  17   3.515 -12.256 -10.022
  121    H    LYS  18           HN       LYS  18   7.329 -11.800 -12.643
  122    HA   LYS  18           HA       LYS  18   6.964 -10.504 -15.107
  123    HB2  LYS  18           HB2      LYS  18   9.337 -11.900 -13.809
  124    HB3  LYS  18           HB1      LYS  18   9.436 -11.367 -15.523
  125    HG2  LYS  18           HG2      LYS  18  10.269  -9.785 -13.556
  126    HG3  LYS  18           HG1      LYS  18   9.424  -9.108 -14.987
  127    HD2  LYS  18           HD2      LYS  18   7.405  -8.771 -13.799
  128    HD3  LYS  18           HD1      LYS  18   7.843  -9.948 -12.518
  129    HE2  LYS  18           HE2      LYS  18   7.991  -7.621 -11.663
  130    HE3  LYS  18           HE1      LYS  18   9.637  -8.373 -11.708
  131    HZ1  LYS  18           HZ1      LYS  18  10.247  -6.680 -12.926
  132    HZ2  LYS  18           HZ2      LYS  18   8.663  -6.075 -13.033
  133    HZ3  LYS  18           HZ3      LYS  18   9.223  -7.198 -14.176
  134    H    TYR  19           HN       TYR  19   7.151 -13.881 -14.068
  135    HA   TYR  19           HA       TYR  19   7.598 -14.854 -16.709
  136    HB2  TYR  19           HB2      TYR  19   8.222 -16.444 -15.102
  137    HB3  TYR  19           HB1      TYR  19   6.832 -16.071 -14.043
  138    HD1  TYR  19           HD1      TYR  19   7.742 -17.601 -17.307
  139    HD2  TYR  19           HD2      TYR  19   4.976 -17.357 -14.101
  140    HE1  TYR  19           HE1      TYR  19   6.531 -19.521 -18.222
  141    HE2  TYR  19           HE2      TYR  19   3.765 -19.273 -15.011
  142    HH   TYR  19           HH       TYR  19   4.757 -21.418 -16.817
  143    H    LYS  20           HN       LYS  20   4.764 -14.567 -14.477
  144    HA   LYS  20           HA       LYS  20   2.928 -15.661 -16.252
  145    HB2  LYS  20           HB2      LYS  20   2.475 -13.345 -14.298
  146    HB3  LYS  20           HB1      LYS  20   1.204 -14.378 -15.022
  147    HG2  LYS  20           HG2      LYS  20   3.449 -15.401 -13.236
  148    HG3  LYS  20           HG1      LYS  20   1.810 -14.992 -12.673
  149    HD2  LYS  20           HD2      LYS  20   1.972 -16.885 -15.006
  150    HD3  LYS  20           HD1      LYS  20   2.588 -17.509 -13.439
  151    HE2  LYS  20           HE2      LYS  20   0.390 -16.929 -12.357
  152    HE3  LYS  20           HE1      LYS  20  -0.225 -16.333 -13.953
  153    HZ1  LYS  20           HZ1      LYS  20  -0.459 -18.397 -14.702
  154    HZ2  LYS  20           HZ2      LYS  20  -0.511 -18.811 -13.056
  155    HZ3  LYS  20           HZ3      LYS  20   0.929 -18.998 -13.934
  156    H    SER  21           HN       SER  21   4.369 -12.419 -15.921
  157    HA   SER  21           HA       SER  21   2.613 -11.178 -17.763
  158    HB2  SER  21           HB2      SER  21   5.561 -10.539 -17.119
  159    HB3  SER  21           HB1      SER  21   4.478  -9.478 -18.108
  160    HG   SER  21           HG       SER  21   4.171 -10.268 -15.392
  161    H    CYS  22           HN       CYS  22   5.552 -13.198 -18.061
  162    HA   CYS  22           HA       CYS  22   5.922 -12.649 -20.820
  163    HB2  CYS  22           HB2      CYS  22   7.624 -13.746 -19.147
  164    HB3  CYS  22           HB1      CYS  22   6.685 -15.248 -19.424
  165    H    GLN  23           HN       GLN  23   4.049 -15.013 -18.899
  166    HA   GLN  23           HA       GLN  23   3.361 -16.609 -21.131
  167    HB2  GLN  23           HB2      GLN  23   1.957 -16.192 -18.426
  168    HB3  GLN  23           HB1      GLN  23   1.402 -17.379 -19.658
  169    HG2  GLN  23           HG2      GLN  23   4.213 -17.394 -18.370
  170    HG3  GLN  23           HG1      GLN  23   2.820 -18.426 -17.846
  171   HE21  GLN  23          HE21      GLN  23   1.719 -19.719 -19.661
  172   HE22  GLN  23          HE22      GLN  23   2.745 -20.434 -20.854
  173    H    MET  24           HN       MET  24   2.273 -13.490 -19.861
  174    HA   MET  24           HA       MET  24  -0.144 -13.680 -21.450
  175    HB2  MET  24           HB2      MET  24   0.944 -11.543 -19.593
  176    HB3  MET  24           HB1      MET  24  -0.512 -11.317 -20.610
  177    HG2  MET  24           HG2      MET  24  -1.436 -13.453 -19.545
  178    HG3  MET  24           HG1      MET  24  -0.092 -13.337 -18.376
  179    HE1  MET  24           HE1      MET  24   0.672 -11.305 -17.658
  180    HE2  MET  24           HE2      MET  24  -0.280 -11.007 -16.162
  181    HE3  MET  24           HE3      MET  24  -0.215  -9.756 -17.449
  182    H    SER  25           HN       SER  25   3.064 -13.074 -21.919
  183    HA   SER  25           HA       SER  25   2.741 -10.756 -23.570
  184    HB2  SER  25           HB2      SER  25   5.083 -12.738 -23.312
  185    HB3  SER  25           HB1      SER  25   5.115 -11.255 -24.351
  186    HG   SER  25           HG       SER  25   4.429 -11.131 -21.611
  187    H    ASP  26           HN       ASP  26   3.373 -10.855 -25.954
  188    HA   ASP  26           HA       ASP  26   1.907 -13.079 -27.090
  189    HB2  ASP  26           HB2      ASP  26   3.098 -10.531 -28.293
  190    HB3  ASP  26           HB1      ASP  26   2.314 -11.815 -29.279
  191    H    SER  27           HN       SER  27   4.791 -12.974 -25.833
  192    HA   SER  27           HA       SER  27   6.366 -13.638 -28.146
  193    HB2  SER  27           HB2      SER  27   7.010 -13.890 -25.143
  194    HB3  SER  27           HB1      SER  27   8.188 -14.187 -26.487
  195    HG   SER  27           HG       SER  27   8.535 -12.156 -26.042
  196    H    CYS  28           HN       CYS  28   3.988 -15.104 -26.270
  197    HA   CYS  28           HA       CYS  28   5.242 -17.705 -26.342
  198    HB2  CYS  28           HB2      CYS  28   3.658 -17.017 -24.455
  199    HB3  CYS  28           HB1      CYS  28   2.350 -16.955 -25.683
  200    H    HIS  29           HN       HIS  29   5.611 -17.660 -28.724
  201    HA   HIS  29           HA       HIS  29   3.176 -17.679 -30.296
  202    HB2  HIS  29           HB2      HIS  29   5.958 -18.422 -31.324
  203    HB3  HIS  29           HB1      HIS  29   4.569 -17.749 -32.259
  204    HD2  HIS  29           HD2      HIS  29   7.444 -16.508 -29.811
  205    HE1  HIS  29           HE1      HIS  29   5.622 -13.190 -31.695
  206    HE2  HIS  29           HE2      HIS  29   7.523 -13.976 -30.200
  207    H    ASP  30           HN       ASP  30   5.500 -19.865 -28.747
  208    HA   ASP  30           HA       ASP  30   3.835 -22.044 -29.713
  209    HB2  ASP  30           HB2      ASP  30   6.345 -21.687 -30.858
  210    HB3  ASP  30           HB1      ASP  30   6.756 -22.683 -29.417
  211    H    GLU  31           HN       GLU  31   4.576 -24.132 -28.357
  212    HA   GLU  31           HA       GLU  31   4.183 -23.385 -25.668
  213    HB2  GLU  31           HB2      GLU  31   5.108 -26.042 -26.910
  214    HB3  GLU  31           HB1      GLU  31   4.763 -25.828 -25.154
  215    HG2  GLU  31           HG2      GLU  31   2.383 -25.256 -25.640
  216    HG3  GLU  31           HG1      GLU  31   2.708 -25.376 -27.417
  217    H    GLN  32           HN       GLN  32   7.029 -24.266 -27.678
  218    HA   GLN  32           HA       GLN  32   8.822 -24.474 -25.531
  219    HB2  GLN  32           HB2      GLN  32   9.326 -25.191 -27.910
  220    HB3  GLN  32           HB1      GLN  32   9.391 -23.460 -28.358
  221    HG2  GLN  32           HG2      GLN  32  11.305 -23.073 -26.837
  222    HG3  GLN  32           HG1      GLN  32  11.215 -24.787 -26.265
  223   HE21  GLN  32          HE21      GLN  32  13.608 -24.223 -27.262
  224   HE22  GLN  32          HE22      GLN  32  13.828 -24.814 -28.874
  225    H    SER  33           HN       SER  33   7.646 -21.734 -27.545
  226    HA   SER  33           HA       SER  33   9.438 -19.854 -26.500
  227    HB2  SER  33           HB2      SER  33   6.542 -19.417 -27.452
  228    HB3  SER  33           HB1      SER  33   7.751 -18.106 -27.168
  229    HG   SER  33           HG       SER  33   8.943 -18.836 -28.823
  230    H    CYS  34           HN       CYS  34   6.201 -21.064 -25.405
  231    HA   CYS  34           HA       CYS  34   6.073 -19.212 -23.249
  232    HB2  CYS  34           HB2      CYS  34   4.522 -21.599 -24.158
