*HEADER    DE NOVO PROTEIN                         06-SEP-06   2I9M              
*TITLE     DESIGN OF A-HELIX BASED ON CONFORMATIONALLY RESTRICTED                
*TITLE    2 LIBRARIES                                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MHA6;                                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE DESIGNED PEPTIDE WAS SYNTHESIZED USING            
*SOURCE   4 FMOC CHEMISTRY                                                       
*KEYWDS    HELIX, DE NOVO PROTEIN                                                
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    D.PANTOJA-UCEDA, A.PINEDA-LUCENA                                      
*REVDAT   1   18-SEP-07 2I9M    0                                                


  1 SER  HB3     2 ALA  HN      4.70 
  1 SER  HA      2 ALA  HN      3.51         
  1 SER  HB2     2 ALA  HN      3.81         
  1 SER  HN      1 SER  HB2     3.70         
  1 SER  HN      1 SER  HB3     3.37         
  1 SER  HN      4 GLU  HB3     3.06         
  1 SER  HN      4 GLU  HB2     4.34         
  1 SER  HN      2 ALA  HN      5.01         
  2 ALA  HN      4 GLU  HB3     5.50         
  2 ALA  HN      2 ALA  QB      3.44         
  2 ALA  HN      3 ALA  HN      4.14         
  1 SER  HB2     3 ALA  HN      3.97         
  3 ALA  HN      4 GLU  HB3     5.03         
  3 ALA  HN      3 ALA  QB      2.84         
  3 ALA  HN      4 GLU  HN      3.42         
  1 SER  HA      3 ALA  HN      4.83         
  1 SER  HA      4 GLU  HN      4.57         
  3 ALA  HA      4 GLU  HN      3.41         
  1 SER  HB3     4 GLU  HN      4.46         
  4 GLU  HN      4 GLU  HG2     3.53         
  4 GLU  HN      4 GLU  HB2     3.81         
  3 ALA  QB      4 GLU  HN      3.40         
  4 GLU  HN      5 ALA  QB      5.28         
  4 GLU  HA      5 ALA  HN      3.44         
  4 GLU  HB3     5 ALA  HN      4.40         
  4 GLU  HB2     5 ALA  HN      4.31         
  2 ALA  HA      5 ALA  HN      4.71         
  1 SER  HA      5 ALA  HN      5.44         
  5 ALA  QB      6 TYR  HN      3.89         
  6 TYR  HN      6 TYR  HB3     3.00         
  7 ALA  HN      7 ALA  QB      2.89         
  6 TYR  HN      7 ALA  HN      3.12         
  8 LYS  HN      9 ARG  HN      3.22         
  9 ARG  HN     10 ILE  HN      3.59         
  8 LYS  HN      8 LYS  QG      5.11         
  8 LYS  HN      8 LYS  HB2     3.30         
  9 ARG  HN      9 ARG  QD      4.33         
  6 TYR  HA      9 ARG  HN      4.31         
  9 ARG  HN     10 ILE  QD1     5.50         
 10 ILE  QG2    13 ALA  HN      5.11         
  9 ARG  HG3    10 ILE  HN      4.46         
  9 ARG  HG2    10 ILE  HN      4.57         
  8 LYS  QG      9 ARG  HN      5.15         
  9 ARG  HN      9 ARG  HG3     3.74         
  9 ARG  HN      9 ARG  HG2     3.52         
  9 ARG  HN      9 ARG  HB2     3.08         
  9 ARG  HN      9 ARG  HB3     3.38         
 10 ILE  HA     13 ALA  HN      3.67         
 10 ILE  HN     10 ILE  HB      3.14         
 10 ILE  HN     10 ILE  QD1     4.05         
 10 ILE  HN     10 ILE  QG2     3.41         
 10 ILE  HN     10 ILE  HG13    3.02         
 10 ILE  HN     10 ILE  HG12    3.15         
  9 ARG  QD     10 ILE  HN      5.05         
  8 LYS  HN      8 LYS  QD      4.68         
 13 ALA  HN     14 MET  HN      3.34         
 12 GLU  HN     13 ALA  HN      3.19         
 11 ALA  HN     12 GLU  HN      3.12         
 12 GLU  HB2    13 ALA  HN      3.85         
 13 ALA  HN     13 ALA  QB      2.94         
 12 GLU  HG3    13 ALA  HN      4.67         
 12 GLU  HN     12 GLU  HG2     3.24         
 12 GLU  HN     12 GLU  HB2     2.90         
 12 GLU  HN     12 GLU  HB3     3.26         
 13 ALA  QB     14 MET  HN      3.72         
 14 MET  HN     14 MET  QB      2.86         
 14 MET  HN     14 MET  HG3     3.75         
 14 MET  HN     14 MET  HG2     3.95         
 11 ALA  HA     14 MET  HN      4.56         
 10 ILE  QG2    14 MET  HN      5.41         
 14 MET  HA     15 ALA  HN      3.10         
 15 ALA  HN     16 LYS  HN      3.94         
 14 MET  QB     15 ALA  HN      3.82         
 11 ALA  QB     12 GLU  HN      3.31         
 11 ALA  HA     12 GLU  HN      3.48         
 10 ILE  HA     12 GLU  HN      4.69         
 15 ALA  QB     16 LYS  HN      3.92         
 16 LYS  HN     16 LYS  HB3     3.56         
  6 TYR  QD     10 ILE  QD1     4.00         
  6 TYR  QD     10 ILE  QG2     5.09         
  6 TYR  QD     10 ILE  HG13    4.54         
  6 TYR  QD     10 ILE  HG12    4.66         
  6 TYR  QE     10 ILE  QD1     3.42         
  6 TYR  QE     10 ILE  QG2     4.41         
  6 TYR  QE     10 ILE  HG13    4.99         
  6 TYR  QE     10 ILE  HG12    4.02         
  6 TYR  QE      7 ALA  HA      5.17         
  6 TYR  QD      7 ALA  HA      3.80         
  6 TYR  QD      7 ALA  HN      3.75         
  6 TYR  HN      6 TYR  QD      3.93         
  4 GLU  HN      4 GLU  HG3     3.67         
  4 GLU  HN      4 GLU  HB3     3.48         
  4 GLU  HG3     5 ALA  HN      4.84         
  4 GLU  HG2     5 ALA  HN      5.47         
  4 GLU  HA      4 GLU  HG2     3.86         
  4 GLU  HA      4 GLU  HG3     4.04         
  8 LYS  HA     11 ALA  QB      3.42         
  5 ALA  HN      5 ALA  QB      3.22         
  6 TYR  HN      6 TYR  HB2     3.23         
 10 ILE  HN     10 ILE  HA      2.83         
 10 ILE  HA     10 ILE  HB      3.01         
 10 ILE  HA     10 ILE  QD1     3.07         
 10 ILE  HB     10 ILE  QD1     3.33         
 10 ILE  HG13   11 ALA  HN      3.55         
 10 ILE  HA     10 ILE  HG13    3.41         
 10 ILE  HA     10 ILE  HG12    3.63         
 10 ILE  HA     10 ILE  QG2     2.90         
 10 ILE  QG2    10 ILE  QD1     3.37         
 10 ILE  QG2    10 ILE  HG12    3.89         
 10 ILE  QG2    10 ILE  HG13    3.30         
 11 ALA  HN     11 ALA  QB      3.05         
 10 ILE  QG2    12 GLU  HN      5.50         
 12 GLU  HN     12 GLU  HG3     3.86         
 12 GLU  HA     12 GLU  HG3     3.40         
 12 GLU  HA     12 GLU  HG2     3.75         
 12 GLU  HA     12 GLU  HB3     3.02         
 14 MET  HG3    15 ALA  HN      5.50         
 14 MET  HG2    15 ALA  HN      5.50         
 14 MET  HN     15 ALA  HN      3.80         
 15 ALA  HN     15 ALA  QB      3.17         
  1 SER  HN      4 GLU  HG3     5.50         
 12 GLU  HN     14 MET  HN      4.96         
  7 ALA  HA     10 ILE  HG13    3.56         
  7 ALA  HA     10 ILE  HG12    4.06         
  7 ALA  HA     10 ILE  HB      3.18         
  9 ARG  HA      9 ARG  HG2     3.77         
  8 LYS  HA      8 LYS  QD      4.57         
  7 ALA  HA     10 ILE  QD1     3.91         
  7 ALA  HA     10 ILE  QG2     3.99         
 10 ILE  QG2    11 ALA  HA      3.74         
 16 LYS  HG2    16 LYS  QD      2.40         
  8 LYS  QG      8 LYS  QD      2.47         
  8 LYS  HB3     8 LYS  QG      2.75         
 16 LYS  HG3    16 LYS  QD      2.67         
  5 ALA  HA      8 LYS  HB3     4.95         
 12 GLU  HA     15 ALA  QB      3.46         
 10 ILE  HA     13 ALA  QB      3.07         
  9 ARG  HB2     9 ARG  HG2     2.93         
  9 ARG  HB3     9 ARG  HG2     2.71         
  9 ARG  HB2    10 ILE  HN      4.08         
 12 GLU  HB3    13 ALA  HN      4.18         
  2 ALA  HA      5 ALA  QB      4.40         
  6 TYR  HA      9 ARG  HG2     4.79         
  6 TYR  HA      9 ARG  HG3     5.50         
  6 TYR  HB2     7 ALA  HN      3.68         
  6 TYR  HB3     7 ALA  HN      3.62         
  9 ARG  HG3     9 ARG  QD      3.00         
  9 ARG  HB3     9 ARG  QD      3.77         
  9 ARG  HA      9 ARG  QD      3.86         
  8 LYS  HA      8 LYS  QG      3.50         
  4 GLU  HA      7 ALA  QB      3.59         
 14 MET  HA     14 MET  HG2     4.12         
  5 ALA  HA      8 LYS  HB2     4.30         
 11 ALA  HA     14 MET  QB      3.63         
 13 ALA  HA     16 LYS  HB2     3.86         
 12 GLU  HA     13 ALA  HN      3.50         
 12 GLU  HA     15 ALA  HN      4.26         
  7 ALA  HA      9 ARG  HN      5.02         
 12 GLU  HA     14 MET  HN      4.21         
  3 ALA  HA      6 TYR  QD      3.21         
  1 SER  HB3     3 ALA  HN      5.04         
  1 SER  HB2     4 GLU  HN      5.18         
 10 ILE  QG2    14 MET  HG2     4.33         
 10 ILE  QG2    14 MET  HG3     4.59         
  9 ARG  HB2     9 ARG  QD      4.06         
  8 LYS  HA      8 LYS  QE      5.21         
 11 ALA  HA     14 MET  HG2     4.41         
 11 ALA  HA     14 MET  HG3     5.35         
  8 LYS  QG      8 LYS  QE      4.09         
  9 ARG  HB3    10 ILE  HN      3.81         
 10 ILE  HA     14 MET  HN      4.92         

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   SER   1           HA       SER   1  14.137  10.745  11.668
    2    HG   SER   1           HG       SER   1  10.922  10.931  11.022
    3    H1   SER   1           1H       SER   1  14.127   9.647   8.943
    4    HB2  SER   1           1HB      SER   1  11.952   9.265  10.291
    5    HB3  SER   1           2HB      SER   1  12.254   8.870  11.983
    6    H    ALA   2           H        ALA   2  14.430   9.083  13.342
    7    HA   ALA   2           HA       ALA   2  16.625   7.437  12.826
    8    HB1  ALA   2           3HB      ALA   2  16.478   6.737  15.047
    9    HB2  ALA   2           1HB      ALA   2  15.764   8.350  15.061
   10    HB3  ALA   2           2HB      ALA   2  14.725   6.924  15.088
   11    H    ALA   3           H        ALA   3  13.177   6.644  13.063
   12    HA   ALA   3           HA       ALA   3  13.523   3.845  12.703
   13    HB1  ALA   3           3HB      ALA   3  11.369   5.622  13.216
   14    HB2  ALA   3           1HB      ALA   3  10.942   4.628  11.823
   15    HB3  ALA   3           2HB      ALA   3  11.401   3.863  13.345
   16    H    GLU   4           H        GLU   4  13.626   6.495  10.562
   17    HA   GLU   4           HA       GLU   4  12.894   4.939   8.219
   18    HB2  GLU   4           1HB      GLU   4  13.907   7.780   8.441
   19    HB3  GLU   4           2HB      GLU   4  13.297   7.021   6.977
   20    HG2  GLU   4           1HG      GLU   4  11.559   7.118   9.392
   21    HG3  GLU   4           2HG      GLU   4  11.772   8.572   8.419
   22    H    ALA   5           H        ALA   5  15.711   5.826   9.974
   23    HA   ALA   5           HA       ALA   5  17.498   5.251   7.742
   24    HB1  ALA   5           3HB      ALA   5  19.221   5.677   9.692
   25    HB2  ALA   5           1HB      ALA   5  18.403   7.013   8.881
   26    HB3  ALA   5           2HB      ALA   5  17.823   6.445  10.447
   27    H    TYR   6           H        TYR   6  16.357   3.830  10.727
   28    HA   TYR   6           HA       TYR   6  18.308   1.725  10.769
   29    HD1  TYR   6           HD2      TYR   6  18.305  -0.287  13.007
   30    HD2  TYR   6           HD1      TYR   6  14.239   0.744  12.297
   31    HE1  TYR   6           HE2      TYR   6  17.625  -2.567  13.626
   32    HE2  TYR   6           HE1      TYR   6  13.547  -1.533  12.915
   33    HH   TYR   6           HH       TYR   6  14.684  -3.438  14.488
   34    HB2  TYR   6           1HB      TYR   6  17.529   2.094  12.900
   35    HB3  TYR   6           2HB      TYR   6  15.891   2.442  12.359
   36    H    ALA   7           H        ALA   7  14.761   1.457  10.582
   37    HA   ALA   7           HA       ALA   7  14.514  -1.077   9.662
   38    HB1  ALA   7           3HB      ALA   7  12.903   1.381   9.160
   39    HB2  ALA   7           1HB      ALA   7  12.492  -0.108   8.309
   40    HB3  ALA   7           2HB      ALA   7  12.491  -0.070  10.073
   41    H    LYS   8           H        LYS   8  15.331   1.762   7.734
   42    HA   LYS   8           HA       LYS   8  15.087   0.892   5.174
   43    HB2  LYS   8           1HB      LYS   8  16.273   3.032   6.322
   44    HB3  LYS   8           2HB      LYS   8  17.696   2.159   5.768
   45    HG2  LYS   8           1HG      LYS   8  17.232   3.543   3.986
   46    HG3  LYS   8           2HG      LYS   8  16.446   2.037   3.507
   47    HD2  LYS   8           1HD      LYS   8  14.368   2.914   3.679
   48    HD3  LYS   8           2HD      LYS   8  14.791   3.911   5.073
   49    HE2  LYS   8           1HE      LYS   8  16.185   4.784   2.701
   50    HE3  LYS   8           2HE      LYS   8  14.442   4.753   2.437
   51    HZ1  LYS   8           3HZ      LYS   8  14.735   5.884   4.904
   52    HZ2  LYS   8           1HZ      LYS   8  14.410   6.707   3.462
   53    HZ3  LYS   8           2HZ      LYS   8  16.003   6.555   4.008
   54    H    ARG   9           H        ARG   9  18.065   0.439   7.092
   55    HA   ARG   9           HA       ARG   9  19.357  -1.244   5.281
   56    HE   ARG   9           HE       ARG   9  21.367   2.598   7.374
   57    HB2  ARG   9           1HB      ARG   9  19.811  -1.718   8.177
   58    HB3  ARG   9           2HB      ARG   9  20.974  -1.479   6.879
   59    HG2  ARG   9           1HG      ARG   9  19.882   0.971   6.963
   60    HG3  ARG   9           2HG      ARG   9  19.673   0.485   8.647
   61    HD2  ARG   9           1HD      ARG   9  21.878   0.581   9.076
   62    HD3  ARG   9           2HD      ARG   9  22.311  -0.121   7.518
   63   HH11  ARG   9          2HH1      ARG   9  24.130   0.522   7.795
   64   HH12  ARG   9          1HH1      ARG   9  25.271   1.716   7.270
   65   HH21  ARG   9          2HH2      ARG   9  22.859   4.178   6.681
   66   HH22  ARG   9          1HH2      ARG   9  24.547   3.796   6.638
   67    H    ILE  10           H        ILE  10  17.708  -2.213   8.296
   68    HA   ILE  10           HA       ILE  10  17.804  -4.883   8.220
   69    HB   ILE  10           HB       ILE  10  15.078  -3.709   8.593
   70   HG12  ILE  10          1HG1      ILE  10  16.377  -2.016   9.627
   71   HG13  ILE  10          2HG1      ILE  10  15.861  -3.075  10.935
   72   HG21  ILE  10          1HG2      ILE  10  15.183  -5.237  10.596
   73   HG22  ILE  10          2HG2      ILE  10  15.234  -6.032   9.024
   74   HG23  ILE  10          3HG2      ILE  10  16.716  -5.831   9.959
   75   HD11  ILE  10          3HD1      ILE  10  18.493  -2.316  10.169
   76   HD12  ILE  10          1HD1      ILE  10  17.970  -3.282  11.548
   77   HD13  ILE  10          2HD1      ILE  10  18.326  -4.064  10.008
   78    H    ALA  11           H        ALA  11  14.965  -3.305   6.753
   79    HA   ALA  11           HA       ALA  11  13.845  -5.306   5.380
   80    HB1  ALA  11           3HB      ALA  11  14.120  -2.429   4.848
   81    HB2  ALA  11           1HB      ALA  11  13.665  -3.413   3.457
   82    HB3  ALA  11           2HB      ALA  11  12.677  -3.440   4.919
   83    H    GLU  12           H        GLU  12  16.675  -3.489   4.233
   84    HA   GLU  12           HA       GLU  12  16.969  -4.841   1.786
   85    HB2  GLU  12           1HB      GLU  12  18.544  -2.988   3.410
   86    HB3  GLU  12           2HB      GLU  12  19.535  -4.115   2.495
   87    HG2  GLU  12           1HG      GLU  12  17.893  -3.388   0.546
   88    HG3  GLU  12           2HG      GLU  12  17.760  -1.944   1.547
   89    H    ALA  13           H        ALA  13  18.944  -5.231   4.734
   90    HA   ALA  13           HA       ALA  13  20.334  -7.492   3.972
   91    HB1  ALA  13           3HB      ALA  13  19.695  -6.179   6.514
   92    HB2  ALA  13           1HB      ALA  13  20.071  -7.898   6.646
   93    HB3  ALA  13           2HB      ALA  13  21.232  -6.795   5.906
   94    H    MET  14           H        MET  14  17.024  -7.196   4.914
   95    HA   MET  14           HA       MET  14  16.699 -10.024   5.459
   96    HB2  MET  14           1HB      MET  14  14.697  -7.767   5.283
   97    HB3  MET  14           2HB      MET  14  14.290  -9.423   5.712
   98    HG2  MET  14           1HG      MET  14  16.376  -8.723   7.419
   99    HG3  MET  14           2HG      MET  14  15.335  -7.303   7.350
  100    HE1  MET  14           3HE      MET  14  15.770  -9.135  10.147
  101    HE2  MET  14           1HE      MET  14  14.832 -10.629  10.111
  102    HE3  MET  14           2HE      MET  14  16.160 -10.394   8.973
  103    H    ALA  15           H        ALA  15  17.521  -8.890   2.763
  104    HA   ALA  15           HA       ALA  15  15.498 -10.341   1.190
  105    HB1  ALA  15           3HB      ALA  15  15.419  -7.808   0.946
  106    HB2  ALA  15           1HB      ALA  15  16.968  -7.952   0.115
  107    HB3  ALA  15           2HB      ALA  15  15.539  -8.752  -0.539
  108    H    LYS  16           H        LYS  16  18.691  -8.845   0.638
  109    HA   LYS  16           HA       LYS  16  20.452  -9.612  -0.633
  110    HB2  LYS  16           1HB      LYS  16  20.753 -10.518   1.702
  111    HB3  LYS  16           2HB      LYS  16  20.082 -12.039   1.127
  112    HG2  LYS  16           1HG      LYS  16  21.911 -12.189  -0.519
  113    HG3  LYS  16           2HG      LYS  16  22.602 -10.710   0.152
  114    HD2  LYS  16           1HD      LYS  16  23.640 -11.901   1.715
  115    HD3  LYS  16           2HD      LYS  16  22.087 -12.502   2.298
  116    HE2  LYS  16           1HE      LYS  16  22.891 -14.513   1.711
  117    HE3  LYS  16           2HE      LYS  16  22.452 -14.024   0.075
  118    HZ1  LYS  16           3HZ      LYS  16  24.585 -14.405  -0.390
  119    HZ2  LYS  16           1HZ      LYS  16  25.053 -14.405   1.236
  120    HZ3  LYS  16           2HZ      LYS  16  24.911 -12.943   0.397
  121    H    GLY  17           H        GLY  17  18.327  -9.931  -2.211
  122    HA2  GLY  17           1HA      GLY  17  18.492 -12.701  -3.216
  123    HA3  GLY  17           2HA      GLY  17  17.128 -11.624  -3.478
  Start of MODEL    2
    1    HA   SER   1           HA       SER   1  15.068  10.634  12.269
    2    HG   SER   1           HG       SER   1  12.809  10.483  13.853
    3    H1   SER   1           1H       SER   1  13.878  10.118   9.754
    4    HB2  SER   1           1HB      SER   1  12.579  10.391  11.744
    5    HB3  SER   1           2HB      SER   1  12.848   8.648  11.777
    6    H    ALA   2           H        ALA   2  15.061   8.680  13.928
    7    HA   ALA   2           HA       ALA   2  17.226   6.992  13.119
    8    HB1  ALA   2           3HB      ALA   2  16.806   5.992  15.457
    9    HB2  ALA   2           1HB      ALA   2  17.361   7.663  15.340
   10    HB3  ALA   2           2HB      ALA   2  15.659   7.318  15.651
   11    H    ALA   3           H        ALA   3  13.803   6.705  13.148
   12    HA   ALA   3           HA       ALA   3  13.868   3.791  13.033
   13    HB1  ALA   3           3HB      ALA   3  11.502   3.854  13.204
   14    HB2  ALA   3           1HB      ALA   3  12.127   5.048  14.343
   15    HB3  ALA   3           2HB      ALA   3  11.451   5.570  12.799
   16    H    GLU   4           H        GLU   4  13.959   6.446  10.924
   17    HA   GLU   4           HA       GLU   4  12.802   4.977   8.684
   18    HB2  GLU   4           1HB      GLU   4  12.621   6.982   7.576
   19    HB3  GLU   4           2HB      GLU   4  12.524   7.535   9.242
   20    HG2  GLU   4           1HG      GLU   4  14.831   8.195   9.216
   21    HG3  GLU   4           2HG      GLU   4  15.050   7.503   7.610
   22    H    ALA   5           H        ALA   5  15.859   5.768  10.049
   23    HA   ALA   5           HA       ALA   5  17.305   5.147   7.592
   24    HB1  ALA   5           3HB      ALA   5  19.243   5.951   8.653
   25    HB2  ALA   5           1HB      ALA   5  17.950   7.035   9.169
   26    HB3  ALA   5           2HB      ALA   5  18.535   5.778  10.260
   27    H    TYR   6           H        TYR   6  16.395   3.697  10.604
   28    HA   TYR   6           HA       TYR   6  18.339   1.573  10.466
   29    HD1  TYR   6           HD2      TYR   6  18.503  -0.488  12.614
   30    HD2  TYR   6           HD1      TYR   6  14.418   0.689  12.442
   31    HE1  TYR   6           HE2      TYR   6  17.827  -2.758  13.278
   32    HE2  TYR   6           HE1      TYR   6  13.731  -1.577  13.106
   33    HH   TYR   6           HH       TYR   6  15.761  -4.214  13.015
   34    HB2  TYR   6           1HB      TYR   6  17.785   1.930  12.667
   35    HB3  TYR   6           2HB      TYR   6  16.110   2.325  12.294
   36    H    ALA   7           H        ALA   7  14.783   1.394  10.607
   37    HA   ALA   7           HA       ALA   7  14.419  -1.140   9.685
   38    HB1  ALA   7           3HB      ALA   7  12.219  -0.345   8.783
   39    HB2  ALA   7           1HB      ALA   7  12.548   0.113  10.455
   40    HB3  ALA   7           2HB      ALA   7  12.733   1.299   9.162
   41    H    LYS   8           H        LYS   8  15.248   1.691   7.806
   42    HA   LYS   8           HA       LYS   8  14.636   0.868   5.240
   43    HB2  LYS   8           1HB      LYS   8  15.681   3.085   6.112
   44    HB3  LYS   8           2HB      LYS   8  17.220   2.281   5.828
   45    HG2  LYS   8           1HG      LYS   8  16.850   3.482   3.877
   46    HG3  LYS   8           2HG      LYS   8  16.333   1.846   3.462
   47    HD2  LYS   8           1HD      LYS   8  13.991   2.700   4.248
   48    HD3  LYS   8           2HD      LYS   8  14.689   4.294   3.949
   49    HE2  LYS   8           1HE      LYS   8  14.886   3.928   1.682
   50    HE3  LYS   8           2HE      LYS   8  14.942   2.175   1.863
   51    HZ1  LYS   8           3HZ      LYS   8  12.743   2.032   1.673
   52    HZ2  LYS   8           1HZ      LYS   8  12.771   3.630   1.118
   53    HZ3  LYS   8           2HZ      LYS   8  12.463   3.306   2.749
   54    H    ARG   9           H        ARG   9  17.808   0.484   6.835
   55    HA   ARG   9           HA       ARG   9  18.970  -1.125   4.882
   56    HE   ARG   9           HE       ARG   9  20.979   2.634   8.167
   57    HB2  ARG   9           1HB      ARG   9  19.689  -1.653   7.716
   58    HB3  ARG   9           2HB      ARG   9  20.727  -1.361   6.327
   59    HG2  ARG   9           1HG      ARG   9  19.595   1.060   6.560
   60    HG3  ARG   9           2HG      ARG   9  19.545   0.536   8.244
   61    HD2  ARG   9           1HD      ARG   9  21.995  -0.065   7.978
   62    HD3  ARG   9           2HD      ARG   9  21.944   0.821   6.454
   63   HH11  ARG   9          2HH1      ARG   9  23.770   0.559   8.333
   64   HH12  ARG   9          1HH1      ARG   9  24.696   1.664   9.294
   65   HH21  ARG   9          2HH2      ARG   9  22.189   4.097   9.432
   66   HH22  ARG   9          1HH2      ARG   9  23.796   3.676   9.919
   67    H    ILE  10           H        ILE  10  17.537  -2.183   7.976
   68    HA   ILE  10           HA       ILE  10  17.716  -4.848   7.873
   69    HB   ILE  10           HB       ILE  10  14.974  -3.767   8.380
   70   HG12  ILE  10          1HG1      ILE  10  16.263  -2.039   9.368
   71   HG13  ILE  10          2HG1      ILE  10  15.842  -3.123  10.689
   72   HG21  ILE  10          1HG2      ILE  10  15.218  -5.304  10.363
   73   HG22  ILE  10          2HG2      ILE  10  15.227  -6.087   8.784
   74   HG23  ILE  10          3HG2      ILE  10  16.740  -5.843   9.654
   75   HD11  ILE  10          3HD1      ILE  10  18.251  -4.109   9.780
   76   HD12  ILE  10          1HD1      ILE  10  18.438  -2.359   9.668
   77   HD13  ILE  10          2HD1      ILE  10  17.998  -3.102  11.206
   78    H    ALA  11           H        ALA  11  14.764  -3.355   6.550
   79    HA   ALA  11           HA       ALA  11  13.647  -5.383   5.214
   80    HB1  ALA  11           3HB      ALA  11  13.695  -2.513   4.848
   81    HB2  ALA  11           1HB      ALA  11  13.467  -3.364   3.319
   82    HB3  ALA  11           2HB      ALA  11  12.361  -3.652   4.663
   83    H    GLU  12           H        GLU  12  16.358  -3.464   3.951