  233    HB3  CYS  34           HB1      CYS  34   4.647 -21.474 -22.369
  234    H    HIS  35           HN       HIS  35   7.537 -22.438 -23.795
  235    HA   HIS  35           HA       HIS  35   8.008 -22.966 -21.058
  236    HB2  HIS  35           HB2      HIS  35   8.268 -24.778 -22.740
  237    HB3  HIS  35           HB1      HIS  35   9.585 -23.846 -23.540
  238    HD2  HIS  35           HD2      HIS  35  12.051 -24.660 -22.745
  239    HE1  HIS  35           HE1      HIS  35  10.927 -26.256 -18.994
  240    HE2  HIS  35           HE2      HIS  35  12.832 -25.895 -20.639
  241    H    GLN  36           HN       GLN  36   9.722 -21.119 -23.612
  242    HA   GLN  36           HA       GLN  36  12.109 -20.780 -22.200
  243    HB2  GLN  36           HB2      GLN  36  10.677 -18.931 -24.160
  244    HB3  GLN  36           HB1      GLN  36  12.306 -18.591 -23.507
  245    HG2  GLN  36           HG2      GLN  36  11.716 -21.254 -24.894
  246    HG3  GLN  36           HG1      GLN  36  12.118 -19.766 -25.843
  247   HE21  GLN  36          HE21      GLN  36  13.331 -22.238 -23.641
  248   HE22  GLN  36          HE22      GLN  36  14.981 -21.742 -23.653
  249    H    CYS  37           HN       CYS  37   8.939 -19.154 -22.047
  250    HA   CYS  37           HA       CYS  37   9.799 -16.995 -20.471
  251    HB2  CYS  37           HB2      CYS  37   7.115 -18.457 -20.563
  252    HB3  CYS  37           HB1      CYS  37   7.399 -16.984 -19.603
  253    H    HIS  38           HN       HIS  38   8.779 -20.317 -19.759
  254    HA   HIS  38           HA       HIS  38   8.799 -19.914 -16.952
  255    HB2  HIS  38           HB2      HIS  38   7.537 -21.805 -18.078
  256    HB3  HIS  38           HB1      HIS  38   9.133 -22.533 -18.496
  257    HD2  HIS  38           HD2      HIS  38  10.637 -23.462 -16.226
  258    HE1  HIS  38           HE1      HIS  38   7.245 -23.409 -13.695
  259    HE2  HIS  38           HE2      HIS  38   9.646 -24.210 -13.977
  260    H    VAL  39           HN       VAL  39  11.076 -21.044 -19.436
  261    HA   VAL  39           HA       VAL  39  13.035 -21.879 -17.591
  262    HB   VAL  39           HB       VAL  39  13.233 -20.854 -20.451
  263   HG11  VAL  39          HG11      VAL  39  15.565 -22.019 -20.241
  264   HG12  VAL  39          HG12      VAL  39  15.330 -21.875 -18.458
  265   HG13  VAL  39          HG13      VAL  39  15.374 -20.393 -19.486
  266   HG21  VAL  39          HG21      VAL  39  12.615 -23.434 -19.084
  267   HG22  VAL  39          HG22      VAL  39  13.917 -23.563 -20.330
  268   HG23  VAL  39          HG23      VAL  39  12.298 -22.910 -20.783
  269    H    LYS  40           HN       LYS  40  12.153 -18.740 -19.106
  270    HA   LYS  40           HA       LYS  40  14.492 -17.409 -18.233
  271    HB2  LYS  40           HB2      LYS  40  11.657 -16.403 -18.847
  272    HB3  LYS  40           HB1      LYS  40  12.978 -15.300 -18.319
  273    HG2  LYS  40           HG2      LYS  40  14.042 -15.362 -20.344
  274    HG3  LYS  40           HG1      LYS  40  13.714 -17.114 -20.586
  275    HD2  LYS  40           HD2      LYS  40  11.844 -16.712 -21.819
  276    HD3  LYS  40           HD1      LYS  40  11.251 -15.450 -20.690
  277    HE2  LYS  40           HE2      LYS  40  12.821 -13.785 -21.732
  278    HE3  LYS  40           HE1      LYS  40  13.401 -15.063 -22.878
  279    HZ1  LYS  40           HZ1      LYS  40  10.551 -14.267 -22.618
  280    HZ2  LYS  40           HZ2      LYS  40  11.282 -15.199 -23.836
  281    HZ3  LYS  40           HZ3      LYS  40  11.634 -13.542 -23.705
  282    H    HIS  41           HN       HIS  41  11.314 -18.188 -16.819
  283    HA   HIS  41           HA       HIS  41  11.648 -16.605 -14.528
  284    HB2  HIS  41           HB2      HIS  41   9.454 -17.588 -15.073
  285    HB3  HIS  41           HB1      HIS  41  10.137 -19.232 -14.931
  286    HD2  HIS  41           HD2      HIS  41   9.126 -16.198 -12.544
  287    HE1  HIS  41           HE1      HIS  41   9.592 -19.723 -10.286
  288    HE2  HIS  41           HE2      HIS  41   8.874 -17.289 -10.247
  289    H    THR  42           HN       THR  42  12.552 -19.962 -15.424
  290    HA   THR  42           HA       THR  42  13.416 -20.706 -12.889
  291    HB   THR  42           HB       THR  42  14.400 -21.557 -15.661
  292    HG1  THR  42           HG1      THR  42  12.199 -21.983 -14.935
  293   HG21  THR  42          HG21      THR  42  16.188 -22.236 -14.347
  294   HG22  THR  42          HG22      THR  42  15.081 -23.632 -14.079
  295   HG23  THR  42          HG23      THR  42  15.204 -22.326 -12.843
  296    H    ASP  43           HN       ASP  43  15.161 -19.133 -15.674
  297    HA   ASP  43           HA       ASP  43  17.617 -19.049 -14.223
  298    HB2  ASP  43           HB2      ASP  43  16.622 -17.469 -16.660
  299    HB3  ASP  43           HB1      ASP  43  18.275 -17.269 -15.966
  300    H    CYS  44           HN       CYS  44  14.766 -16.943 -14.530
  301    HA   CYS  44           HA       CYS  44  15.995 -14.637 -13.438
  302    HB2  CYS  44           HB2      CYS  44  13.708 -14.701 -14.676
  303    HB3  CYS  44           HB1      CYS  44  13.040 -15.417 -13.173
  304    H    VAL  45           HN       VAL  45  14.345 -17.496 -12.181
  305    HA   VAL  45           HA       VAL  45  14.336 -16.463  -9.538
  306    HB   VAL  45           HB       VAL  45  13.651 -19.045 -10.885
  307   HG11  VAL  45          HG11      VAL  45  13.486 -20.124  -8.563
  308   HG12  VAL  45          HG12      VAL  45  14.434 -18.739  -7.910
  309   HG13  VAL  45          HG13      VAL  45  15.177 -19.849  -9.137
  310   HG21  VAL  45          HG21      VAL  45  11.619 -18.702  -9.330
  311   HG22  VAL  45          HG22      VAL  45  11.874 -17.426 -10.585
  312   HG23  VAL  45          HG23      VAL  45  12.350 -17.117  -8.869
  313    H    ASN  46           HN       ASN  46  16.357 -18.600 -11.521
  314    HA   ASN  46           HA       ASN  46  17.934 -19.507  -9.398
  315    HB2  ASN  46           HB2      ASN  46  18.362 -19.177 -12.373
  316    HB3  ASN  46           HB1      ASN  46  19.724 -19.657 -11.310
  317   HD21  ASN  46          HD21      ASN  46  18.111 -21.087 -13.485
  318   HD22  ASN  46          HD22      ASN  46  17.634 -22.574 -12.756
  319    H    THR  47           HN       THR  47  17.968 -16.479 -11.281
  320    HA   THR  47           HA       THR  47  20.526 -15.821 -10.042
  321    HB   THR  47           HB       THR  47  18.813 -14.192 -11.975
  322    HG1  THR  47           HG1      THR  47  19.647 -16.003 -12.953
  323   HG21  THR  47          HG21      THR  47  21.573 -13.800 -10.681
  324   HG22  THR  47          HG22      THR  47  20.172 -12.664 -10.711
  325   HG23  THR  47          HG23      THR  47  21.114 -12.976 -12.218
  326    H    GLY  48           HN       GLY  48  17.086 -14.721 -10.166
  327    HA2  GLY  48           HA2      GLY  48  17.608 -12.568  -8.384
  328    HA3  GLY  48           HA1      GLY  48  16.001 -13.273  -8.851
  329    H    CYS  49           HN       CYS  49  16.485 -16.006  -7.968
  330    HA   CYS  49           HA       CYS  49  17.141 -15.704  -5.158
  331    HB2  CYS  49           HB2      CYS  49  14.850 -17.090  -4.773
  332    HB3  CYS  49           HB1      CYS  49  14.913 -15.310  -4.645
  333    HA   PRO  50           HA       PRO  50  18.565 -19.498  -7.485
  334    HB2  PRO  50           HB2      PRO  50  20.661 -19.606  -5.482
  335    HB3  PRO  50           HB1      PRO  50  20.825 -19.147  -7.230
  336    HG2  PRO  50           HG2      PRO  50  20.551 -17.380  -4.784
  337    HG3  PRO  50           HG1      PRO  50  21.334 -17.032  -6.380
  338    HD2  PRO  50           HD2      PRO  50  18.937 -15.929  -5.688
  339    HD3  PRO  50           HD1      PRO  50  19.301 -16.405  -7.390
  Start of MODEL   19
    1    H1   SER   1           HT1      SER   1   9.937 -30.106   5.437
    2    H2   SER   1           HT2      SER   1  10.182 -30.422   7.089
    3    H3   SER   1           HT3      SER   1  11.019 -29.150   6.334
    4    HA   SER   1           HA       SER   1   8.509 -28.477   5.797
    5    HB2  SER   1           HB2      SER   1   7.233 -28.691   7.998