   84    HA   GLU  12           HA       GLU  12  16.584  -4.789   1.483
   85    HB2  GLU  12           1HB      GLU  12  18.172  -2.899   3.049
   86    HB3  GLU  12           2HB      GLU  12  19.157  -3.989   2.084
   87    HG2  GLU  12           1HG      GLU  12  17.408  -3.301   0.214
   88    HG3  GLU  12           2HG      GLU  12  17.275  -1.868   1.232
   89    H    ALA  13           H        ALA  13  18.701  -5.141   4.336
   90    HA   ALA  13           HA       ALA  13  20.126  -7.350   3.491
   91    HB1  ALA  13           3HB      ALA  13  21.069  -6.581   5.388
   92    HB2  ALA  13           1HB      ALA  13  19.521  -6.121   6.099
   93    HB3  ALA  13           2HB      ALA  13  20.048  -7.804   6.147
   94    H    MET  14           H        MET  14  16.831  -7.171   4.331
   95    HA   MET  14           HA       MET  14  16.615 -10.007   4.962
   96    HB2  MET  14           1HB      MET  14  14.540  -7.814   4.833
   97    HB3  MET  14           2HB      MET  14  14.191  -9.484   5.260
   98    HG2  MET  14           1HG      MET  14  16.107  -9.026   7.036
   99    HG3  MET  14           2HG      MET  14  15.553  -7.367   6.816
  100    HE1  MET  14           3HE      MET  14  12.587  -7.509   6.265
  101    HE2  MET  14           1HE      MET  14  11.805  -7.575   7.845
  102    HE3  MET  14           2HE      MET  14  13.158  -6.476   7.577
  103    H    ALA  15           H        ALA  15  17.375  -8.897   2.261
  104    HA   ALA  15           HA       ALA  15  15.373 -10.407   0.724
  105    HB1  ALA  15           3HB      ALA  15  16.556  -7.731   0.016
  106    HB2  ALA  15           1HB      ALA  15  15.729  -8.767  -1.148
  107    HB3  ALA  15           2HB      ALA  15  14.856  -8.138   0.251
  108    H    LYS  16           H        LYS  16  18.048 -11.072   1.816
  109    HA   LYS  16           HA       LYS  16  19.399 -11.693  -0.729
  110    HB2  LYS  16           1HB      LYS  16  20.420 -10.272   1.452
  111    HB3  LYS  16           2HB      LYS  16  21.133 -11.874   1.587
  112    HG2  LYS  16           1HG      LYS  16  21.430 -11.305  -1.081
  113    HG3  LYS  16           2HG      LYS  16  21.679  -9.737  -0.310
  114    HD2  LYS  16           1HD      LYS  16  23.084 -11.557   1.271
  115    HD3  LYS  16           2HD      LYS  16  23.414 -12.045  -0.393
  116    HE2  LYS  16           1HE      LYS  16  25.075 -10.490  -0.031
  117    HE3  LYS  16           2HE      LYS  16  23.817  -9.494  -0.761
  118    HZ1  LYS  16           3HZ      LYS  16  24.909  -9.414   1.905
  119    HZ2  LYS  16           1HZ      LYS  16  23.218  -9.356   1.861
  120    HZ3  LYS  16           2HZ      LYS  16  24.127  -8.204   1.019
  121    H    GLY  17           H        GLY  17  20.977 -13.639  -0.361
  122    HA2  GLY  17           1HA      GLY  17  20.187 -15.608   1.554
  123    HA3  GLY  17           2HA      GLY  17  19.506 -15.941  -0.032
  Start of MODEL    3
    1    HA   SER   1           HA       SER   1  14.022  10.407  12.270
    2    HG   SER   1           HG       SER   1  12.252  10.182  13.593
    3    H1   SER   1           1H       SER   1  13.241   9.839   9.584
    4    HB2  SER   1           1HB      SER   1  11.720   9.345  10.938
    5    HB3  SER   1           2HB      SER   1  12.179   8.245  12.236
    6    H    ALA   2           H        ALA   2  14.048   8.469  13.876
    7    HA   ALA   2           HA       ALA   2  16.361   6.911  13.236
    8    HB1  ALA   2           3HB      ALA   2  15.868   5.893  15.531
    9    HB2  ALA   2           1HB      ALA   2  16.254   7.613  15.463
   10    HB3  ALA   2           2HB      ALA   2  14.578   7.091  15.642
   11    H    ALA   3           H        ALA   3  12.961   6.422  13.031
   12    HA   ALA   3           HA       ALA   3  13.190   3.521  12.935
   13    HB1  ALA   3           3HB      ALA   3  11.155   5.278  13.672
   14    HB2  ALA   3           1HB      ALA   3  10.603   4.536  12.170
   15    HB3  ALA   3           2HB      ALA   3  11.052   3.522  13.542
   16    H    GLU   4           H        GLU   4  13.454   6.119  10.810
   17    HA   GLU   4           HA       GLU   4  12.590   4.551   8.490
   18    HB2  GLU   4           1HB      GLU   4  12.303   6.515   7.347
   19    HB3  GLU   4           2HB      GLU   4  12.040   7.091   8.987
   20    HG2  GLU   4           1HG      GLU   4  14.283   7.943   9.105
   21    HG3  GLU   4           2HG      GLU   4  14.670   7.243   7.534
   22    H    ALA   5           H        ALA   5  15.405   5.641  10.137
   23    HA   ALA   5           HA       ALA   5  17.149   5.170   7.850
   24    HB1  ALA   5           3HB      ALA   5  18.544   6.579   8.854
   25    HB2  ALA   5           1HB      ALA   5  17.294   6.848  10.069
   26    HB3  ALA   5           2HB      ALA   5  18.536   5.625  10.337
   27    H    TYR   6           H        TYR   6  15.995   3.554  10.667
   28    HA   TYR   6           HA       TYR   6  18.139   1.603  10.702
   29    HD1  TYR   6           HD1      TYR   6  18.302  -0.534  12.555
   30    HD2  TYR   6           HD2      TYR   6  14.174   0.491  12.687
   31    HE1  TYR   6           HE1      TYR   6  17.751  -2.854  13.159
   32    HE2  TYR   6           HE2      TYR   6  13.612  -1.826  13.292
   33    HH   TYR   6           HH       TYR   6  15.870  -4.049  14.350
   34    HB2  TYR   6           1HB      TYR   6  17.411   1.899  12.861
   35    HB3  TYR   6           2HB      TYR   6  15.742   2.175  12.377
   36    H    ALA   7           H        ALA   7  14.611   1.127  10.649
   37    HA   ALA   7           HA       ALA   7  14.522  -1.405   9.649
   38    HB1  ALA   7           3HB      ALA   7  12.505  -0.390  10.361
   39    HB2  ALA   7           1HB      ALA   7  12.644   0.894   9.159
   40    HB3  ALA   7           2HB      ALA   7  12.297  -0.759   8.649
   41    H    LYS   8           H        LYS   8  15.039   1.569   7.848
   42    HA   LYS   8           HA       LYS   8  14.630   0.834   5.258
   43    HB2  LYS   8           1HB      LYS   8  15.344   3.055   5.724
   44    HB3  LYS   8           2HB      LYS   8  16.844   2.496   6.453
   45    HG2  LYS   8           1HG      LYS   8  17.892   2.326   4.477
   46    HG3  LYS   8           2HG      LYS   8  16.461   1.701   3.654
   47    HD2  LYS   8           1HD      LYS   8  15.607   3.838   3.261
   48    HD3  LYS   8           2HD      LYS   8  16.627   4.574   4.500
   49    HE2  LYS   8           1HE      LYS   8  18.608   4.060   3.098
   50    HE3  LYS   8           2HE      LYS   8  17.524   3.464   1.843
   51    HZ1  LYS   8           3HZ      LYS   8  16.528   5.660   1.709
   52    HZ2  LYS   8           1HZ      LYS   8  18.194   5.746   1.426
   53    HZ3  LYS   8           2HZ      LYS   8  17.563   6.232   2.918
   54    H    ARG   9           H        ARG   9  17.808   0.521   6.857
   55    HA   ARG   9           HA       ARG   9  19.018  -1.008   4.871
   56    HE   ARG   9           HE       ARG   9  21.209   2.332   5.927
   57    HB2  ARG   9           1HB      ARG   9  19.775  -1.556   7.692
   58    HB3  ARG   9           2HB      ARG   9  20.793  -1.202   6.302
   59    HG2  ARG   9           1HG      ARG   9  19.570   1.170   6.581
   60    HG3  ARG   9           2HG      ARG   9  19.551   0.618   8.257
   61    HD2  ARG   9           1HD      ARG   9  21.701   1.127   8.479
   62    HD3  ARG   9           2HD      ARG   9  22.114   0.073   7.127
   63   HH11  ARG   9          2HH1      ARG   9  23.631   1.679   8.341
   64   HH12  ARG   9          1HH1      ARG   9  24.634   3.016   7.884
   65   HH21  ARG   9          2HH2      ARG   9  22.521   4.095   5.315
   66   HH22  ARG   9          1HH2      ARG   9  24.001   4.390   6.163
   67    H    ILE  10           H        ILE  10  17.675  -2.185   7.963
   68    HA   ILE  10           HA       ILE  10  17.952  -4.838   7.795
   69    HB   ILE  10           HB       ILE  10  15.183  -3.874   8.381
   70   HG12  ILE  10          1HG1      ILE  10  16.426  -2.121   9.383
   71   HG13  ILE  10          2HG1      ILE  10  16.073  -3.250  10.687
   72   HG21  ILE  10          1HG2      ILE  10  15.527  -5.445  10.323
   73   HG22  ILE  10          2HG2      ILE  10  15.527  -6.191   8.726
   74   HG23  ILE  10          3HG2      ILE  10  17.051  -5.911   9.568
   75   HD11  ILE  10          3HD1      ILE  10  18.524  -4.063   9.608
   76   HD12  ILE  10          1HD1      ILE  10  18.598  -2.306   9.733
   77   HD13  ILE  10          2HD1      ILE  10  18.230  -3.277  11.159
   78    H    ALA  11           H        ALA  11  14.919  -3.429   6.566
   79    HA   ALA  11           HA       ALA  11  13.850  -5.466   5.205
   80    HB1  ALA  11           3HB      ALA  11  13.472  -3.490   3.355
   81    HB2  ALA  11           1HB      ALA  11  12.511  -3.716   4.817
   82    HB3  ALA  11           2HB      ALA  11  13.852  -2.570   4.811
   83    H    GLU  12           H        GLU  12  16.464  -3.421   3.932
   84    HA   GLU  12           HA       GLU  12  16.688  -4.683   1.431
   85    HB2  GLU  12           1HB      GLU  12  18.237  -2.770   3.009
   86    HB3  GLU  12           2HB      GLU  12  19.241  -3.802   2.000
   87    HG2  GLU  12           1HG      GLU  12  17.431  -3.139   0.181
   88    HG3  GLU  12           2HG      GLU  12  17.268  -1.733   1.232
   89    H    ALA  13           H        ALA  13  18.875  -5.018   4.233
   90    HA   ALA  13           HA       ALA  13  20.332  -7.181   3.289
   91    HB1  ALA  13           3HB      ALA  13  20.314  -7.598   5.996
   92    HB2  ALA  13           1HB      ALA  13  21.393  -6.500   5.134
   93    HB3  ALA  13           2HB      ALA  13  19.913  -5.885   5.870
   94    H    MET  14           H        MET  14  17.089  -7.079   4.348
   95    HA   MET  14           HA       MET  14  17.008  -9.964   4.844
   96    HB2  MET  14           1HB      MET  14  15.009  -7.756   5.319
   97    HB3  MET  14           2HB      MET  14  14.605  -9.458   5.498
   98    HG2  MET  14           1HG      MET  14  16.954  -9.073   6.969
   99    HG3  MET  14           2HG      MET  14  15.920  -7.693   7.331
  100    HE1  MET  14           3HE      MET  14  16.468 -11.277   7.081
  101    HE2  MET  14           1HE      MET  14  15.777 -11.921   8.571
  102    HE3  MET  14           2HE      MET  14  14.813 -11.889   7.094
  103    H    ALA  15           H        ALA  15  17.383  -8.738   2.172
  104    HA   ALA  15           HA       ALA  15  15.056  -9.975   0.856
  105    HB1  ALA  15           3HB      ALA  15  14.674  -8.203  -0.467
  106    HB2  ALA  15           1HB      ALA  15  15.536  -7.305   0.782
  107    HB3  ALA  15           2HB      ALA  15  16.390  -7.849  -0.662
  108    H    LYS  16           H        LYS  16  18.478  -9.115   0.628
  109    HA   LYS  16           HA       LYS  16  19.281 -10.154  -1.726
  110    HB2  LYS  16           1HB      LYS  16  21.417 -10.403  -0.832
  111    HB3  LYS  16           2HB      LYS  16  20.677  -9.231   0.251
  112    HG2  LYS  16           1HG      LYS  16  20.042 -11.454   1.571
  113    HG3  LYS  16           2HG      LYS  16  21.494 -12.029   0.749
  114    HD2  LYS  16           1HD      LYS  16  21.582  -9.387   2.122
  115    HD3  LYS  16           2HD      LYS  16  21.628 -10.852   3.105
  116    HE2  LYS  16           1HE      LYS  16  23.415 -11.142   0.894
  117    HE3  LYS  16           2HE      LYS  16  23.747  -9.614   1.707
  118    HZ1  LYS  16           3HZ      LYS  16  24.897 -11.757   2.523
  119    HZ2  LYS  16           1HZ      LYS  16  23.421 -12.077   3.286
  120    HZ3  LYS  16           2HZ      LYS  16  24.281 -10.672   3.666
  121    H    GLY  17           H        GLY  17  18.196 -11.984   1.060
  122    HA2  GLY  17           1HA      GLY  17  19.066 -14.536   0.242
  123    HA3  GLY  17           2HA      GLY  17  17.736 -14.214   1.345
  Start of MODEL    4
    1    HA   SER   1           HA       SER   1  14.483  10.598  11.285
    2    HG   SER   1           HG       SER   1  12.277  11.491  11.849
    3    H1   SER   1           1H       SER   1  13.161   9.785   8.969
    4    HB2  SER   1           1HB      SER   1  11.901   9.654  10.607
    5    HB3  SER   1           2HB      SER   1  12.468   8.663  11.951
    6    H    ALA   2           H        ALA   2  14.464   8.949  13.278
    7    HA   ALA   2           HA       ALA   2  16.684   7.277  12.924
    8    HB1  ALA   2           3HB      ALA   2  16.431   6.665  15.178
    9    HB2  ALA   2           1HB      ALA   2  15.813   8.314  15.078
   10    HB3  ALA   2           2HB      ALA   2  14.692   6.954  15.149
   11    H    ALA   3           H        ALA   3  13.223   6.528  13.089
   12    HA   ALA   3           HA       ALA   3  13.605   3.703  12.838
   13    HB1  ALA   3           3HB      ALA   3  11.588   5.069  13.811
   14    HB2  ALA   3           1HB      ALA   3  11.017   5.005  12.144
   15    HB3  ALA   3           2HB      ALA   3  11.327   3.511  13.028
   16    H    GLU   4           H        GLU   4  13.579   6.314  10.645
   17    HA   GLU   4           HA       GLU   4  12.783   4.711   8.358
   18    HB2  GLU   4           1HB      GLU   4  13.773   7.563   8.522
   19    HB3  GLU   4           2HB      GLU   4  13.171   6.782   7.067
   20    HG2  GLU   4           1HG      GLU   4  11.203   6.446   9.056
   21    HG3  GLU   4           2HG      GLU   4  11.723   8.130   9.114
   22    H    ALA   5           H        ALA   5  15.662   5.660   9.985
   23    HA   ALA   5           HA       ALA   5  17.372   5.055   7.705
   24    HB1  ALA   5           3HB      ALA   5  18.714   5.472  10.254
   25    HB2  ALA   5           1HB      ALA   5  18.915   6.311   8.715
   26    HB3  ALA   5           2HB      ALA   5  17.628   6.793   9.822
   27    H    TYR   6           H        TYR   6  16.289   3.627  10.698
   28    HA   TYR   6           HA       TYR   6  18.260   1.543  10.735
   29    HD1  TYR   6           HD2      TYR   6  18.272  -0.542  12.769
   30    HD2  TYR   6           HD1      TYR   6  14.181   0.576  12.434
   31    HE1  TYR   6           HE2      TYR   6  17.603  -2.830  13.374
   32    HE2  TYR   6           HE1      TYR   6  13.500  -1.709  13.039
   33    HH   TYR   6           HH       TYR   6  15.264  -4.269  12.829
   34    HB2  TYR   6           1HB      TYR   6  17.471   1.889  12.864
   35    HB3  TYR   6           2HB      TYR   6  15.832   2.229  12.320
   36    H    ALA   7           H        ALA   7  14.725   1.175  10.596
   37    HA   ALA   7           HA       ALA   7  14.527  -1.342   9.638
   38    HB1  ALA   7           3HB      ALA   7  12.851   1.079   9.124
   39    HB2  ALA   7           1HB      ALA   7  12.458  -0.454   8.345
   40    HB3  ALA   7           2HB      ALA   7  12.497  -0.343  10.105
   41    H    LYS   8           H        LYS   8  15.035   1.555   7.650
   42    HA   LYS   8           HA       LYS   8  14.852   0.694   5.120
   43    HB2  LYS   8           1HB      LYS   8  16.090   2.825   6.332
   44    HB3  LYS   8           2HB      LYS   8  17.440   2.008   5.555
   45    HG2  LYS   8           1HG      LYS   8  15.685   2.004   3.526
   46    HG3  LYS   8           2HG      LYS   8  15.166   3.463   4.373
   47    HD2  LYS   8           1HD      LYS   8  18.039   3.362   4.197
   48    HD3  LYS   8           2HD      LYS   8  17.315   3.195   2.596
   49    HE2  LYS   8           1HE      LYS   8  16.280   5.266   2.708
   50    HE3  LYS   8           2HE      LYS   8  16.344   5.314   4.470
   51    HZ1  LYS   8           3HZ      LYS   8  18.263   6.387   4.378
   52    HZ2  LYS   8           1HZ      LYS   8  18.116   6.479   2.695
   53    HZ3  LYS   8           2HZ      LYS   8  18.959   5.194   3.401
   54    H    ARG   9           H        ARG   9  17.922   0.360   6.914
   55    HA   ARG   9           HA       ARG   9  19.208  -1.280   5.077
   56    HE   ARG   9           HE       ARG   9  20.985   2.612   8.113
   57    HB2  ARG   9           1HB      ARG   9  19.739  -1.757   7.963
   58    HB3  ARG   9           2HB      ARG   9  20.867  -1.493   6.640
   59    HG2  ARG   9           1HG      ARG   9  19.724   0.932   6.747
   60    HG3  ARG   9           2HG      ARG   9  19.560   0.443   8.435
   61    HD2  ARG   9           1HD      ARG   9  21.914   0.101   8.639
   62    HD3  ARG   9           2HD      ARG   9  22.149   0.303   6.903
   63   HH11  ARG   9          2HH1      ARG   9  23.985   0.933   7.566
   64   HH12  ARG   9          1HH1      ARG   9  24.957   2.362   7.685
   65   HH21  ARG   9          2HH2      ARG   9  22.254   4.501   8.271
   66   HH22  ARG   9          1HH2      ARG   9  23.971   4.391   8.086
   67    H    ILE  10           H        ILE  10  17.704  -2.349   8.135
   68    HA   ILE  10           HA       ILE  10  17.876  -5.013   7.999
   69    HB   ILE  10           HB       ILE  10  15.136  -3.931   8.516
   70   HG12  ILE  10          1HG1      ILE  10  16.428  -2.218   9.526
   71   HG13  ILE  10          2HG1      ILE  10  16.002  -3.318  10.834
   72   HG21  ILE  10          1HG2      ILE  10  15.379  -5.492  10.483
   73   HG22  ILE  10          2HG2      ILE  10  15.375  -6.254   8.894
   74   HG23  ILE  10          3HG2      ILE  10  16.895  -6.030   9.760
   75   HD11  ILE  10          3HD1      ILE  10  18.442  -4.235   9.808
   76   HD12  ILE  10          1HD1      ILE  10  18.581  -2.482   9.935
   77   HD13  ILE  10          2HD1      ILE  10  18.144  -3.437  11.352
   78    H    ALA  11           H        ALA  11  14.929  -3.495   6.691
   79    HA   ALA  11           HA       ALA  11  13.809  -5.503   5.327
   80    HB1  ALA  11           3HB      ALA  11  14.086  -2.617   4.619
   81    HB2  ALA  11           1HB      ALA  11  13.287  -3.719   3.497
   82    HB3  ALA  11           2HB      ALA  11  12.659  -3.518   5.133
   83    H    GLU  12           H        GLU  12  16.528  -3.577   4.092
   84    HA   GLU  12           HA       GLU  12  16.754  -4.872   1.608
   85    HB2  GLU  12           1HB      GLU  12  18.345  -3.006   3.201
   86    HB3  GLU  12           2HB      GLU  12  19.328  -4.086   2.223
   87    HG2  GLU  12           1HG      GLU  12  17.586  -3.371   0.359
   88    HG3  GLU  12           2HG      GLU  12  17.454  -1.950   1.394
   89    H    ALA  13           H        ALA  13  18.866  -5.265   4.460
   90    HA   ALA  13           HA       ALA  13  20.289  -7.464   3.593
   91    HB1  ALA  13           3HB      ALA  13  20.340  -7.987   6.173
   92    HB2  ALA  13           1HB      ALA  13  21.163  -6.575   5.510
   93    HB3  ALA  13           2HB      ALA  13  19.586  -6.396   6.280
   94    H    MET  14           H        MET  14  17.044  -7.308   4.860
   95    HA   MET  14           HA       MET  14  16.838 -10.173   5.211
   96    HB2  MET  14           1HB      MET  14  14.805  -7.949   5.422
   97    HB3  MET  14           2HB      MET  14  14.433  -9.644   5.710
   98    HG2  MET  14           1HG      MET  14  16.670  -9.086   7.289
   99    HG3  MET  14           2HG      MET  14  15.595  -7.702   7.472
  100    HE1  MET  14           3HE      MET  14  12.611  -8.809   9.249
  101    HE2  MET  14           1HE      MET  14  14.036  -8.011   9.914
  102    HE3  MET  14           2HE      MET  14  13.478  -7.609   8.290
  103    H    ALA  15           H        ALA  15  17.275  -8.690   2.534
  104    HA   ALA  15           HA       ALA  15  15.156 -10.121   1.068
  105    HB1  ALA  15           3HB      ALA  15  16.218  -7.370   0.706
  106    HB2  ALA  15           1HB      ALA  15  15.751  -8.280  -0.731
  107    HB3  ALA  15           2HB      ALA  15  14.571  -7.979   0.545
  108    H    LYS  16           H        LYS  16  17.871 -10.969   1.896
  109    HA   LYS  16           HA       LYS  16  18.950 -11.527  -0.789
  110    HB2  LYS  16           1HB      LYS  16  20.234 -10.137   1.272
  111    HB3  LYS  16           2HB      LYS  16  20.941 -11.747   1.305
  112    HG2  LYS  16           1HG      LYS  16  21.935 -11.507  -0.721
  113    HG3  LYS  16           2HG      LYS  16  20.680 -10.429  -1.335
  114    HD2  LYS  16           1HD      LYS  16  21.801  -8.603  -0.696
  115    HD3  LYS  16           2HD      LYS  16  22.152  -9.280   0.897
  116    HE2  LYS  16           1HE      LYS  16  23.633 -10.400  -1.413
  117    HE3  LYS  16           2HE      LYS  16  24.050  -8.764  -0.907
  118    HZ1  LYS  16           3HZ      LYS  16  23.824 -10.589   1.292
  119    HZ2  LYS  16           1HZ      LYS  16  25.077  -9.523   0.898
  120    HZ3  LYS  16           2HZ      LYS  16  25.015 -11.055   0.184
  121    H    GLY  17           H        GLY  17  18.656 -13.598  -1.268
  122    HA2  GLY  17           1HA      GLY  17  18.724 -15.567   0.930
  123    HA3  GLY  17           2HA      GLY  17  17.822 -15.771  -0.565
  Start of MODEL    5
    1    HA   SER   1           HA       SER   1  14.334  10.535  11.696
    2    HG   SER   1           HG       SER   1  12.676  10.471  12.893
    3    H1   SER   1           1H       SER   1  14.712   9.161   9.167
    4    HB2  SER   1           1HB      SER   1  12.097   9.554  10.329
    5    HB3  SER   1           2HB      SER   1  12.441   8.343  11.564
    6    H    ALA   2           H        ALA   2  14.240   8.854  13.526
    7    HA   ALA   2           HA       ALA   2  16.560   7.252  13.366
    8    HB1  ALA   2           3HB      ALA   2  15.771   6.378  15.599
    9    HB2  ALA   2           1HB      ALA   2  15.975   8.126  15.485
   10    HB3  ALA   2           2HB      ALA   2  14.360   7.420  15.411
   11    H    ALA   3           H        ALA   3  13.119   6.508  13.139
   12    HA   ALA   3           HA       ALA   3  13.608   3.660  12.944
   13    HB1  ALA   3           3HB      ALA   3  11.089   5.297  12.713
   14    HB2  ALA   3           1HB      ALA   3  11.142   3.539  12.583
   15    HB3  ALA   3           2HB      ALA   3  11.617   4.326  14.088
   16    H    GLU   4           H        GLU   4  13.528   6.321  10.832
   17    HA   GLU   4           HA       GLU   4  12.765   4.768   8.498
   18    HB2  GLU   4           1HB      GLU   4  13.588   7.652   8.845
   19    HB3  GLU   4           2HB      GLU   4  13.214   6.931   7.286
   20    HG2  GLU   4           1HG      GLU   4  11.029   6.268   8.814
   21    HG3  GLU   4           2HG      GLU   4  11.439   7.887   9.377
   22    H    ALA   5           H        ALA   5  15.612   5.726  10.163
   23    HA   ALA   5           HA       ALA   5  17.345   5.266   7.869
   24    HB1  ALA   5           3HB      ALA   5  19.070   5.610   9.897
   25    HB2  ALA   5           1HB      ALA   5  18.339   6.945   9.006
   26    HB3  ALA   5           2HB      ALA   5  17.662   6.444  10.556
   27    H    TYR   6           H        TYR   6  16.222   3.639  10.725
   28    HA   TYR   6           HA       TYR   6  18.253   1.586  10.625
   29    HD1  TYR   6           HD1      TYR   6  18.379  -0.584  12.527
   30    HD2  TYR   6           HD2      TYR   6  14.279   0.555  12.553
   31    HE1  TYR   6           HE1      TYR   6  17.746  -2.896  13.078
   32    HE2  TYR   6           HE2      TYR   6  13.635  -1.754  13.105
   33    HH   TYR   6           HH       TYR   6  14.346  -3.860  13.328
   34    HB2  TYR   6           1HB      TYR   6  17.585   1.849  12.808
   35    HB3  TYR   6           2HB      TYR   6  15.918   2.206  12.370
   36    H    ALA   7           H        ALA   7  14.702   1.300  10.596
   37    HA   ALA   7           HA       ALA   7  14.412  -1.196   9.597
   38    HB1  ALA   7           3HB      ALA   7  12.793   1.278   9.289