    6    HB3  SER   1           HB1      SER   1   7.543 -30.291   7.214
    7    HG   SER   1           HG       SER   1   9.116 -29.063   9.248
    8    H    SER   2           HN       SER   2  10.535 -26.907   5.632
    9    HA   SER   2           HA       SER   2  10.399 -25.277   8.061
   10    HB2  SER   2           HB2      SER   2  12.922 -25.791   6.362
   11    HB3  SER   2           HB1      SER   2  12.803 -24.591   7.711
   12    HG   SER   2           HG       SER   2  11.921 -27.044   8.447
   13    H    THR   3           HN       THR   3  10.452 -22.972   7.641
   14    HA   THR   3           HA       THR   3   9.501 -22.406   5.000
   15    HB   THR   3           HB       THR   3  10.183 -20.486   7.277
   16    HG1  THR   3           HG1      THR   3   7.632 -20.635   6.928
   17   HG21  THR   3          HG21      THR   3   8.758 -18.894   6.003
   18   HG22  THR   3          HG22      THR   3   8.483 -20.139   4.730
   19   HG23  THR   3          HG23      THR   3  10.133 -19.461   4.985
   20    HA   PRO   4           HA       PRO   4  13.528 -21.691   3.381
   21    HB2  PRO   4           HB2      PRO   4  12.720 -20.187   1.169
   22    HB3  PRO   4           HB1      PRO   4  12.690 -22.000   1.243
   23    HG2  PRO   4           HG2      PRO   4  10.430 -20.000   1.684
   24    HG3  PRO   4           HG1      PRO   4  10.406 -21.602   0.838
   25    HD2  PRO   4           HD2      PRO   4   9.436 -21.274   3.384
   26    HD3  PRO   4           HD1      PRO   4  10.235 -22.806   2.845
   27    H    ASP   5           HN       ASP   5  11.402 -18.804   2.875
   28    HA   ASP   5           HA       ASP   5  13.013 -17.289   4.627
   29    HB2  ASP   5           HB2      ASP   5  14.292 -17.395   2.319
   30    HB3  ASP   5           HB1      ASP   5  12.966 -16.333   1.748
   31    H    GLY   6           HN       GLY   6  12.098 -14.997   2.552
   32    HA2  GLY   6           HA2      GLY   6   9.294 -15.142   2.643
   33    HA3  GLY   6           HA1      GLY   6   9.983 -14.087   3.957
   34    H    THR   7           HN       THR   7  12.398 -13.386   2.351
   35    HA   THR   7           HA       THR   7  11.033 -11.432   0.631
   36    HB   THR   7           HB       THR   7  13.895 -11.544   1.718
   37    HG1  THR   7           HG1      THR   7  12.528  -9.301   2.168
   38   HG21  THR   7          HG21      THR   7  12.523  -9.735  -0.350
   39   HG22  THR   7          HG22      THR   7  14.097 -10.606  -0.480
   40   HG23  THR   7          HG23      THR   7  13.946  -9.173   0.606
   41    H    TRP   8           HN       TRP   8  13.340 -14.091   0.792
   42    HA   TRP   8           HA       TRP   8  14.354 -13.848  -1.776
   43    HB2  TRP   8           HB2      TRP   8  15.577 -15.483  -0.699
   44    HB3  TRP   8           HB1      TRP   8  14.217 -15.925   0.350
   45    HD1  TRP   8           HD1      TRP   8  15.958 -17.026  -2.882
   46    HE1  TRP   8           HE1      TRP   8  14.844 -19.166  -3.698
   47    HE3  TRP   8           HE3      TRP   8  11.969 -17.112   0.252
   48    HZ2  TRP   8           HZ2      TRP   8  12.563 -20.680  -3.076
   49    HZ3  TRP   8           HZ3      TRP   8  10.353 -18.939   0.082
   50    HH2  TRP   8           HH2      TRP   8  10.652 -20.707  -1.575
   51    H    VAL   9           HN       VAL   9  11.343 -15.299  -0.447
   52    HA   VAL   9           HA       VAL   9  10.652 -16.587  -2.877
   53    HB   VAL   9           HB       VAL   9   9.657 -17.188  -0.645
   54   HG11  VAL   9          HG11      VAL   9   8.296 -15.691   0.533
   55   HG12  VAL   9          HG12      VAL   9   7.799 -14.800  -0.954
   56   HG13  VAL   9          HG13      VAL   9   9.428 -14.523  -0.239
   57   HG21  VAL   9          HG21      VAL   9   8.649 -17.844  -2.832
   58   HG22  VAL   9          HG22      VAL   9   7.714 -16.290  -2.860
   59   HG23  VAL   9          HG23      VAL   9   7.387 -17.526  -1.582
   60    H    LYS  10           HN       LYS  10  10.422 -13.275  -1.653
   61    HA   LYS  10           HA       LYS  10   8.292 -12.486  -3.315
   62    HB2  LYS  10           HB2      LYS  10  10.690 -10.873  -2.252
   63    HB3  LYS  10           HB1      LYS  10   9.322 -10.140  -3.159
   64    HG2  LYS  10           HG2      LYS  10   7.728 -10.920  -1.405
   65    HG3  LYS  10           HG1      LYS  10   9.087 -11.661  -0.496
   66    HD2  LYS  10           HD2      LYS  10  10.148  -9.407  -0.245
   67    HD3  LYS  10           HD1      LYS  10   8.790  -8.665  -1.158
   68    HE2  LYS  10           HE2      LYS  10   7.180  -9.404   0.621
   69    HE3  LYS  10           HE1      LYS  10   8.544 -10.167   1.539
   70    HZ1  LYS  10           HZ1      LYS  10   7.669  -7.540   1.618
   71    HZ2  LYS  10           HZ2      LYS  10   9.190  -7.502   0.864
   72    HZ3  LYS  10           HZ3      LYS  10   9.017  -8.224   2.391
   73    H    CYS  11           HN       CYS  11  11.672 -13.288  -3.864
   74    HA   CYS  11           HA       CYS  11  11.837 -11.891  -6.337
   75    HB2  CYS  11           HB2      CYS  11  14.016 -12.341  -5.548
   76    HB3  CYS  11           HB1      CYS  11  13.530 -13.910  -4.868
   77    H    ARG  12           HN       ARG  12  11.112 -15.212  -5.182
   78    HA   ARG  12           HA       ARG  12  10.937 -16.410  -7.648
   79    HB2  ARG  12           HB2      ARG  12   9.196 -16.865  -5.174
   80    HB3  ARG  12           HB1      ARG  12   9.316 -17.968  -6.557
   81    HG2  ARG  12           HG2      ARG  12  11.827 -17.173  -5.098
   82    HG3  ARG  12           HG1      ARG  12  10.722 -18.387  -4.372
   83    HD2  ARG  12           HD2      ARG  12  10.874 -19.744  -6.519
   84    HD3  ARG  12           HD1      ARG  12  12.117 -18.557  -7.111
   85    HE   ARG  12           HE       ARG  12  13.101 -19.267  -4.643
   86   HH11  ARG  12          HH11      ARG  12  11.832 -21.094  -7.426
   87   HH12  ARG  12          HH12      ARG  12  12.856 -22.470  -7.190
   88   HH21  ARG  12          HH21      ARG  12  14.501 -21.152  -4.322
   89   HH22  ARG  12          HH22      ARG  12  14.396 -22.504  -5.399
   90    H    HIS  13           HN       HIS  13   8.573 -14.576  -5.691
   91    HA   HIS  13           HA       HIS  13   6.494 -14.947  -7.606
   92    HB2  HIS  13           HB2      HIS  13   5.832 -14.388  -5.321
   93    HB3  HIS  13           HB1      HIS  13   6.879 -12.925  -5.331
   94    HD2  HIS  13           HD2      HIS  13   5.593 -10.624  -6.093
   95    HE1  HIS  13           HE1      HIS  13   2.145 -12.478  -7.695
   96    HE2  HIS  13           HE2      HIS  13   3.259 -10.271  -7.095
   97    H    ASP  14           HN       ASP  14   8.987 -12.413  -6.987
   98    HA   ASP  14           HA       ASP  14   7.935 -10.506  -8.736
   99    HB2  ASP  14           HB2      ASP  14   9.955 -10.193  -7.145
  100    HB3  ASP  14           HB1      ASP  14  10.931 -11.048  -8.381
  101    H    CYS  15           HN       CYS  15  10.385 -13.145  -9.368
  102    HA   CYS  15           HA       CYS  15  10.479 -12.460 -12.134
  103    HB2  CYS  15           HB2      CYS  15  11.240 -15.075 -10.693
  104    HB3  CYS  15           HB1      CYS  15  11.546 -14.759 -12.429
  105    H    PHE  16           HN       PHE  16   8.438 -14.479 -10.075
  106    HA   PHE  16           HA       PHE  16   7.413 -16.088 -12.116
  107    HB2  PHE  16           HB2      PHE  16   6.955 -16.499  -9.696
  108    HB3  PHE  16           HB1      PHE  16   5.955 -15.009  -9.657
  109    HD1  PHE  16           HD1      PHE  16   6.259 -18.010 -11.881
  110    HD2  PHE  16           HD2      PHE  16   3.762 -15.418  -9.610
  111    HE1  PHE  16           HE1      PHE  16   4.295 -19.328 -12.515
  112    HE2  PHE  16           HE2      PHE  16   1.806 -16.750 -10.256
  113    HZ   PHE  16           HZ       PHE  16   2.073 -18.701 -11.705
  114    H    THR  17           HN       THR  17   6.316 -12.913 -10.755
  115    HA   THR  17           HA       THR  17   4.118 -12.751 -12.517
  116    HB   THR  17           HB       THR  17   4.177 -10.295 -12.072
  117    HG1  THR  17           HG1      THR  17   6.682 -11.052 -11.076
  118   HG21  THR  17          HG21      THR  17   3.218 -10.683 -10.040
  119   HG22  THR  17          HG22      THR  17   4.753 -11.336  -9.355
  120   HG23  THR  17          HG23      THR  17   3.663 -12.410 -10.310
  121    H    LYS  18           HN       LYS  18   7.576 -11.788 -12.766
  122    HA   LYS  18           HA       LYS  18   7.283 -10.393 -15.159
  123    HB2  LYS  18           HB2      LYS  18   9.567 -11.760 -13.759
  124    HB3  LYS  18           HB1      LYS  18   9.764 -11.403 -15.509
  125    HG2  LYS  18           HG2      LYS  18  10.658  -9.615 -13.981
  126    HG3  LYS  18           HG1      LYS  18   9.437  -9.041 -15.163
  127    HD2  LYS  18           HD2      LYS  18   7.931  -9.810 -12.887
  128    HD3  LYS  18           HD1      LYS  18   9.375  -9.015 -12.223
  129    HE2  LYS  18           HE2      LYS  18   7.621  -7.775 -14.421
  130    HE3  LYS  18           HE1      LYS  18   7.429  -7.432 -12.653
  131    HZ1  LYS  18           HZ1      LYS  18  10.095  -7.159 -13.836
  132    HZ2  LYS  18           HZ2      LYS  18   9.341  -6.275 -12.599
  133    HZ3  LYS  18           HZ3      LYS  18   8.929  -5.987 -14.221
  134    H    TYR  19           HN       TYR  19   7.370 -13.821 -14.318
  135    HA   TYR  19           HA       TYR  19   7.860 -14.592 -17.043
  136    HB2  TYR  19           HB2      TYR  19   8.603 -16.269 -15.580
  137    HB3  TYR  19           HB1      TYR  19   7.234 -16.035 -14.448
  138    HD1  TYR  19           HD1      TYR  19   8.166 -17.349 -17.792
  139    HD2  TYR  19           HD2      TYR  19   5.359 -17.316 -14.603
  140    HE1  TYR  19           HE1      TYR  19   6.998 -19.237 -18.813
  141    HE2  TYR  19           HE2      TYR  19   4.189 -19.203 -15.623
  142    HH   TYR  19           HH       TYR  19   4.987 -21.197 -17.306
  143    H    LYS  20           HN       LYS  20   5.073 -14.535 -14.727
  144    HA   LYS  20           HA       LYS  20   3.219 -15.616 -16.498
  145    HB2  LYS  20           HB2      LYS  20   2.758 -13.413 -14.429
  146    HB3  LYS  20           HB1      LYS  20   1.490 -14.431 -15.184
  147    HG2  LYS  20           HG2      LYS  20   3.795 -15.502 -13.518
  148    HG3  LYS  20           HG1      LYS  20   2.164 -15.158 -12.897
  149    HD2  LYS  20           HD2      LYS  20   2.373 -16.929 -15.331
  150    HD3  LYS  20           HD1      LYS  20   2.918 -17.612 -13.767
  151    HE2  LYS  20           HE2      LYS  20   0.687 -17.104 -12.756
  152    HE3  LYS  20           HE1      LYS  20   0.137 -16.390 -14.327
  153    HZ1  LYS  20           HZ1      LYS  20   0.836 -18.656 -15.265
  154    HZ2  LYS  20           HZ2      LYS  20  -0.620 -18.529 -14.392
  155    HZ3  LYS  20           HZ3      LYS  20   0.756 -19.194 -13.653
  156    H    SER  21           HN       SER  21   4.687 -12.435 -16.199
  157    HA   SER  21           HA       SER  21   2.815 -11.031 -17.738
  158    HB2  SER  21           HB2      SER  21   4.768  -9.892 -16.562
  159    HB3  SER  21           HB1      SER  21   5.878 -10.651 -17.772
  160    HG   SER  21           HG       SER  21   4.219  -9.595 -19.294
  161    H    CYS  22           HN       CYS  22   5.471 -13.296 -18.586
  162    HA   CYS  22           HA       CYS  22   5.365 -12.719 -21.363
  163    HB2  CYS  22           HB2      CYS  22   7.337 -13.884 -20.395
  164    HB3  CYS  22           HB1      CYS  22   6.277 -15.231 -19.879
  165    H    GLN  23           HN       GLN  23   3.763 -15.088 -19.183
  166    HA   GLN  23           HA       GLN  23   2.523 -16.496 -21.280
  167    HB2  GLN  23           HB2      GLN  23   1.728 -16.130 -18.335
  168    HB3  GLN  23           HB1      GLN  23   0.782 -17.151 -19.475
  169    HG2  GLN  23           HG2      GLN  23   2.990 -18.456 -19.940
  170    HG3  GLN  23           HG1      GLN  23   3.668 -17.585 -18.504
  171   HE21  GLN  23          HE21      GLN  23   1.997 -20.364 -19.490
  172   HE22  GLN  23          HE22      GLN  23   1.280 -20.815 -17.981
  173    H    MET  24           HN       MET  24   1.919 -13.382 -19.719
  174    HA   MET  24           HA       MET  24  -0.779 -13.302 -20.740
  175    HB2  MET  24           HB2      MET  24   0.993 -11.151 -19.473
  176    HB3  MET  24           HB1      MET  24  -0.708 -10.903 -19.976
  177    HG2  MET  24           HG2      MET  24   0.168 -13.024 -17.963
  178    HG3  MET  24           HG1      MET  24  -0.333 -11.375 -17.509
  179    HE1  MET  24           HE1      MET  24  -1.554 -14.791 -19.343
  180    HE2  MET  24           HE2      MET  24  -2.738 -15.067 -18.020
  181    HE3  MET  24           HE3      MET  24  -1.018 -14.723 -17.627
  182    H    SER  25           HN       SER  25   2.491 -12.628 -21.724
  183    HA   SER  25           HA       SER  25   1.731 -10.674 -23.671
  184    HB2  SER  25           HB2      SER  25   4.293 -12.369 -23.446
  185    HB3  SER  25           HB1      SER  25   4.054 -11.002 -24.611
  186    HG   SER  25           HG       SER  25   3.769 -10.768 -21.792
  187    H    ASP  26           HN       ASP  26   2.251 -11.130 -26.087
  188    HA   ASP  26           HA       ASP  26   0.831 -13.571 -26.717
  189    HB2  ASP  26           HB2      ASP  26   1.867 -11.257 -28.435
  190    HB3  ASP  26           HB1      ASP  26   1.078 -12.720 -29.124
  191    H    SER  27           HN       SER  27   3.888 -12.955 -25.807
  192    HA   SER  27           HA       SER  27   5.252 -14.169 -28.030
  193    HB2  SER  27           HB2      SER  27   6.213 -13.607 -25.152
  194    HB3  SER  27           HB1      SER  27   7.266 -14.210 -26.496
  195    HG   SER  27           HG       SER  27   7.508 -12.218 -26.943
  196    H    CYS  28           HN       CYS  28   3.273 -15.140 -25.433
  197    HA   CYS  28           HA       CYS  28   4.605 -17.714 -25.205
  198    HB2  CYS  28           HB2      CYS  28   3.558 -16.463 -23.172
  199    HB3  CYS  28           HB1      CYS  28   1.970 -16.807 -23.928
  200    H    HIS  29           HN       HIS  29   4.136 -17.782 -27.712
  201    HA   HIS  29           HA       HIS  29   1.388 -18.754 -28.052
  202    HB2  HIS  29           HB2      HIS  29   1.787 -18.443 -30.528
  203    HB3  HIS  29           HB1      HIS  29   1.875 -16.895 -29.621
  204    HD2  HIS  29           HD2      HIS  29   4.530 -15.797 -29.384
  205    HE1  HIS  29           HE1      HIS  29   6.158 -18.393 -32.289
  206    HE2  HIS  29           HE2      HIS  29   6.534 -16.303 -30.892
  207    H    ASP  30           HN       ASP  30   4.869 -19.399 -28.332
  208    HA   ASP  30           HA       ASP  30   4.196 -22.047 -29.344
  209    HB2  ASP  30           HB2      ASP  30   6.801 -20.440 -29.294
  210    HB3  ASP  30           HB1      ASP  30   6.825 -22.230 -29.474
  211    H    GLU  31           HN       GLU  31   4.897 -23.898 -28.172
  212    HA   GLU  31           HA       GLU  31   4.814 -23.525 -25.394
  213    HB2  GLU  31           HB2      GLU  31   5.737 -25.928 -27.072
  214    HB3  GLU  31           HB1      GLU  31   5.607 -25.960 -25.276
  215    HG2  GLU  31           HG2      GLU  31   3.157 -25.532 -25.388
  216    HG3  GLU  31           HG1      GLU  31   3.251 -25.375 -27.189
  217    H    GLN  32           HN       GLN  32   7.467 -23.958 -27.792
  218    HA   GLN  32           HA       GLN  32   9.481 -24.249 -25.840
  219    HB2  GLN  32           HB2      GLN  32   9.770 -24.803 -28.294
  220    HB3  GLN  32           HB1      GLN  32   9.717 -23.048 -28.639
  221    HG2  GLN  32           HG2      GLN  32  11.757 -22.662 -27.284
  222    HG3  GLN  32           HG1      GLN  32  11.799 -24.413 -26.828
  223   HE21  GLN  32          HE21      GLN  32  14.046 -23.602 -28.034
  224   HE22  GLN  32          HE22      GLN  32  14.127 -24.098 -29.689
  225    H    SER  33           HN       SER  33   8.111 -21.418 -27.646
  226    HA   SER  33           HA       SER  33   9.916 -19.563 -26.550
  227    HB2  SER  33           HB2      SER  33   7.001 -19.139 -27.460
  228    HB3  SER  33           HB1      SER  33   8.152 -17.801 -27.063
  229    HG   SER  33           HG       SER  33   9.082 -18.078 -28.886