   39    HB2  ALA   7           1HB      ALA   7  12.357  -0.134   8.326
   40    HB3  ALA   7           2HB      ALA   7  12.395  -0.243  10.087
   41    H    LYS   8           H        LYS   8  15.116   1.711   7.715
   42    HA   LYS   8           HA       LYS   8  14.793   0.889   5.147
   43    HB2  LYS   8           1HB      LYS   8  15.580   3.113   5.661
   44    HB3  LYS   8           2HB      LYS   8  17.090   2.477   6.301
   45    HG2  LYS   8           1HG      LYS   8  17.296   1.484   3.864
   46    HG3  LYS   8           2HG      LYS   8  16.214   2.827   3.487
   47    HD2  LYS   8           1HD      LYS   8  17.790   4.397   4.475
   48    HD3  LYS   8           2HD      LYS   8  18.858   3.065   4.926
   49    HE2  LYS   8           1HE      LYS   8  18.226   2.920   2.129
   50    HE3  LYS   8           2HE      LYS   8  18.836   4.526   2.524
   51    HZ1  LYS   8           3HZ      LYS   8  20.876   3.732   2.998
   52    HZ2  LYS   8           1HZ      LYS   8  20.410   2.466   1.977
   53    HZ3  LYS   8           2HZ      LYS   8  20.300   2.283   3.654
   54    H    ARG   9           H        ARG   9  17.832   0.453   6.969
   55    HA   ARG   9           HA       ARG   9  19.124  -1.132   5.072
   56    HE   ARG   9           HE       ARG   9  21.819   2.439   8.936
   57    HB2  ARG   9           1HB      ARG   9  19.648  -1.701   7.939
   58    HB3  ARG   9           2HB      ARG   9  20.778  -1.389   6.629
   59    HG2  ARG   9           1HG      ARG   9  19.634   1.031   6.824
   60    HG3  ARG   9           2HG      ARG   9  19.470   0.479   8.493
   61    HD2  ARG   9           1HD      ARG   9  21.812   0.162   8.708
   62    HD3  ARG   9           2HD      ARG   9  22.065   0.360   6.974
   63   HH11  ARG   9          2HH1      ARG   9  21.411   1.628   5.575
   64   HH12  ARG   9          1HH1      ARG   9  21.582   3.261   5.025
   65   HH21  ARG   9          2HH2      ARG   9  22.047   4.594   8.224
   66   HH22  ARG   9          1HH2      ARG   9  21.945   4.948   6.533
   67    H    ILE  10           H        ILE  10  17.595  -2.264   8.094
   68    HA   ILE  10           HA       ILE  10  17.739  -4.919   7.914
   69    HB   ILE  10           HB       ILE  10  14.993  -3.829   8.378
   70   HG12  ILE  10          1HG1      ILE  10  16.283  -2.143   9.445
   71   HG13  ILE  10          2HG1      ILE  10  15.794  -3.251  10.722
   72   HG21  ILE  10          1HG2      ILE  10  15.205  -6.159   8.723
   73   HG22  ILE  10          2HG2      ILE  10  16.706  -5.962   9.626
   74   HG23  ILE  10          3HG2      ILE  10  15.179  -5.425  10.326
   75   HD11  ILE  10          3HD1      ILE  10  18.199  -2.406  10.718
   76   HD12  ILE  10          1HD1      ILE  10  17.936  -4.137  10.932
   77   HD13  ILE  10          2HD1      ILE  10  18.449  -3.509   9.365
   78    H    ALA  11           H        ALA  11  14.836  -3.364   6.554
   79    HA   ALA  11           HA       ALA  11  13.734  -5.338   5.133
   80    HB1  ALA  11           3HB      ALA  11  13.148  -3.605   3.367
   81    HB2  ALA  11           1HB      ALA  11  12.698  -3.231   5.031
   82    HB3  ALA  11           2HB      ALA  11  14.119  -2.475   4.310
   83    H    GLU  12           H        GLU  12  16.500  -3.423   3.984
   84    HA   GLU  12           HA       GLU  12  16.781  -4.708   1.500
   85    HB2  GLU  12           1HB      GLU  12  18.340  -2.857   3.140
   86    HB3  GLU  12           2HB      GLU  12  19.342  -3.937   2.182
   87    HG2  GLU  12           1HG      GLU  12  17.648  -3.204   0.280
   88    HG3  GLU  12           2HG      GLU  12  17.500  -1.787   1.318
   89    H    ALA  13           H        ALA  13  18.822  -5.123   4.399
   90    HA   ALA  13           HA       ALA  13  20.232  -7.345   3.540
   91    HB1  ALA  13           3HB      ALA  13  21.152  -6.504   5.441
   92    HB2  ALA  13           1HB      ALA  13  19.587  -6.182   6.189
   93    HB3  ALA  13           2HB      ALA  13  20.227  -7.825   6.154
   94    H    MET  14           H        MET  14  16.942  -7.113   4.438
   95    HA   MET  14           HA       MET  14  16.699  -9.971   4.978
   96    HB2  MET  14           1HB      MET  14  14.662  -7.740   5.051
   97    HB3  MET  14           2HB      MET  14  14.309  -9.420   5.430
   98    HG2  MET  14           1HG      MET  14  16.207  -9.172   7.169
   99    HG3  MET  14           2HG      MET  14  15.941  -7.443   6.959
  100    HE1  MET  14           3HE      MET  14  14.162  -9.856   9.980
  101    HE2  MET  14           1HE      MET  14  14.018 -10.826   8.514
  102    HE3  MET  14           2HE      MET  14  15.572 -10.117   8.952
  103    H    ALA  15           H        ALA  15  17.307  -8.668   2.291
  104    HA   ALA  15           HA       ALA  15  15.068  -9.842   0.777
  105    HB1  ALA  15           3HB      ALA  15  15.447  -8.320  -0.965
  106    HB2  ALA  15           1HB      ALA  15  15.586  -7.360   0.508
  107    HB3  ALA  15           2HB      ALA  15  17.039  -7.877  -0.349
  108    H    LYS  16           H        LYS  16  18.551  -9.709   1.159
  109    HA   LYS  16           HA       LYS  16  19.501 -11.009  -1.039
  110    HB2  LYS  16           1HB      LYS  16  20.524 -10.340   1.426
  111    HB3  LYS  16           2HB      LYS  16  20.626 -12.096   1.440
  112    HG2  LYS  16           1HG      LYS  16  22.064 -12.147  -0.396
  113    HG3  LYS  16           2HG      LYS  16  21.660 -10.496  -0.872
  114    HD2  LYS  16           1HD      LYS  16  22.647 -10.251   1.714
  115    HD3  LYS  16           2HD      LYS  16  23.696 -11.451   0.954
  116    HE2  LYS  16           1HE      LYS  16  24.802  -9.721   0.081
  117    HE3  LYS  16           2HE      LYS  16  23.420  -9.523  -0.995
  118    HZ1  LYS  16           3HZ      LYS  16  23.344  -8.277   1.662
  119    HZ2  LYS  16           1HZ      LYS  16  22.600  -7.787   0.223
  120    HZ3  LYS  16           2HZ      LYS  16  24.260  -7.544   0.443
  121    H    GLY  17           H        GLY  17  18.393 -12.649   1.935
  122    HA2  GLY  17           1HA      GLY  17  16.906 -14.634   0.685
  123    HA3  GLY  17           2HA      GLY  17  18.546 -15.252   0.813
  Start of MODEL    6
    1    HA   SER   1           HA       SER   1  13.105  10.500  10.732
    2    HG   SER   1           HG       SER   1  11.491   9.890  12.017
    3    H1   SER   1           1H       SER   1  12.813   9.717   8.111
    4    HB2  SER   1           1HB      SER   1  11.100   9.349   9.315
    5    HB3  SER   1           2HB      SER   1  11.568   8.000  10.350
    6    H    ALA   2           H        ALA   2  12.898   8.748  12.605
    7    HA   ALA   2           HA       ALA   2  15.475   7.598  12.865
    8    HB1  ALA   2           3HB      ALA   2  14.933   7.244  15.041
    9    HB2  ALA   2           1HB      ALA   2  13.676   8.418  14.647
   10    HB3  ALA   2           2HB      ALA   2  13.301   6.694  14.662
   11    H    ALA   3           H        ALA   3  12.248   6.163  12.440
   12    HA   ALA   3           HA       ALA   3  13.194   3.480  12.368
   13    HB1  ALA   3           3HB      ALA   3  10.850   4.235  12.930
   14    HB2  ALA   3           1HB      ALA   3  10.604   4.466  11.199
   15    HB3  ALA   3           2HB      ALA   3  10.976   2.862  11.831
   16    H    GLU   4           H        GLU   4  13.173   6.013  10.085
   17    HA   GLU   4           HA       GLU   4  13.177   4.282   7.761
   18    HB2  GLU   4           1HB      GLU   4  13.723   7.249   7.966
   19    HB3  GLU   4           2HB      GLU   4  13.468   6.346   6.480
   20    HG2  GLU   4           1HG      GLU   4  11.297   5.992   8.369
   21    HG3  GLU   4           2HG      GLU   4  11.552   7.682   7.939
   22    H    ALA   5           H        ALA   5  15.453   5.680   9.929
   23    HA   ALA   5           HA       ALA   5  17.699   5.393   8.112
   24    HB1  ALA   5           3HB      ALA   5  17.736   6.093  11.043
   25    HB2  ALA   5           1HB      ALA   5  19.040   6.312   9.876
   26    HB3  ALA   5           2HB      ALA   5  17.563   7.266   9.738
   27    H    TYR   6           H        TYR   6  16.297   3.743  10.880
   28    HA   TYR   6           HA       TYR   6  18.482   1.862  11.081
   29    HD1  TYR   6           HD1      TYR   6  18.577  -0.248  12.976
   30    HD2  TYR   6           HD2      TYR   6  14.418   0.628  12.771
   31    HE1  TYR   6           HE1      TYR   6  18.063  -2.578  13.571
   32    HE2  TYR   6           HE2      TYR   6  13.893  -1.700  13.367
   33    HH   TYR   6           HH       TYR   6  16.010  -4.171  13.166
   34    HB2  TYR   6           1HB      TYR   6  17.581   2.154  13.173
   35    HB3  TYR   6           2HB      TYR   6  15.945   2.364  12.559
   36    H    ALA   7           H        ALA   7  14.984   1.295  10.707
   37    HA   ALA   7           HA       ALA   7  15.064  -1.270   9.768
   38    HB1  ALA   7           3HB      ALA   7  13.114   0.634   8.546
   39    HB2  ALA   7           1HB      ALA   7  12.865  -1.015   9.121
   40    HB3  ALA   7           2HB      ALA   7  13.055   0.303  10.277
   41    H    LYS   8           H        LYS   8  16.113   1.563   8.146
   42    HA   LYS   8           HA       LYS   8  15.786   1.042   5.480
   43    HB2  LYS   8           1HB      LYS   8  17.452   2.709   7.056
   44    HB3  LYS   8           2HB      LYS   8  18.485   1.921   5.870
   45    HG2  LYS   8           1HG      LYS   8  15.966   3.018   4.820
   46    HG3  LYS   8           2HG      LYS   8  17.129   4.203   5.421
   47    HD2  LYS   8           1HD      LYS   8  18.305   2.098   3.755
   48    HD3  LYS   8           2HD      LYS   8  17.140   3.123   2.913
   49    HE2  LYS   8           1HE      LYS   8  19.477   4.141   4.524
   50    HE3  LYS   8           2HE      LYS   8  19.478   3.945   2.772
   51    HZ1  LYS   8           3HZ      LYS   8  17.329   5.527   3.967
   52    HZ2  LYS   8           1HZ      LYS   8  18.109   5.716   2.478
   53    HZ3  LYS   8           2HZ      LYS   8  18.870   6.222   3.902
   54    H    ARG   9           H        ARG   9  18.872   0.282   7.086
   55    HA   ARG   9           HA       ARG   9  19.805  -1.467   5.145
   56    HE   ARG   9           HE       ARG   9  22.881   0.142   8.643
   57    HB2  ARG   9           1HB      ARG   9  21.019  -2.459   7.340
   58    HB3  ARG   9           2HB      ARG   9  21.521  -0.976   6.539
   59    HG2  ARG   9           1HG      ARG   9  19.431  -0.708   8.606
   60    HG3  ARG   9           2HG      ARG   9  21.048  -1.144   9.163
   61    HD2  ARG   9           1HD      ARG   9  20.604   1.138   7.266
   62    HD3  ARG   9           2HD      ARG   9  20.442   1.349   9.009
   63   HH11  ARG   9          2HH1      ARG   9  21.347   3.079   7.574
   64   HH12  ARG   9          1HH1      ARG   9  22.829   3.969   7.467
   65   HH21  ARG   9          2HH2      ARG   9  24.840   1.303   8.506
   66   HH22  ARG   9          1HH2      ARG   9  24.816   2.958   7.997
   67    H    ILE  10           H        ILE  10  18.374  -2.365   8.290
   68    HA   ILE  10           HA       ILE  10  18.274  -5.037   8.180
   69    HB   ILE  10           HB       ILE  10  15.689  -3.675   8.819
   70   HG12  ILE  10          1HG1      ILE  10  17.196  -2.099   9.747
   71   HG13  ILE  10          2HG1      ILE  10  16.732  -3.144  11.085
   72   HG21  ILE  10          1HG2      ILE  10  17.283  -5.936   9.999
   73   HG22  ILE  10          2HG2      ILE  10  15.869  -5.241  10.789
   74   HG23  ILE  10          3HG2      ILE  10  15.708  -6.010   9.210
   75   HD11  ILE  10          3HD1      ILE  10  18.968  -4.381  10.085
   76   HD12  ILE  10          1HD1      ILE  10  19.340  -2.666   9.908
   77   HD13  ILE  10          2HD1      ILE  10  18.908  -3.317  11.490
   78    H    ALA  11           H        ALA  11  15.438  -3.232   7.000