  230    H    CYS  34           HN       CYS  34   6.692 -20.802 -25.482
  231    HA   CYS  34           HA       CYS  34   6.553 -19.085 -23.248
  232    HB2  CYS  34           HB2      CYS  34   5.374 -21.900 -23.659
  233    HB3  CYS  34           HB1      CYS  34   4.959 -20.814 -22.287
  234    H    HIS  35           HN       HIS  35   8.031 -22.322 -23.866
  235    HA   HIS  35           HA       HIS  35   8.620 -22.835 -21.150
  236    HB2  HIS  35           HB2      HIS  35   8.776 -24.637 -22.872
  237    HB3  HIS  35           HB1      HIS  35  10.121 -23.741 -23.667
  238    HD2  HIS  35           HD2      HIS  35  12.565 -24.642 -22.883
  239    HE1  HIS  35           HE1      HIS  35  11.391 -26.245 -19.150
  240    HE2  HIS  35           HE2      HIS  35  13.306 -25.928 -20.793
  241    H    GLN  36           HN       GLN  36  10.320 -21.059 -23.785
  242    HA   GLN  36           HA       GLN  36  12.745 -20.770 -22.418
  243    HB2  GLN  36           HB2      GLN  36  11.332 -18.905 -24.383
  244    HB3  GLN  36           HB1      GLN  36  12.981 -18.594 -23.753
  245    HG2  GLN  36           HG2      GLN  36  12.349 -21.280 -25.064
  246    HG3  GLN  36           HG1      GLN  36  12.687 -19.821 -26.079
  247   HE21  GLN  36          HE21      GLN  36  14.012 -22.085 -23.670
  248   HE22  GLN  36          HE22      GLN  36  15.660 -21.611 -23.838
  249    H    CYS  37           HN       CYS  37   9.665 -18.965 -22.303
  250    HA   CYS  37           HA       CYS  37  10.691 -16.911 -20.666
  251    HB2  CYS  37           HB2      CYS  37   7.880 -18.013 -21.067
  252    HB3  CYS  37           HB1      CYS  37   8.232 -16.669 -19.941
  253    H    HIS  38           HN       HIS  38   9.335 -20.125 -20.071
  254    HA   HIS  38           HA       HIS  38   9.171 -19.746 -17.267
  255    HB2  HIS  38           HB2      HIS  38   7.903 -21.573 -18.474
  256    HB3  HIS  38           HB1      HIS  38   9.485 -22.365 -18.820
  257    HD2  HIS  38           HD2      HIS  38  10.828 -23.389 -16.484
  258    HE1  HIS  38           HE1      HIS  38   7.307 -23.246 -14.139
  259    HE2  HIS  38           HE2      HIS  38   9.689 -24.135 -14.306
  260    H    VAL  39           HN       VAL  39  11.572 -20.925 -19.596
  261    HA   VAL  39           HA       VAL  39  13.364 -21.856 -17.619
  262    HB   VAL  39           HB       VAL  39  13.785 -20.868 -20.471
  263   HG11  VAL  39          HG11      VAL  39  15.878 -20.484 -19.379
  264   HG12  VAL  39          HG12      VAL  39  16.049 -22.127 -20.108
  265   HG13  VAL  39          HG13      VAL  39  15.711 -21.952 -18.344
  266   HG21  VAL  39          HG21      VAL  39  14.355 -23.622 -20.211
  267   HG22  VAL  39          HG22      VAL  39  12.851 -22.898 -20.896
  268   HG23  VAL  39          HG23      VAL  39  12.913 -23.376 -19.154
  269    H    LYS  40           HN       LYS  40  12.708 -18.696 -19.213
  270    HA   LYS  40           HA       LYS  40  15.037 -17.452 -18.207
  271    HB2  LYS  40           HB2      LYS  40  12.284 -16.343 -18.987
  272    HB3  LYS  40           HB1      LYS  40  13.610 -15.287 -18.381
  273    HG2  LYS  40           HG2      LYS  40  14.819 -15.427 -20.328
  274    HG3  LYS  40           HG1      LYS  40  14.377 -17.147 -20.613
  275    HD2  LYS  40           HD2      LYS  40  12.721 -16.563 -22.036
  276    HD3  LYS  40           HD1      LYS  40  12.004 -15.432 -20.839
  277    HE2  LYS  40           HE2      LYS  40  13.601 -13.643 -21.551
  278    HE3  LYS  40           HE1      LYS  40  14.358 -14.785 -22.737
  279    HZ1  LYS  40           HZ1      LYS  40  12.665 -14.550 -24.126
  280    HZ2  LYS  40           HZ2      LYS  40  12.340 -13.120 -23.269
  281    HZ3  LYS  40           HZ3      LYS  40  11.477 -14.539 -22.913
  282    H    HIS  41           HN       HIS  41  11.757 -18.109 -16.976
  283    HA   HIS  41           HA       HIS  41  12.010 -16.536 -14.672
  284    HB2  HIS  41           HB2      HIS  41   9.818 -17.428 -15.281
  285    HB3  HIS  41           HB1      HIS  41  10.440 -19.100 -15.211
  286    HD2  HIS  41           HD2      HIS  41   9.403 -16.187 -12.719
  287    HE1  HIS  41           HE1      HIS  41   9.772 -19.812 -10.607
  288    HE2  HIS  41           HE2      HIS  41   9.071 -17.377 -10.481
  289    H    THR  42           HN       THR  42  12.857 -19.926 -15.503
  290    HA   THR  42           HA       THR  42  13.575 -20.676 -12.924
  291    HB   THR  42           HB       THR  42  14.673 -21.579 -15.637
  292    HG1  THR  42           HG1      THR  42  12.428 -21.930 -15.065
  293   HG21  THR  42          HG21      THR  42  16.357 -22.326 -14.236
  294   HG22  THR  42          HG22      THR  42  15.178 -23.665 -13.995
  295   HG23  THR  42          HG23      THR  42  15.303 -22.342 -12.778
  296    H    ASP  43           HN       ASP  43  15.496 -19.171 -15.628
  297    HA   ASP  43           HA       ASP  43  17.886 -19.153 -14.073
  298    HB2  ASP  43           HB2      ASP  43  17.038 -17.527 -16.536
  299    HB3  ASP  43           HB1      ASP  43  18.666 -17.386 -15.777
  300    H    CYS  44           HN       CYS  44  15.105 -16.977 -14.491
  301    HA   CYS  44           HA       CYS  44  16.328 -14.701 -13.341
  302    HB2  CYS  44           HB2      CYS  44  14.089 -14.716 -14.660
  303    HB3  CYS  44           HB1      CYS  44  13.353 -15.441 -13.196
  304    H    VAL  45           HN       VAL  45  14.589 -17.536 -12.161
  305    HA   VAL  45           HA       VAL  45  14.503 -16.522  -9.514
  306    HB   VAL  45           HB       VAL  45  13.835 -19.088 -10.902
  307   HG11  VAL  45          HG11      VAL  45  13.547 -20.164  -8.592
  308   HG12  VAL  45          HG12      VAL  45  14.484 -18.794  -7.894
  309   HG13  VAL  45          HG13      VAL  45  15.267 -19.913  -9.085
  310   HG21  VAL  45          HG21      VAL  45  11.740 -18.713  -9.438
  311   HG22  VAL  45          HG22      VAL  45  12.070 -17.448 -10.687
  312   HG23  VAL  45          HG23      VAL  45  12.472 -17.137  -8.952
  313    H    ASN  46           HN       ASN  46  16.553 -18.685 -11.434
  314    HA   ASN  46           HA       ASN  46  18.037 -19.629  -9.259
  315    HB2  ASN  46           HB2      ASN  46  18.577 -19.304 -12.217
  316    HB3  ASN  46           HB1      ASN  46  19.883 -19.830 -11.105
  317   HD21  ASN  46          HD21      ASN  46  18.304 -21.202 -13.346
  318   HD22  ASN  46          HD22      ASN  46  17.756 -22.677 -12.642
  319    H    THR  47           HN       THR  47  18.207 -16.610 -11.149
  320    HA   THR  47           HA       THR  47  20.737 -16.009  -9.825
  321    HB   THR  47           HB       THR  47  19.127 -14.348 -11.818
  322    HG1  THR  47           HG1      THR  47  19.980 -16.204 -12.732
  323   HG21  THR  47          HG21      THR  47  21.825 -13.994 -10.397
  324   HG22  THR  47          HG22      THR  47  20.455 -12.826 -10.531
  325   HG23  THR  47          HG23      THR  47  21.477 -13.190 -11.974
  326    H    GLY  48           HN       GLY  48  17.330 -14.830 -10.057
  327    HA2  GLY  48           HA2      GLY  48  17.847 -12.689  -8.259
  328    HA3  GLY  48           HA1      GLY  48  16.239 -13.351  -8.781
  329    H    CYS  49           HN       CYS  49  16.632 -16.100  -7.884
  330    HA   CYS  49           HA       CYS  49  17.189 -15.804  -5.051
  331    HB2  CYS  49           HB2      CYS  49  14.866 -17.151  -4.750
  332    HB3  CYS  49           HB1      CYS  49  14.948 -15.371  -4.632
  333    HA   PRO  50           HA       PRO  50  18.618 -19.639  -7.312
  334    HB2  PRO  50           HB2      PRO  50  20.689 -19.766  -5.294
  335    HB3  PRO  50           HB1      PRO  50  20.877 -19.290  -7.036
  336    HG2  PRO  50           HG2      PRO  50  20.572 -17.546  -4.573
  337    HG3  PRO  50           HG1      PRO  50  21.405 -17.196  -6.142
  338    HD2  PRO  50           HD2      PRO  50  19.008 -16.062  -5.515
  339    HD3  PRO  50           HD1      PRO  50  19.410 -16.539  -7.208
  Start of MODEL   20
    1    H1   SER   1           HT1      SER   1  11.774 -28.888   4.707
    2    H2   SER   1           HT2      SER   1  10.890 -30.231   4.156
    3    H3   SER   1           HT3      SER   1  11.817 -30.349   5.575
    4    HA   SER   1           HA       SER   1   9.270 -28.984   5.120
    5    HB2  SER   1           HB2      SER   1   9.470 -31.361   6.133
    6    HB3  SER   1           HB1      SER   1  10.282 -30.577   7.547
    7    HG   SER   1           HG       SER   1   8.460 -29.516   8.017
    8    H    SER   2           HN       SER   2  10.663 -26.852   5.041
    9    HA   SER   2           HA       SER   2  10.469 -25.753   7.681
   10    HB2  SER   2           HB2      SER   2  12.784 -24.835   7.778
   11    HB3  SER   2           HB1      SER   2  12.872 -26.639   7.691
   12    HG   SER   2           HG       SER   2  12.730 -25.515   5.230
   13    H    THR   3           HN       THR   3  10.751 -23.302   7.558
   14    HA   THR   3           HA       THR   3   9.633 -22.472   5.052
   15    HB   THR   3           HB       THR   3  10.503 -20.787   7.443
   16    HG1  THR   3           HG1      THR   3   7.928 -20.871   7.245
   17   HG21  THR   3          HG21      THR   3   8.987 -19.080   6.412
   18   HG22  THR   3          HG22      THR   3   8.681 -20.196   5.029
   19   HG23  THR   3          HG23      THR   3  10.333 -19.525   5.299
   20    HA   PRO   4           HA       PRO   4  13.597 -21.683   3.310
   21    HB2  PRO   4           HB2      PRO   4  12.707 -20.153   1.166
   22    HB3  PRO   4           HB1      PRO   4  12.656 -21.967   1.209
   23    HG2  PRO   4           HG2      PRO   4  10.443 -19.945   1.773
   24    HG3  PRO   4           HG1      PRO   4  10.364 -21.528   0.898
   25    HD2  PRO   4           HD2      PRO   4   9.510 -21.222   3.502
   26    HD3  PRO   4           HD1      PRO   4  10.225 -22.767   2.882
   27    H    ASP   5           HN       ASP   5  11.429 -18.807   2.919
   28    HA   ASP   5           HA       ASP   5  13.046 -17.313   4.679
   29    HB2  ASP   5           HB2      ASP   5  14.312 -17.374   2.362
   30    HB3  ASP   5           HB1      ASP   5  12.979 -16.306   1.818
   31    H    GLY   6           HN       GLY   6  12.112 -14.989   2.654
   32    HA2  GLY   6           HA2      GLY   6   9.309 -15.146   2.758
   33    HA3  GLY   6           HA1      GLY   6  10.003 -14.108   4.083
   34    H    THR   7           HN       THR   7  12.409 -13.389   2.460
   35    HA   THR   7           HA       THR   7  11.028 -11.406   0.784
   36    HB   THR   7           HB       THR   7  13.901 -11.536   1.840
   37    HG1  THR   7           HG1      THR   7  12.597  -9.299   2.370
   38   HG21  THR   7          HG21      THR   7  12.504  -9.700  -0.186
   39   HG22  THR   7          HG22      THR   7  14.083 -10.559  -0.340
   40   HG23  THR   7          HG23      THR   7  13.929  -9.142   0.768
   41    H    TRP   8           HN       TRP   8  13.333 -14.068   0.885
   42    HA   TRP   8           HA       TRP   8  14.326 -13.790  -1.688
   43    HB2  TRP   8           HB2      TRP   8  15.554 -15.447  -0.654
   44    HB3  TRP   8           HB1      TRP   8  14.208 -15.893   0.411
   45    HD1  TRP   8           HD1      TRP   8  15.896 -16.968  -2.858
   46    HE1  TRP   8           HE1      TRP   8  14.756 -19.089  -3.684
   47    HE3  TRP   8           HE3      TRP   8  11.946 -17.064   0.329
   48    HZ2  TRP   8           HZ2      TRP   8  12.472 -20.595  -3.052
   49    HZ3  TRP   8           HZ3      TRP   8  10.316 -18.877   0.158
   50    HH2  TRP   8           HH2      TRP   8  10.581 -20.628  -1.525
   51    H    VAL   9           HN       VAL   9  11.318 -15.236  -0.352
   52    HA   VAL   9           HA       VAL   9  10.600 -16.500  -2.789
   53    HB   VAL   9           HB       VAL   9   9.615 -17.112  -0.555
   54   HG11  VAL   9          HG11      VAL   9   9.408 -14.448  -0.128
   55   HG12  VAL   9          HG12      VAL   9   8.276 -15.614   0.646
   56   HG13  VAL   9          HG13      VAL   9   7.771 -14.708  -0.830
   57   HG21  VAL   9          HG21      VAL   9   8.588 -17.738  -2.743
   58   HG22  VAL   9          HG22      VAL   9   7.663 -16.178  -2.747
   59   HG23  VAL   9          HG23      VAL   9   7.338 -17.425  -1.479
   60    H    LYS  10           HN       LYS  10  10.409 -13.194  -1.539
   61    HA   LYS  10           HA       LYS  10   8.269 -12.374  -3.170
   62    HB2  LYS  10           HB2      LYS  10  10.699 -10.791  -2.136
   63    HB3  LYS  10           HB1      LYS  10   9.325 -10.041  -3.017
   64    HG2  LYS  10           HG2      LYS  10   7.750 -10.814  -1.242
   65    HG3  LYS  10           HG1      LYS  10   9.119 -11.569  -0.356
   66    HD2  LYS  10           HD2      LYS  10  10.203  -9.325  -0.116
   67    HD3  LYS  10           HD1      LYS  10   8.838  -8.568  -1.008
   68    HE2  LYS  10           HE2      LYS  10   7.249  -9.297   0.796
   69    HE3  LYS  10           HE1      LYS  10   8.622 -10.072   1.691
   70    HZ1  LYS  10           HZ1      LYS  10   7.767  -7.448   1.806
   71    HZ2  LYS  10           HZ2      LYS  10   9.260  -7.403   0.999
   72    HZ3  LYS  10           HZ3      LYS  10   9.143  -8.133   2.527
   73    H    CYS  11           HN       CYS  11  11.637 -13.204  -3.767
   74    HA   CYS  11           HA       CYS  11  11.780 -11.793  -6.234
   75    HB2  CYS  11           HB2      CYS  11  13.964 -12.270  -5.484
   76    HB3  CYS  11           HB1      CYS  11  13.473 -13.838  -4.803
   77    H    ARG  12           HN       ARG  12  11.034 -15.113  -5.091
   78    HA   ARG  12           HA       ARG  12  10.818 -16.293  -7.562
   79    HB2  ARG  12           HB2      ARG  12   9.095 -16.741  -5.072
   80    HB3  ARG  12           HB1      ARG  12   9.185 -17.836  -6.465
   81    HG2  ARG  12           HG2      ARG  12  11.714 -17.082  -5.011
   82    HG3  ARG  12           HG1      ARG  12  10.605 -18.303  -4.306
   83    HD2  ARG  12           HD2      ARG  12  10.745 -19.624  -6.476
   84    HD3  ARG  12           HD1      ARG  12  11.984 -18.428  -7.057
   85    HE   ARG  12           HE       ARG  12  12.990 -19.180  -4.612
   86   HH11  ARG  12          HH11      ARG  12  11.691 -20.960  -7.411
   87   HH12  ARG  12          HH12      ARG  12  12.715 -22.341  -7.207
   88   HH21  ARG  12          HH21      ARG  12  14.390 -21.071  -4.334
   89   HH22  ARG  12          HH22      ARG  12  14.272 -22.405  -5.431
   90    H    HIS  13           HN       HIS  13   8.495 -14.441  -5.569
   91    HA   HIS  13           HA       HIS  13   6.393 -14.766  -7.468
   92    HB2  HIS  13           HB2      HIS  13   5.746 -14.207  -5.184
   93    HB3  HIS  13           HB1      HIS  13   6.836 -12.775  -5.178
   94    HD2  HIS  13           HD2      HIS  13   5.624 -10.426  -5.932
   95    HE1  HIS  13           HE1      HIS  13   2.103 -12.161  -7.508
   96    HE2  HIS  13           HE2      HIS  13   3.295  -9.994  -6.911
   97    H    ASP  14           HN       ASP  14   8.945 -12.294  -6.866
   98    HA   ASP  14           HA       ASP  14   7.914 -10.350  -8.584
   99    HB2  ASP  14           HB2      ASP  14   9.977 -10.126  -7.012
  100    HB3  ASP  14           HB1      ASP  14  10.905 -10.951  -8.306
  101    H    CYS  15           HN       CYS  15  10.307 -13.031  -9.276
  102    HA   CYS  15           HA       CYS  15  10.343 -12.327 -12.045
  103    HB2  CYS  15           HB2      CYS  15  11.129 -14.956 -10.636
  104    HB3  CYS  15           HB1      CYS  15  11.399 -14.624 -12.376
  105    H    PHE  16           HN       PHE  16   8.303 -14.273  -9.938
  106    HA   PHE  16           HA       PHE  16   7.242 -15.918 -11.936
  107    HB2  PHE  16           HB2      PHE  16   6.793 -16.271  -9.508
  108    HB3  PHE  16           HB1      PHE  16   5.819 -14.766  -9.491
  109    HD1  PHE  16           HD1      PHE  16   6.075 -17.855 -11.585
  110    HD2  PHE  16           HD2      PHE  16   3.610 -15.089  -9.496
  111    HE1  PHE  16           HE1      PHE  16   4.088 -19.151 -12.192
  112    HE2  PHE  16           HE2      PHE  16   1.630 -16.396 -10.113
  113    HZ   PHE  16           HZ       PHE  16   1.869 -18.426 -11.459
  114    H    THR  17           HN       THR  17   6.229 -12.681 -10.652