   79    HA   ALA  11           HA       ALA  11  14.046  -5.118   5.719
   80    HB1  ALA  11           3HB      ALA  11  14.563  -2.273   5.044
   81    HB2  ALA  11           1HB      ALA  11  13.710  -3.265   3.861
   82    HB3  ALA  11           2HB      ALA  11  13.058  -3.077   5.489
   83    H    GLU  12           H        GLU  12  16.894  -3.510   4.329
   84    HA   GLU  12           HA       GLU  12  16.858  -4.846   1.856
   85    HB2  GLU  12           1HB      GLU  12  18.715  -3.147   3.344
   86    HB3  GLU  12           2HB      GLU  12  19.528  -4.336   2.336
   87    HG2  GLU  12           1HG      GLU  12  17.780  -3.452   0.549
   88    HG3  GLU  12           2HG      GLU  12  17.856  -2.017   1.568
   89    H    ALA  13           H        ALA  13  19.059  -5.434   4.604
   90    HA   ALA  13           HA       ALA  13  20.152  -7.810   3.681
   91    HB1  ALA  13           3HB      ALA  13  19.665  -7.338   6.600
   92    HB2  ALA  13           1HB      ALA  13  21.041  -8.110   5.813
   93    HB3  ALA  13           2HB      ALA  13  20.824  -6.364   5.696
   94    H    MET  14           H        MET  14  16.981  -7.214   4.719
   95    HA   MET  14           HA       MET  14  16.490 -10.020   5.395
   96    HB2  MET  14           1HB      MET  14  14.824  -7.523   5.684
   97    HB3  MET  14           2HB      MET  14  14.167  -9.133   5.948
   98    HG2  MET  14           1HG      MET  14  16.552  -8.946   7.445
   99    HG3  MET  14           2HG      MET  14  15.626  -7.476   7.738
  100    HE1  MET  14           3HE      MET  14  14.079  -7.180   9.267
  101    HE2  MET  14           1HE      MET  14  13.190  -8.357  10.235
  102    HE3  MET  14           2HE      MET  14  14.918  -8.123  10.500
  103    H    ALA  15           H        ALA  15  17.057  -9.004   2.653
  104    HA   ALA  15           HA       ALA  15  14.566  -9.917   1.365
  105    HB1  ALA  15           3HB      ALA  15  14.543  -8.101   0.094
  106    HB2  ALA  15           1HB      ALA  15  15.921  -7.475   1.000
  107    HB3  ALA  15           2HB      ALA  15  16.185  -8.429  -0.460
  108    H    LYS  16           H        LYS  16  18.094  -9.686   0.931
  109    HA   LYS  16           HA       LYS  16  18.446 -11.368  -1.203
  110    HB2  LYS  16           1HB      LYS  16  20.093 -10.608   1.138
  111    HB3  LYS  16           2HB      LYS  16  20.603 -12.051   0.271
  112    HG2  LYS  16           1HG      LYS  16  20.702 -10.763  -1.807
  113    HG3  LYS  16           2HG      LYS  16  20.205  -9.316  -0.927
  114    HD2  LYS  16           1HD      LYS  16  22.271  -9.918   0.583
  115    HD3  LYS  16           2HD      LYS  16  22.797 -10.791  -0.858
  116    HE2  LYS  16           1HE      LYS  16  23.749  -8.645  -1.039
  117    HE3  LYS  16           2HE      LYS  16  22.370  -8.642  -2.137
  118    HZ1  LYS  16           3HZ      LYS  16  21.743  -7.770   0.536
  119    HZ2  LYS  16           1HZ      LYS  16  21.339  -7.074  -0.952
  120    HZ3  LYS  16           2HZ      LYS  16  22.852  -6.772  -0.260
  121    H    GLY  17           H        GLY  17  18.430 -13.526  -1.579
  122    HA2  GLY  17           1HA      GLY  17  18.618 -15.516   0.424
  123    HA3  GLY  17           2HA      GLY  17  16.928 -15.235   0.031
  Start of MODEL    7
    1    HA   SER   1           HA       SER   1  12.301  10.090  11.410
    2    HG   SER   1           HG       SER   1   9.604   8.412  12.306
    3    H1   SER   1           1H       SER   1  12.896   8.998   8.758
    4    HB2  SER   1           1HB      SER   1  10.190   9.161  10.397
    5    HB3  SER   1           2HB      SER   1  10.972   7.580  10.369
    6    H    ALA   2           H        ALA   2  12.891   8.609  13.165
    7    HA   ALA   2           HA       ALA   2  15.471   7.601  12.898
    8    HB1  ALA   2           3HB      ALA   2  13.777   6.409  15.008
    9    HB2  ALA   2           1HB      ALA   2  15.368   7.163  15.117
   10    HB3  ALA   2           2HB      ALA   2  13.921   8.166  15.001
   11    H    ALA   3           H        ALA   3  12.414   5.781  13.150
   12    HA   ALA   3           HA       ALA   3  13.569   3.239  12.757
   13    HB1  ALA   3           3HB      ALA   3  11.496   2.497  13.120
   14    HB2  ALA   3           1HB      ALA   3  11.066   4.185  13.398
   15    HB3  ALA   3           2HB      ALA   3  10.828   3.464  11.805
   16    H    GLU   4           H        GLU   4  12.944   5.793  10.588
   17    HA   GLU   4           HA       GLU   4  12.735   4.106   8.240
   18    HB2  GLU   4           1HB      GLU   4  12.855   7.097   8.616
   19    HB3  GLU   4           2HB      GLU   4  12.810   6.334   7.033
   20    HG2  GLU   4           1HG      GLU   4  10.715   5.437   8.871
   21    HG3  GLU   4           2HG      GLU   4  10.635   7.143   8.438
   22    H    ALA   5           H        ALA   5  15.186   5.691  10.059
   23    HA   ALA   5           HA       ALA   5  17.125   5.671   7.901
   24    HB1  ALA   5           3HB      ALA   5  16.974   7.420   9.765
   25    HB2  ALA   5           1HB      ALA   5  17.746   6.208  10.787
   26    HB3  ALA   5           2HB      ALA   5  18.572   6.803   9.346
   27    H    TYR   6           H        TYR   6  16.407   3.849  10.832
   28    HA   TYR   6           HA       TYR   6  18.747   2.192  10.610
   29    HD1  TYR   6           HD1      TYR   6  19.329   0.053  12.437
   30    HD2  TYR   6           HD2      TYR   6  15.099   0.438  12.689
   31    HE1  TYR   6           HE1      TYR   6  19.149  -2.339  12.977
   32    HE2  TYR   6           HE2      TYR   6  14.908  -1.954  13.231
   33    HH   TYR   6           HH       TYR   6  17.713  -3.920  13.884
   34    HB2  TYR   6           1HB      TYR   6  18.115   2.306  12.815
   35    HB3  TYR   6           2HB      TYR   6  16.398   2.354  12.434
   36    H    ALA   7           H        ALA   7  15.312   1.249  10.673
   37    HA   ALA   7           HA       ALA   7  15.525  -1.256   9.613
   38    HB1  ALA   7           3HB      ALA   7  13.205  -1.011   8.840
   39    HB2  ALA   7           1HB      ALA   7  13.435  -0.380  10.470
   40    HB3  ALA   7           2HB      ALA   7  13.314   0.729   9.104
   41    H    LYS   8           H        LYS   8  16.054   1.724   7.995
   42    HA   LYS   8           HA       LYS   8  15.449   1.282   5.376
   43    HB2  LYS   8           1HB      LYS   8  16.865   3.175   6.679
   44    HB3  LYS   8           2HB      LYS   8  18.172   2.348   5.842
   45    HG2  LYS   8           1HG      LYS   8  16.047   2.766   3.999
   46    HG3  LYS   8           2HG      LYS   8  16.383   4.286   4.831
   47    HD2  LYS   8           1HD      LYS   8  18.898   3.445   4.319
   48    HD3  LYS   8           2HD      LYS   8  18.044   2.746   2.941
   49    HE2  LYS   8           1HE      LYS   8  18.860   4.943   2.360
   50    HE3  LYS   8           2HE      LYS   8  17.100   4.971   2.441
   51    HZ1  LYS   8           3HZ      LYS   8  17.181   6.046   4.540
   52    HZ2  LYS   8           1HZ      LYS   8  18.223   6.896   3.513
   53    HZ3  LYS   8           2HZ      LYS   8  18.855   5.836   4.670
   54    H    ARG   9           H        ARG   9  18.746   0.659   6.578
   55    HA   ARG   9           HA       ARG   9  19.547  -0.918   4.431
   56    HE   ARG   9           HE       ARG   9  22.663   1.853   6.551
   57    HB2  ARG   9           1HB      ARG   9  21.106  -1.906   6.392
   58    HB3  ARG   9           2HB      ARG   9  21.386  -0.347   5.628
   59    HG2  ARG   9           1HG      ARG   9  19.568  -0.360   7.953
   60    HG3  ARG   9           2HG      ARG   9  21.271  -0.691   8.275
   61    HD2  ARG   9           1HD      ARG   9  20.398   1.648   6.607
   62    HD3  ARG   9           2HD      ARG   9  20.487   1.745   8.365
   63   HH11  ARG   9          2HH1      ARG   9  21.746   0.654   9.688
   64   HH12  ARG   9          1HH1      ARG   9  23.358   0.701  10.321
   65   HH21  ARG   9          2HH2      ARG   9  24.789   1.920   7.373
   66   HH22  ARG   9          1HH2      ARG   9  25.088   1.422   9.004
   67    H    ILE  10           H        ILE  10  18.661  -2.076   7.690
   68    HA   ILE  10           HA       ILE  10  18.712  -4.733   7.443
   69    HB   ILE  10           HB       ILE  10  16.154  -3.600   8.501
   70   HG12  ILE  10          1HG1      ILE  10  17.681  -1.963   9.296
   71   HG13  ILE  10          2HG1      ILE  10  17.452  -3.089  10.629
   72   HG21  ILE  10          1HG2      ILE  10  16.383  -5.942   8.752
   73   HG22  ILE  10          2HG2      ILE  10  18.044  -5.790   9.322
   74   HG23  ILE  10          3HG2      ILE  10  16.710  -5.240  10.336
   75   HD11  ILE  10          3HD1      ILE  10  19.818  -2.288  10.122
   76   HD12  ILE  10          1HD1      ILE  10  19.568  -4.018  10.359
   77   HD13  ILE  10          2HD1      ILE  10  19.747  -3.368   8.729
   78    H    ALA  11           H        ALA  11  15.622  -3.095   6.759
   79    HA   ALA  11           HA       ALA  11  14.191  -5.012   5.580
   80    HB1  ALA  11           3HB      ALA  11  13.547  -3.080   3.852
   81    HB2  ALA  11           1HB      ALA  11  13.026  -3.070   5.537
   82    HB3  ALA  11           2HB      ALA  11  14.422  -2.113   5.040
   83    H    GLU  12           H        GLU  12  16.707  -3.155   3.889
   84    HA   GLU  12           HA       GLU  12  16.419  -4.412   1.391
   85    HB2  GLU  12           1HB      GLU  12  18.343  -2.625   2.679
   86    HB3  GLU  12           2HB      GLU  12  19.087  -3.716   1.519
   87    HG2  GLU  12           1HG      GLU  12  17.048  -2.912   0.028
   88    HG3  GLU  12           2HG      GLU  12  17.163  -1.508   1.087
   89    H    ALA  13           H        ALA  13  19.024  -4.914   3.780
   90    HA   ALA  13           HA       ALA  13  20.209  -7.122   2.655
   91    HB1  ALA  13           3HB      ALA  13  21.499  -6.747   4.423
   92    HB2  ALA  13           1HB      ALA  13  20.218  -5.841   5.229
   93    HB3  ALA  13           2HB      ALA  13  20.308  -7.594   5.410
   94    H    MET  14           H        MET  14  17.219  -6.944   4.447
   95    HA   MET  14           HA       MET  14  16.996  -9.815   4.728
   96    HB2  MET  14           1HB      MET  14  15.062  -7.573   5.330
   97    HB3  MET  14           2HB      MET  14  14.736  -9.270   5.652
   98    HG2  MET  14           1HG      MET  14  16.763  -9.298   7.110
   99    HG3  MET  14           2HG      MET  14  16.863  -7.551   6.897
  100    HE1  MET  14           3HE      MET  14  14.965 -10.516   8.658
  101    HE2  MET  14           1HE      MET  14  13.413  -9.757   9.016
  102    HE3  MET  14           2HE      MET  14  13.890 -10.041   7.342
  103    H    ALA  15           H        ALA  15  17.099  -8.370   2.051
  104    HA   ALA  15           HA       ALA  15  14.654  -9.573   0.926
  105    HB1  ALA  15           3HB      ALA  15  16.106  -7.099   0.000
  106    HB2  ALA  15           1HB      ALA  15  14.782  -7.873  -0.871
  107    HB3  ALA  15           2HB      ALA  15  14.500  -7.179   0.726
  108    H    LYS  16           H        LYS  16  18.098  -9.023   0.587
  109    HA   LYS  16           HA       LYS  16  18.662  -9.975  -1.907
  110    HB2  LYS  16           1HB      LYS  16  20.840 -10.474  -1.147
  111    HB3  LYS  16           2HB      LYS  16  20.281  -9.164  -0.115
  112    HG2  LYS  16           1HG      LYS  16  19.558 -11.070   1.486
  113    HG3  LYS  16           2HG      LYS  16  20.682 -12.050   0.542
  114    HD2  LYS  16           1HD      LYS  16  22.393 -10.213   0.974
  115    HD3  LYS  16           2HD      LYS  16  21.262  -9.594   2.180
  116    HE2  LYS  16           1HE      LYS  16  21.746 -12.462   2.409
  117    HE3  LYS  16           2HE      LYS  16  23.204 -11.493   2.611