  115    HA   THR  17           HA       THR  17   4.003 -12.517 -12.380
  116    HB   THR  17           HB       THR  17   4.132 -10.055 -12.023
  117    HG1  THR  17           HG1      THR  17   6.632 -10.819 -10.985
  118   HG21  THR  17          HG21      THR  17   3.682 -12.104 -10.138
  119   HG22  THR  17          HG22      THR  17   3.204 -10.372  -9.970
  120   HG23  THR  17          HG23      THR  17   4.768 -10.948  -9.282
  121    H    LYS  18           HN       LYS  18   7.491 -11.679 -12.739
  122    HA   LYS  18           HA       LYS  18   7.163 -10.391 -15.212
  123    HB2  LYS  18           HB2      LYS  18   9.506 -11.808 -13.884
  124    HB3  LYS  18           HB1      LYS  18   9.629 -11.287 -15.598
  125    HG2  LYS  18           HG2      LYS  18  10.465  -9.701 -13.641
  126    HG3  LYS  18           HG1      LYS  18   9.630  -9.023 -15.078
  127    HD2  LYS  18           HD2      LYS  18   7.617  -8.650 -13.897
  128    HD3  LYS  18           HD1      LYS  18   8.029  -9.837 -12.617
  129    HE2  LYS  18           HE2      LYS  18   8.203  -7.500 -11.770
  130    HE3  LYS  18           HE1      LYS  18   9.827  -8.299 -11.775
  131    HZ1  LYS  18           HZ1      LYS  18   8.843  -6.058 -13.298
  132    HZ2  LYS  18           HZ2      LYS  18   9.700  -7.196 -14.221
  133    HZ3  LYS  18           HZ3      LYS  18  10.425  -6.488 -12.859
  134    H    TYR  19           HN       TYR  19   7.324 -13.768 -14.157
  135    HA   TYR  19           HA       TYR  19   7.783 -14.757 -16.788
  136    HB2  TYR  19           HB2      TYR  19   8.370 -16.344 -15.166
  137    HB3  TYR  19           HB1      TYR  19   6.973 -15.952 -14.125
  138    HD1  TYR  19           HD1      TYR  19   7.899 -17.492 -17.377
  139    HD2  TYR  19           HD2      TYR  19   5.114 -17.232 -14.189
  140    HE1  TYR  19           HE1      TYR  19   6.679 -19.404 -18.299
  141    HE2  TYR  19           HE2      TYR  19   3.896 -19.141 -15.108
  142    HH   TYR  19           HH       TYR  19   4.865 -21.290 -16.882
  143    H    LYS  20           HN       LYS  20   4.926 -14.448 -14.588
  144    HA   LYS  20           HA       LYS  20   3.105 -15.536 -16.380
  145    HB2  LYS  20           HB2      LYS  20   2.647 -13.220 -14.428
  146    HB3  LYS  20           HB1      LYS  20   1.374 -14.236 -15.172
  147    HG2  LYS  20           HG2      LYS  20   3.587 -15.292 -13.365
  148    HG3  LYS  20           HG1      LYS  20   1.947 -14.865 -12.818
  149    HD2  LYS  20           HD2      LYS  20   2.117 -16.753 -15.157
  150    HD3  LYS  20           HD1      LYS  20   2.695 -17.389 -13.580
  151    HE2  LYS  20           HE2      LYS  20   0.483 -16.756 -12.539
  152    HE3  LYS  20           HE1      LYS  20  -0.093 -16.183 -14.158
  153    HZ1  LYS  20           HZ1      LYS  20  -0.155 -18.746 -13.123
  154    HZ2  LYS  20           HZ2      LYS  20   1.005 -18.779 -14.362
  155    HZ3  LYS  20           HZ3      LYS  20  -0.570 -18.236 -14.688
  156    H    SER  21           HN       SER  21   4.550 -12.300 -16.035
  157    HA   SER  21           HA       SER  21   2.819 -11.035 -17.872
  158    HB2  SER  21           HB2      SER  21   4.455  -9.733 -16.424
  159    HB3  SER  21           HB1      SER  21   5.809 -10.437 -17.394
  160    HG   SER  21           HG       SER  21   4.315  -9.529 -19.203
  161    H    CYS  22           HN       CYS  22   5.751 -13.081 -18.210
  162    HA   CYS  22           HA       CYS  22   6.074 -12.560 -20.978
  163    HB2  CYS  22           HB2      CYS  22   7.784 -13.679 -19.332
  164    HB3  CYS  22           HB1      CYS  22   6.813 -15.164 -19.580
  165    H    GLN  23           HN       GLN  23   4.195 -14.896 -19.022
  166    HA   GLN  23           HA       GLN  23   3.441 -16.469 -21.251
  167    HB2  GLN  23           HB2      GLN  23   2.107 -16.061 -18.509
  168    HB3  GLN  23           HB1      GLN  23   1.505 -17.226 -19.739
  169    HG2  GLN  23           HG2      GLN  23   4.355 -17.298 -18.541
  170    HG3  GLN  23           HG1      GLN  23   2.962 -18.299 -17.959
  171   HE21  GLN  23          HE21      GLN  23   1.795 -19.630 -19.664
  172   HE22  GLN  23          HE22      GLN  23   2.746 -20.349 -20.917
  173    H    MET  24           HN       MET  24   2.444 -13.344 -19.939
  174    HA   MET  24           HA       MET  24  -0.079 -13.457 -21.347
  175    HB2  MET  24           HB2      MET  24   1.359 -11.189 -19.883
  176    HB3  MET  24           HB1      MET  24  -0.244 -11.033 -20.665
  177    HG2  MET  24           HG2      MET  24   0.363 -13.086 -18.497
  178    HG3  MET  24           HG1      MET  24  -0.236 -11.445 -18.152
  179    HE1  MET  24           HE1      MET  24  -2.223 -15.167 -19.786
  180    HE2  MET  24           HE2      MET  24  -1.655 -14.980 -18.091
  181    HE3  MET  24           HE3      MET  24  -0.503 -14.765 -19.452
  182    H    SER  25           HN       SER  25   3.236 -12.752 -21.936
  183    HA   SER  25           HA       SER  25   2.826 -10.730 -23.869
  184    HB2  SER  25           HB2      SER  25   5.129 -12.759 -23.622
  185    HB3  SER  25           HB1      SER  25   5.132 -11.317 -24.716
  186    HG   SER  25           HG       SER  25   4.573 -11.001 -21.979
  187    H    ASP  26           HN       ASP  26   3.204 -11.037 -26.263
  188    HA   ASP  26           HA       ASP  26   1.558 -13.226 -27.114
  189    HB2  ASP  26           HB2      ASP  26   3.079 -11.048 -28.638
  190    HB3  ASP  26           HB1      ASP  26   2.113 -12.328 -29.455
  191    H    SER  27           HN       SER  27   4.680 -13.089 -26.072
  192    HA   SER  27           HA       SER  27   5.875 -14.520 -28.259
  193    HB2  SER  27           HB2      SER  27   6.865 -14.087 -25.370
  194    HB3  SER  27           HB1      SER  27   7.835 -14.845 -26.697
  195    HG   SER  27           HG       SER  27   8.407 -12.801 -26.778
  196    H    CYS  28           HN       CYS  28   3.685 -15.152 -25.742
  197    HA   CYS  28           HA       CYS  28   4.630 -17.877 -25.404
  198    HB2  CYS  28           HB2      CYS  28   3.673 -16.486 -23.441
  199    HB3  CYS  28           HB1      CYS  28   2.096 -16.560 -24.292
  200    H    HIS  29           HN       HIS  29   4.324 -18.098 -27.872
  201    HA   HIS  29           HA       HIS  29   1.486 -18.659 -28.375
  202    HB2  HIS  29           HB2      HIS  29   2.093 -18.510 -30.840
  203    HB3  HIS  29           HB1      HIS  29   2.256 -16.944 -29.975
  204    HD2  HIS  29           HD2      HIS  29   4.976 -16.087 -29.554
  205    HE1  HIS  29           HE1      HIS  29   6.572 -18.914 -32.254
  206    HE2  HIS  29           HE2      HIS  29   7.032 -16.822 -30.887
  207    H    ASP  30           HN       ASP  30   4.877 -19.723 -28.485
  208    HA   ASP  30           HA       ASP  30   3.914 -22.329 -29.367
  209    HB2  ASP  30           HB2      ASP  30   6.691 -21.030 -29.397
  210    HB3  ASP  30           HB1      ASP  30   6.498 -22.816 -29.506
  211    H    GLU  31           HN       GLU  31   4.574 -24.203 -28.114
  212    HA   GLU  31           HA       GLU  31   4.421 -23.698 -25.362
  213    HB2  GLU  31           HB2      GLU  31   5.336 -26.200 -26.896
  214    HB3  GLU  31           HB1      GLU  31   5.153 -26.145 -25.104
  215    HG2  GLU  31           HG2      GLU  31   2.718 -25.663 -25.310
  216    HG3  GLU  31           HG1      GLU  31   2.868 -25.595 -27.112
  217    H    GLN  32           HN       GLN  32   7.148 -24.313 -27.640
  218    HA   GLN  32           HA       GLN  32   9.081 -24.543 -25.596
  219    HB2  GLN  32           HB2      GLN  32   9.442 -25.251 -28.002
  220    HB3  GLN  32           HB1      GLN  32   9.456 -23.519 -28.449
  221    HG2  GLN  32           HG2      GLN  32  11.456 -23.113 -27.040
  222    HG3  GLN  32           HG1      GLN  32  11.426 -24.835 -26.485
  223   HE21  GLN  32          HE21      GLN  32  13.741 -24.196 -27.636
  224   HE22  GLN  32          HE22      GLN  32  13.867 -24.776 -29.260
  225    H    SER  33           HN       SER  33   7.841 -21.799 -27.607
  226    HA   SER  33           HA       SER  33   9.655 -19.923 -26.561
  227    HB2  SER  33           HB2      SER  33   6.789 -19.482 -27.608