  118    HZ1  LYS  16           3HZ      LYS  16  22.189 -11.773   4.731
  119    HZ2  LYS  16           1HZ      LYS  16  20.681 -11.266   4.156
  120    HZ3  LYS  16           2HZ      LYS  16  21.957 -10.162   4.271
  121    H    GLY  17           H        GLY  17  17.807 -11.852   0.950
  122    HA2  GLY  17           1HA      GLY  17  16.699 -13.935   0.864
  123    HA3  GLY  17           2HA      GLY  17  17.261 -14.140  -0.788
  Start of MODEL    8
    1    HA   SER   1           HA       SER   1  12.748  10.458  10.732
    2    HG   SER   1           HG       SER   1  10.856  10.106  11.319
    3    H1   SER   1           1H       SER   1  12.877   9.998   7.994
    4    HB2  SER   1           1HB      SER   1  11.251   8.991   8.794
    5    HB3  SER   1           2HB      SER   1  11.499   7.952  10.197
    6    H    ALA   2           H        ALA   2  13.182   9.165  12.546
    7    HA   ALA   2           HA       ALA   2  15.653   7.920  12.640
    8    HB1  ALA   2           3HB      ALA   2  15.264   7.686  14.846
    9    HB2  ALA   2           1HB      ALA   2  13.861   8.697  14.500
   10    HB3  ALA   2           2HB      ALA   2  13.683   6.945  14.598
   11    H    ALA   3           H        ALA   3  12.458   6.331  12.676
   12    HA   ALA   3           HA       ALA   3  13.469   3.703  12.497
   13    HB1  ALA   3           3HB      ALA   3  11.138   3.112  11.823
   14    HB2  ALA   3           1HB      ALA   3  11.252   4.047  13.314
   15    HB3  ALA   3           2HB      ALA   3  10.762   4.835  11.813
   16    H    GLU   4           H        GLU   4  13.175   6.179  10.172
   17    HA   GLU   4           HA       GLU   4  13.004   4.415   7.887
   18    HB2  GLU   4           1HB      GLU   4  13.358   7.393   8.185
   19    HB3  GLU   4           2HB      GLU   4  13.432   6.591   6.622
   20    HG2  GLU   4           1HG      GLU   4  11.122   5.606   7.366
   21    HG3  GLU   4           2HG      GLU   4  11.109   7.011   8.430
   22    H    ALA   5           H        ALA   5  15.461   5.833   9.832
   23    HA   ALA   5           HA       ALA   5  17.539   5.482   7.830
   24    HB1  ALA   5           3HB      ALA   5  17.448   7.400   9.502
   25    HB2  ALA   5           1HB      ALA   5  17.968   6.224  10.709
   26    HB3  ALA   5           2HB      ALA   5  18.994   6.572   9.317
   27    H    TYR   6           H        TYR   6  16.333   3.918  10.723
   28    HA   TYR   6           HA       TYR   6  18.546   2.075  10.890
   29    HD1  TYR   6           HD2      TYR   6  18.738   0.052  12.957
   30    HD2  TYR   6           HD1      TYR   6  14.558   0.765  12.601
   31    HE1  TYR   6           HE2      TYR   6  18.290  -2.274  13.621
   32    HE2  TYR   6           HE1      TYR   6  14.099  -1.558  13.265
   33    HH   TYR   6           HH       TYR   6  16.268  -3.512  14.734
   34    HB2  TYR   6           1HB      TYR   6  17.698   2.401  13.000
   35    HB3  TYR   6           2HB      TYR   6  16.042   2.562  12.428
   36    H    ALA   7           H        ALA   7  15.051   1.433  10.630
   37    HA   ALA   7           HA       ALA   7  15.145  -1.150   9.755
   38    HB1  ALA   7           3HB      ALA   7  13.048  -0.166  10.300
   39    HB2  ALA   7           1HB      ALA   7  13.197   1.020   9.003
   40    HB3  ALA   7           2HB      ALA   7  12.959  -0.685   8.617
   41    H    LYS   8           H        LYS   8  16.109   1.654   8.027
   42    HA   LYS   8           HA       LYS   8  15.743   1.080   5.388
   43    HB2  LYS   8           1HB      LYS   8  17.221   2.911   6.756
   44    HB3  LYS   8           2HB      LYS   8  18.492   1.938   6.028
   45    HG2  LYS   8           1HG      LYS   8  16.907   2.293   3.889
   46    HG3  LYS   8           2HG      LYS   8  16.560   3.777   4.780
   47    HD2  LYS   8           1HD      LYS   8  18.475   4.648   4.064
   48    HD3  LYS   8           2HD      LYS   8  19.363   3.349   4.864
   49    HE2  LYS   8           1HE      LYS   8  18.104   2.616   2.311
   50    HE3  LYS   8           2HE      LYS   8  19.388   3.818   2.190
   51    HZ1  LYS   8           3HZ      LYS   8  19.568   1.013   2.732
   52    HZ2  LYS   8           1HZ      LYS   8  20.409   1.938   3.871
   53    HZ3  LYS   8           2HZ      LYS   8  20.768   2.092   2.226
   54    H    ARG   9           H        ARG   9  18.827   0.272   6.982
   55    HA   ARG   9           HA       ARG   9  19.702  -1.515   5.037
   56    HE   ARG   9           HE       ARG   9  22.656   0.288   9.142
   57    HB2  ARG   9           1HB      ARG   9  20.953  -2.487   7.214
   58    HB3  ARG   9           2HB      ARG   9  21.450  -1.015   6.391
   59    HG2  ARG   9           1HG      ARG   9  19.406  -0.712   8.499
   60    HG3  ARG   9           2HG      ARG   9  21.030  -1.160   9.025
   61    HD2  ARG   9           1HD      ARG   9  21.118   0.935   7.042
   62    HD3  ARG   9           2HD      ARG   9  20.097   1.395   8.404
   63   HH11  ARG   9          2HH1      ARG   9  20.869   3.171   8.359
   64   HH12  ARG   9          1HH1      ARG   9  21.964   4.231   9.184
   65   HH21  ARG   9          2HH2      ARG   9  24.105   1.673  10.231
   66   HH22  ARG   9          1HH2      ARG   9  23.805   3.377  10.247
   67    H    ILE  10           H        ILE  10  18.378  -2.360   8.243
   68    HA   ILE  10           HA       ILE  10  18.216  -5.023   8.169
   69    HB   ILE  10           HB       ILE  10  15.673  -3.608   8.865
   70   HG12  ILE  10          1HG1      ILE  10  17.251  -2.052   9.721
   71   HG13  ILE  10          2HG1      ILE  10  16.781  -3.056  11.088
   72   HG21  ILE  10          1HG2      ILE  10  17.259  -5.886  10.021
   73   HG22  ILE  10          2HG2      ILE  10  15.887  -5.153  10.850
   74   HG23  ILE  10          3HG2      ILE  10  15.657  -5.935   9.287
   75   HD11  ILE  10          3HD1      ILE  10  19.228  -3.659   9.474
   76   HD12  ILE  10          1HD1      ILE  10  19.251  -2.497  10.800
   77   HD13  ILE  10          2HD1      ILE  10  18.821  -4.180  11.109
   78    H    ALA  11           H        ALA  11  15.375  -3.187   7.046
   79    HA   ALA  11           HA       ALA  11  13.906  -5.057   5.838
   80    HB1  ALA  11           3HB      ALA  11  14.459  -2.235   5.144
   81    HB2  ALA  11           1HB      ALA  11  13.630  -3.209   3.929
   82    HB3  ALA  11           2HB      ALA  11  12.936  -3.031   5.541
   83    H    GLU  12           H        GLU  12  16.744  -3.545   4.320
   84    HA   GLU  12           HA       GLU  12  16.609  -4.953   1.892
   85    HB2  GLU  12           1HB      GLU  12  18.541  -3.245   3.270
   86    HB3  GLU  12           2HB      GLU  12  19.301  -4.479   2.274
   87    HG2  GLU  12           1HG      GLU  12  17.515  -3.617   0.515
   88    HG3  GLU  12           2HG      GLU  12  17.647  -2.153   1.488
   89    H    ALA  13           H        ALA  13  18.890  -5.499   4.583
   90    HA   ALA  13           HA       ALA  13  20.009  -7.854   3.760
   91    HB1  ALA  13           3HB      ALA  13  20.156  -8.379   6.281
   92    HB2  ALA  13           1HB      ALA  13  20.944  -6.924   5.671
   93    HB3  ALA  13           2HB      ALA  13  19.389  -6.805   6.495
   94    H    MET  14           H        MET  14  16.799  -7.345   4.991
   95    HA   MET  14           HA       MET  14  16.326 -10.217   5.247
   96    HB2  MET  14           1HB      MET  14  14.481  -7.891   5.820
   97    HB3  MET  14           2HB      MET  14  14.157  -9.580   6.189
   98    HG2  MET  14           1HG      MET  14  16.579  -9.113   7.414
   99    HG3  MET  14           2HG      MET  14  15.692  -7.610   7.662
  100    HE1  MET  14           3HE      MET  14  14.285 -11.321   7.378
  101    HE2  MET  14           1HE      MET  14  15.821 -11.443   8.235
  102    HE3  MET  14           2HE      MET  14  14.310 -11.774   9.083
  103    H    ALA  15           H        ALA  15  16.816  -8.993   2.642
  104    HA   ALA  15           HA       ALA  15  14.275  -9.729   1.351
  105    HB1  ALA  15           3HB      ALA  15  16.107  -7.508   0.452
  106    HB2  ALA  15           1HB      ALA  15  14.612  -8.016  -0.334
  107    HB3  ALA  15           2HB      ALA  15  14.561  -7.291   1.273
  108    H    LYS  16           H        LYS  16  17.779  -9.344   0.937
  109    HA   LYS  16           HA       LYS  16  18.083 -10.641  -1.497
  110    HB2  LYS  16           1HB      LYS  16  19.790  -9.843   0.703
  111    HB3  LYS  16           2HB      LYS  16  20.319 -11.375   0.021
  112    HG2  LYS  16           1HG      LYS  16  21.058 -10.421  -1.862
  113    HG3  LYS  16           2HG      LYS  16  19.670  -9.337  -1.976
  114    HD2  LYS  16           1HD      LYS  16  21.198  -7.750  -1.491
  115    HD3  LYS  16           2HD      LYS  16  20.939  -8.290   0.170
  116    HE2  LYS  16           1HE      LYS  16  22.992  -9.179   0.320
  117    HE3  LYS  16           2HE      LYS  16  22.907  -9.878  -1.296
  118    HZ1  LYS  16           3HZ      LYS  16  23.501  -7.031  -0.692
  119    HZ2  LYS  16           1HZ      LYS  16  23.461  -7.732  -2.231
  120    HZ3  LYS  16           2HZ      LYS  16  24.647  -8.200  -1.119
  121    H    GLY  17           H        GLY  17  18.321 -12.055   1.772
  122    HA2  GLY  17           1HA      GLY  17  16.945 -14.402   1.191
  123    HA3  GLY  17           2HA      GLY  17  18.642 -14.719   0.861
  Start of MODEL    9
    1    HA   SER   1           HA       SER   1  12.972  10.304  11.734
    2    HG   SER   1           HG       SER   1  11.140  10.023  12.611
    3    H1   SER   1           1H       SER   1  13.308   9.369   8.959
    4    HB2  SER   1           1HB      SER   1  10.935   9.386  10.233
    5    HB3  SER   1           2HB      SER   1  11.532   7.854  10.872
    6    H    ALA   2           H        ALA   2  13.329   8.621  13.383
    7    HA   ALA   2           HA       ALA   2  15.828   7.381  13.073
    8    HB1  ALA   2           3HB      ALA   2  15.333   6.301  15.244
    9    HB2  ALA   2           1HB      ALA   2  15.036   8.040  15.250
   10    HB3  ALA   2           2HB      ALA   2  13.682   6.914  15.138
   11    H    ALA   3           H        ALA   3  12.551   6.001  13.102
   12    HA   ALA   3           HA       ALA   3  13.388   3.323  12.697
   13    HB1  ALA   3           3HB      ALA   3  11.101   4.315  13.515
   14    HB2  ALA   3           1HB      ALA   3  10.702   4.247  11.798
   15    HB3  ALA   3           2HB      ALA   3  11.161   2.776  12.657
   16    H    GLU   4           H        GLU   4  13.295   5.992  10.626
   17    HA   GLU   4           HA       GLU   4  12.947   4.395   8.210
   18    HB2  GLU   4           1HB      GLU   4  13.309   7.363   8.639
   19    HB3  GLU   4           2HB      GLU   4  13.177   6.614   7.054
   20    HG2  GLU   4           1HG      GLU   4  11.032   5.942   8.948
   21    HG3  GLU   4           2HG      GLU   4  11.099   7.628   8.436
   22    H    ALA   5           H        ALA   5  15.436   5.745  10.161
   23    HA   ALA   5           HA       ALA   5  17.444   5.603   8.063
   24    HB1  ALA   5           3HB      ALA   5  17.397   7.411   9.820
   25    HB2  ALA   5           1HB      ALA   5  17.908   6.183  10.979
   26    HB3  ALA   5           2HB      ALA   5  18.943   6.589   9.609
   27    H    TYR   6           H        TYR   6  16.427   3.824  10.912
   28    HA   TYR   6           HA       TYR   6  18.688   2.047  10.876
   29    HD1  TYR   6           HD2      TYR   6  19.002  -0.113  12.784
   30    HD2  TYR   6           HD1      TYR   6  14.791   0.456  12.557
   31    HE1  TYR   6           HE2      TYR   6  18.659  -2.497  13.282
   32    HE2  TYR   6           HE1      TYR   6  14.436  -1.926  13.055
   33    HH   TYR   6           HH       TYR   6  17.085  -4.194  13.165