  228    HB3  SER  33           HB1      SER  33   7.973 -18.157 -27.265
  229    HG   SER  33           HG       SER  33   8.432 -18.508 -29.265
  230    H    CYS  34           HN       CYS  34   6.383 -21.058 -25.525
  231    HA   CYS  34           HA       CYS  34   6.207 -19.176 -23.417
  232    HB2  CYS  34           HB2      CYS  34   4.938 -21.967 -23.711
  233    HB3  CYS  34           HB1      CYS  34   4.521 -20.793 -22.414
  234    H    HIS  35           HN       HIS  35   7.657 -22.444 -23.820
  235    HA   HIS  35           HA       HIS  35   8.112 -22.873 -21.070
  236    HB2  HIS  35           HB2      HIS  35   8.393 -24.735 -22.690
  237    HB3  HIS  35           HB1      HIS  35   9.714 -23.827 -23.509
  238    HD2  HIS  35           HD2      HIS  35  12.174 -24.625 -22.683
  239    HE1  HIS  35           HE1      HIS  35  11.028 -26.107 -18.890
  240    HE2  HIS  35           HE2      HIS  35  12.940 -25.802 -20.537
  241    H    GLN  36           HN       GLN  36   9.876 -21.090 -23.645
  242    HA   GLN  36           HA       GLN  36  12.249 -20.721 -22.214
  243    HB2  GLN  36           HB2      GLN  36  10.839 -18.910 -24.223
  244    HB3  GLN  36           HB1      GLN  36  12.461 -18.557 -23.559
  245    HG2  GLN  36           HG2      GLN  36  11.877 -21.243 -24.907
  246    HG3  GLN  36           HG1      GLN  36  12.306 -19.774 -25.872
  247   HE21  GLN  36          HE21      GLN  36  13.480 -22.272 -23.719
  248   HE22  GLN  36          HE22      GLN  36  15.127 -21.768 -23.670
  249    H    CYS  37           HN       CYS  37   9.075 -19.110 -22.100
  250    HA   CYS  37           HA       CYS  37   9.917 -16.909 -20.579
  251    HB2  CYS  37           HB2      CYS  37   7.241 -18.388 -20.626
  252    HB3  CYS  37           HB1      CYS  37   7.520 -16.886 -19.713
  253    H    HIS  38           HN       HIS  38   8.932 -20.215 -19.784
  254    HA   HIS  38           HA       HIS  38   8.968 -19.725 -16.985
  255    HB2  HIS  38           HB2      HIS  38   7.656 -21.623 -18.028
  256    HB3  HIS  38           HB1      HIS  38   9.228 -22.389 -18.463
  257    HD2  HIS  38           HD2      HIS  38  10.779 -23.265 -16.199
  258    HE1  HIS  38           HE1      HIS  38   7.430 -23.138 -13.611
  259    HE2  HIS  38           HE2      HIS  38   9.822 -23.956 -13.916
  260    H    VAL  39           HN       VAL  39  11.203 -20.878 -19.470
  261    HA   VAL  39           HA       VAL  39  13.154 -21.779 -17.647
  262    HB   VAL  39           HB       VAL  39  13.343 -20.751 -20.504
  263   HG11  VAL  39          HG11      VAL  39  15.667 -21.934 -20.319
  264   HG12  VAL  39          HG12      VAL  39  15.453 -21.794 -18.533
  265   HG13  VAL  39          HG13      VAL  39  15.499 -20.307 -19.557
  266   HG21  VAL  39          HG21      VAL  39  12.406 -22.799 -20.837
  267   HG22  VAL  39          HG22      VAL  39  12.690 -23.306 -19.125
  268   HG23  VAL  39          HG23      VAL  39  14.006 -23.471 -20.352
  269    H    LYS  40           HN       LYS  40  12.345 -18.557 -19.103
  270    HA   LYS  40           HA       LYS  40  14.795 -17.420 -18.159
  271    HB2  LYS  40           HB2      LYS  40  14.027 -15.364 -18.963
  272    HB3  LYS  40           HB1      LYS  40  13.012 -16.473 -19.942
  273    HG2  LYS  40           HG2      LYS  40  11.411 -16.231 -17.753
  274    HG3  LYS  40           HG1      LYS  40  12.255 -14.656 -17.665
  275    HD2  LYS  40           HD2      LYS  40  11.450 -15.268 -20.417
  276    HD3  LYS  40           HD1      LYS  40  10.049 -15.379 -19.302
  277    HE2  LYS  40           HE2      LYS  40  10.184 -13.099 -18.685
  278    HE3  LYS  40           HE1      LYS  40  11.939 -12.979 -19.112
  279    HZ1  LYS  40           HZ1      LYS  40   9.924 -13.552 -21.190
  280    HZ2  LYS  40           HZ2      LYS  40  11.457 -12.830 -21.324
  281    HZ3  LYS  40           HZ3      LYS  40  10.166 -11.965 -20.636
  282    H    HIS  41           HN       HIS  41  11.621 -18.195 -16.846
  283    HA   HIS  41           HA       HIS  41  11.865 -16.500 -14.588
  284    HB2  HIS  41           HB2      HIS  41   9.659 -17.413 -15.160
  285    HB3  HIS  41           HB1      HIS  41  10.284 -19.080 -15.040
  286    HD2  HIS  41           HD2      HIS  41   9.268 -16.082 -12.624
  287    HE1  HIS  41           HE1      HIS  41   9.661 -19.641 -10.406
  288    HE2  HIS  41           HE2      HIS  41   8.959 -17.203 -10.348
  289    H    THR  42           HN       THR  42  12.736 -19.861 -15.445
  290    HA   THR  42           HA       THR  42  13.498 -20.618 -12.882
  291    HB   THR  42           HB       THR  42  14.531 -21.492 -15.631
  292    HG1  THR  42           HG1      THR  42  12.306 -21.879 -14.922
  293   HG21  THR  42          HG21      THR  42  16.283 -22.187 -14.276
  294   HG22  THR  42          HG22      THR  42  15.156 -23.571 -14.040
  295   HG23  THR  42          HG23      THR  42  15.264 -22.272 -12.796
  296    H    ASP  43           HN       ASP  43  15.334 -19.065 -15.618
  297    HA   ASP  43           HA       ASP  43  17.754 -19.023 -14.110
  298    HB2  ASP  43           HB2      ASP  43  16.845 -17.414 -16.561
  299    HB3  ASP  43           HB1      ASP  43  18.483 -17.251 -15.829
  300    H    CYS  44           HN       CYS  44  14.943 -16.867 -14.490
  301    HA   CYS  44           HA       CYS  44  16.174 -14.585 -13.357
  302    HB2  CYS  44           HB2      CYS  44  13.915 -14.604 -14.643
  303    HB3  CYS  44           HB1      CYS  44  13.202 -15.328 -13.166
  304    H    VAL  45           HN       VAL  45  14.457 -17.427 -12.147
  305    HA   VAL  45           HA       VAL  45  14.401 -16.408  -9.500
  306    HB   VAL  45           HB       VAL  45  13.727 -18.978 -10.874
  307   HG11  VAL  45          HG11      VAL  45  15.198 -19.795  -9.084
  308   HG12  VAL  45          HG12      VAL  45  13.487 -20.062  -8.563
  309   HG13  VAL  45          HG13      VAL  45  14.427 -18.688  -7.879
  310   HG21  VAL  45          HG21      VAL  45  12.388 -17.043  -8.893
  311   HG22  VAL  45          HG22      VAL  45  11.657 -18.619  -9.376
  312   HG23  VAL  45          HG23      VAL  45  11.959 -17.344 -10.621
  313    H    ASN  46           HN       ASN  46  16.446 -18.556 -11.446
  314    HA   ASN  46           HA       ASN  46  17.960 -19.496  -9.290
  315    HB2  ASN  46           HB2      ASN  46  18.462 -19.154 -12.252
  316    HB3  ASN  46           HB1      ASN  46  19.795 -19.656 -11.159
  317   HD21  ASN  46          HD21      ASN  46  18.227 -21.059 -13.380
  318   HD22  ASN  46          HD22      ASN  46  17.711 -22.543 -12.670
  319    H    THR  47           HN       THR  47  18.074 -16.461 -11.152
  320    HA   THR  47           HA       THR  47  20.613 -15.846  -9.858
  321    HB   THR  47           HB       THR  47  18.959 -14.188 -11.816
  322    HG1  THR  47           HG1      THR  47  19.806 -15.995 -12.787
  323   HG21  THR  47          HG21      THR  47  20.290 -12.671 -10.518
  324   HG22  THR  47          HG22      THR  47  21.278 -12.991 -11.995
  325   HG23  THR  47          HG23      THR  47  21.681 -13.819 -10.443
  326    H    GLY  48           HN       GLY  48  17.193 -14.695 -10.040
  327    HA2  GLY  48           HA2      GLY  48  17.712 -12.566  -8.228
  328    HA3  GLY  48           HA1      GLY  48  16.104 -13.239  -8.736
  329    H    CYS  49           HN       CYS  49  16.532 -15.989  -7.866
  330    HA   CYS  49           HA       CYS  49  17.126 -15.719  -5.038
  331    HB2  CYS  49           HB2      CYS  49  14.815 -17.072  -4.709
  332    HB3  CYS  49           HB1      CYS  49  14.889 -15.291  -4.587
  333    HA   PRO  50           HA       PRO  50  18.544 -19.517  -7.361
  334    HB2  PRO  50           HB2      PRO  50  20.613 -19.666  -5.335
  335    HB3  PRO  50           HB1      PRO  50  20.804 -19.189  -7.077
  336    HG2  PRO  50           HG2      PRO  50  20.517 -17.448  -4.613
  337    HG3  PRO  50           HG1      PRO  50  21.330 -17.093  -6.194
  338    HD2  PRO  50           HD2      PRO  50  18.937 -15.965  -5.526
  339    HD3  PRO  50           HD1      PRO  50  19.323 -16.424  -7.228