   34    HB2  TYR   6           1HB      TYR   6  17.873   2.183  13.019
   35    HB3  TYR   6           2HB      TYR   6  16.200   2.319  12.491
   36    H    ALA   7           H        ALA   7  15.215   1.289  10.633
   37    HA   ALA   7           HA       ALA   7  15.386  -1.217   9.567
   38    HB1  ALA   7           3HB      ALA   7  13.251  -0.481  10.172
   39    HB2  ALA   7           1HB      ALA   7  13.352   0.947   9.142
   40    HB3  ALA   7           2HB      ALA   7  13.170  -0.651   8.419
   41    H    LYS   8           H        LYS   8  16.210   1.741   8.033
   42    HA   LYS   8           HA       LYS   8  15.814   1.348   5.367
   43    HB2  LYS   8           1HB      LYS   8  16.948   3.312   6.472
   44    HB3  LYS   8           2HB      LYS   8  18.422   2.354   6.510
   45    HG2  LYS   8           1HG      LYS   8  18.572   3.762   4.621
   46    HG3  LYS   8           2HG      LYS   8  18.225   2.142   4.014
   47    HD2  LYS   8           1HD      LYS   8  15.720   3.061   4.279
   48    HD3  LYS   8           2HD      LYS   8  16.557   4.586   3.983
   49    HE2  LYS   8           1HE      LYS   8  17.605   3.499   1.974
   50    HE3  LYS   8           2HE      LYS   8  16.519   2.134   2.232
   51    HZ1  LYS   8           3HZ      LYS   8  15.208   3.306   0.852
   52    HZ2  LYS   8           1HZ      LYS   8  15.949   4.787   1.200
   53    HZ3  LYS   8           2HZ      LYS   8  14.790   4.153   2.256
   54    H    ARG   9           H        ARG   9  18.955   0.539   6.845
   55    HA   ARG   9           HA       ARG   9  19.854  -1.067   4.757
   56    HE   ARG   9           HE       ARG   9  22.859   0.543   8.866
   57    HB2  ARG   9           1HB      ARG   9  21.183  -2.149   6.834
   58    HB3  ARG   9           2HB      ARG   9  21.610  -0.603   6.113
   59    HG2  ARG   9           1HG      ARG   9  19.600  -0.532   8.274
   60    HG3  ARG   9           2HG      ARG   9  21.250  -0.955   8.737
   61    HD2  ARG   9           1HD      ARG   9  21.203   1.285   6.910
   62    HD3  ARG   9           2HD      ARG   9  20.219   1.600   8.339
   63   HH11  ARG   9          2HH1      ARG   9  20.876   3.380   8.496
   64   HH12  ARG   9          1HH1      ARG   9  21.948   4.406   9.391
   65   HH21  ARG   9          2HH2      ARG   9  24.278   1.883  10.047
   66   HH22  ARG   9          1HH2      ARG   9  23.883   3.553  10.273
   67    H    ILE  10           H        ILE  10  18.626  -2.192   7.916
   68    HA   ILE  10           HA       ILE  10  18.557  -4.847   7.648
   69    HB   ILE  10           HB       ILE  10  15.982  -3.582   8.493
   70   HG12  ILE  10          1HG1      ILE  10  17.521  -2.035   9.432
   71   HG13  ILE  10          2HG1      ILE  10  17.116  -3.153  10.730
   72   HG21  ILE  10          1HG2      ILE  10  16.289  -5.260  10.354
   73   HG22  ILE  10          2HG2      ILE  10  16.058  -5.933   8.741
   74   HG23  ILE  10          3HG2      ILE  10  17.672  -5.878   9.450
   75   HD11  ILE  10          3HD1      ILE  10  19.548  -3.547   9.031
   76   HD12  ILE  10          1HD1      ILE  10  19.558  -2.483  10.437
   77   HD13  ILE  10          2HD1      ILE  10  19.195  -4.198  10.631
   78    H    ALA  11           H        ALA  11  15.631  -3.040   6.716
   79    HA   ALA  11           HA       ALA  11  14.205  -4.869   5.400
   80    HB1  ALA  11           3HB      ALA  11  13.821  -2.896   3.641
   81    HB2  ALA  11           1HB      ALA  11  13.155  -2.867   5.274
   82    HB3  ALA  11           2HB      ALA  11  14.639  -1.985   4.910
   83    H    GLU  12           H        GLU  12  16.956  -3.147   3.951
   84    HA   GLU  12           HA       GLU  12  16.818  -4.376   1.426
   85    HB2  GLU  12           1HB      GLU  12  18.717  -2.701   2.890
   86    HB3  GLU  12           2HB      GLU  12  19.498  -3.827   1.789
   87    HG2  GLU  12           1HG      GLU  12  17.643  -2.906   0.135
   88    HG3  GLU  12           2HG      GLU  12  17.741  -1.515   1.213
   89    H    ALA  13           H        ALA  13  19.177  -5.028   4.024
   90    HA   ALA  13           HA       ALA  13  20.285  -7.325   2.956
   91    HB1  ALA  13           3HB      ALA  13  20.675  -7.911   5.461
   92    HB2  ALA  13           1HB      ALA  13  21.443  -6.483   4.765
   93    HB3  ALA  13           2HB      ALA  13  19.990  -6.312   5.751
   94    H    MET  14           H        MET  14  17.172  -6.876   4.333
   95    HA   MET  14           HA       MET  14  16.772  -9.735   4.765
   96    HB2  MET  14           1HB      MET  14  15.018  -7.336   5.303
   97    HB3  MET  14           2HB      MET  14  14.503  -8.996   5.572
   98    HG2  MET  14           1HG      MET  14  16.946  -8.778   6.887
   99    HG3  MET  14           2HG      MET  14  16.100  -7.271   7.232
  100    HE1  MET  14           3HE      MET  14  16.507  -9.734   9.887
  101    HE2  MET  14           1HE      MET  14  16.602  -8.020   9.481
  102    HE3  MET  14           2HE      MET  14  15.267  -8.620  10.465
  103    H    ALA  15           H        ALA  15  17.054  -8.278   2.088
  104    HA   ALA  15           HA       ALA  15  14.602  -9.377   0.875
  105    HB1  ALA  15           3HB      ALA  15  15.073  -7.629  -0.959
  106    HB2  ALA  15           1HB      ALA  15  14.345  -7.090   0.555
  107    HB3  ALA  15           2HB      ALA  15  16.067  -6.837   0.264
  108    H    LYS  16           H        LYS  16  18.067  -8.989   0.710
  109    HA   LYS  16           HA       LYS  16  18.795  -9.800  -1.757
  110    HB2  LYS  16           1HB      LYS  16  20.805 -10.649  -0.845
  111    HB3  LYS  16           2HB      LYS  16  20.289  -9.377   0.254
  112    HG2  LYS  16           1HG      LYS  16  19.429 -11.017   1.807
  113    HG3  LYS  16           2HG      LYS  16  19.825 -12.322   0.686
  114    HD2  LYS  16           1HD      LYS  16  22.027 -12.269   1.201
  115    HD3  LYS  16           2HD      LYS  16  22.048 -10.514   1.390
  116    HE2  LYS  16           1HE      LYS  16  22.248 -10.981   3.578
  117    HE3  LYS  16           2HE      LYS  16  20.508 -11.251   3.499
  118    HZ1  LYS  16           3HZ      LYS  16  22.048 -13.047   4.518
  119    HZ2  LYS  16           1HZ      LYS  16  22.344 -13.470   2.907
  120    HZ3  LYS  16           2HZ      LYS  16  20.768 -13.518   3.519
  121    H    GLY  17           H        GLY  17  19.129 -11.760  -2.856
  122    HA2  GLY  17           1HA      GLY  17  18.809 -14.329  -2.105
  123    HA3  GLY  17           2HA      GLY  17  17.146 -13.779  -2.246
  Start of MODEL   10
    1    HA   SER   1           HA       SER   1  12.864  10.590  11.001
    2    HG   SER   1           HG       SER   1   9.971   9.113  11.935
    3    H1   SER   1           1H       SER   1  13.451   9.345   8.438
    4    HB2  SER   1           1HB      SER   1  10.673   9.801   9.988
    5    HB3  SER   1           2HB      SER   1  11.297   8.158  10.131
    6    H    ALA   2           H        ALA   2  13.283   9.118  12.826
    7    HA   ALA   2           HA       ALA   2  15.759   7.863  12.628
    8    HB1  ALA   2           3HB      ALA   2  14.168   8.610  14.684
    9    HB2  ALA   2           1HB      ALA   2  14.004   6.855  14.761
   10    HB3  ALA   2           2HB      ALA   2  15.602   7.598  14.856
   11    H    ALA   3           H        ALA   3  12.503   6.454  12.600
   12    HA   ALA   3           HA       ALA   3  13.382   3.756  12.449
   13    HB1  ALA   3           3HB      ALA   3  11.070   4.721  13.132
   14    HB2  ALA   3           1HB      ALA   3  10.725   4.641  11.404
   15    HB3  ALA   3           2HB      ALA   3  11.151   3.175  12.288
   16    H    GLU   4           H        GLU   4  13.236   6.278  10.165
   17    HA   GLU   4           HA       GLU   4  13.021   4.519   7.864
   18    HB2  GLU   4           1HB      GLU   4  13.558   7.492   7.976
   19    HB3  GLU   4           2HB      GLU   4  13.167   6.563   6.536
   20    HG2  GLU   4           1HG      GLU   4  11.192   6.237   8.637
   21    HG3  GLU   4           2HG      GLU   4  11.390   7.917   8.143
   22    H    ALA   5           H        ALA   5  15.461   5.963   9.810
   23    HA   ALA   5           HA       ALA   5  17.543   5.669   7.806
   24    HB1  ALA   5           3HB      ALA   5  17.319   6.918  10.467
   25    HB2  ALA   5           1HB      ALA   5  18.900   6.251  10.056
   26    HB3  ALA   5           2HB      ALA   5  18.159   7.469   9.017
   27    H    TYR   6           H        TYR   6  16.336   4.010  10.641
   28    HA   TYR   6           HA       TYR   6  18.579   2.205  10.801
   29    HD1  TYR   6           HD2      TYR   6  18.754   0.079  12.682
   30    HD2  TYR   6           HD1      TYR   6  14.566   0.804  12.486
   31    HE1  TYR   6           HE2      TYR   6  18.326  -2.274  13.256
   32    HE2  TYR   6           HE1      TYR   6  14.126  -1.547  13.060
   33    HH   TYR   6           HH       TYR   6  15.280  -3.720  12.933
   34    HB2  TYR   6           1HB      TYR   6  17.674   2.440  12.897
   35    HB3  TYR   6           2HB      TYR   6  16.030   2.596  12.290
   36    H    ALA   7           H        ALA   7  15.107   1.495  10.434
   37    HA   ALA   7           HA       ALA   7  15.215  -1.049   9.520
   38    HB1  ALA   7           3HB      ALA   7  13.180  -0.325   8.038
   39    HB2  ALA   7           1HB      ALA   7  13.067  -0.293   9.798
   40    HB3  ALA   7           2HB      ALA   7  13.359   1.200   8.906
   41    H    LYS   8           H        LYS   8  16.272   1.769   7.829
   42    HA   LYS   8           HA       LYS   8  16.127   1.209   5.190
   43    HB2  LYS   8           1HB      LYS   8  17.443   3.065   6.527
   44    HB3  LYS   8           2HB      LYS   8  18.812   1.998   6.243
   45    HG2  LYS   8           1HG      LYS   8  19.021   3.225   4.373
   46    HG3  LYS   8           2HG      LYS   8  17.798   2.110   3.758
   47    HD2  LYS   8           1HD      LYS   8  16.242   3.982   4.961
   48    HD3  LYS   8           2HD      LYS   8  17.598   4.971   4.413
   49    HE2  LYS   8           1HE      LYS   8  17.214   4.485   2.180
   50    HE3  LYS   8           2HE      LYS   8  16.321   3.010   2.550
   51    HZ1  LYS   8           3HZ      LYS   8  14.495   4.216   2.266
   52    HZ2  LYS   8           1HZ      LYS   8  15.355   5.672   2.226
   53    HZ3  LYS   8           2HZ      LYS   8  14.866   5.020   3.707
   54    H    ARG   9           H        ARG   9  18.996   0.216   7.065
   55    HA   ARG   9           HA       ARG   9  19.959  -1.575   5.142
   56    HE   ARG   9           HE       ARG   9  21.488   1.413  10.197
   57    HB2  ARG   9           1HB      ARG   9  21.031  -2.604   7.376
   58    HB3  ARG   9           2HB      ARG   9  21.621  -1.127   6.624
   59    HG2  ARG   9           1HG      ARG   9  19.445  -0.818   8.595
   60    HG3  ARG   9           2HG      ARG   9  21.018  -1.318   9.220
   61    HD2  ARG   9           1HD      ARG   9  21.535   0.739   7.387
   62    HD3  ARG   9           2HD      ARG   9  20.144   1.273   8.330
   63   HH11  ARG   9          2HH1      ARG   9  23.196  -0.179   7.615
   64   HH12  ARG   9          1HH1      ARG   9  24.731  -0.115   8.416
   65   HH21  ARG   9          2HH2      ARG   9  23.503   1.504  11.262
   66   HH22  ARG   9          1HH2      ARG   9  24.904   0.842  10.490
   67    H    ILE  10           H        ILE  10  18.417  -2.393   8.257
   68    HA   ILE  10           HA       ILE  10  18.145  -5.046   8.128
   69    HB   ILE  10           HB       ILE  10  15.638  -3.529   8.730
   70   HG12  ILE  10          1HG1      ILE  10  17.240  -2.060   9.688
   71   HG13  ILE  10          2HG1      ILE  10  16.663  -3.065  11.013
   72   HG21  ILE  10          1HG2      ILE  10  17.064  -5.897   9.915
   73   HG22  ILE  10          2HG2      ILE  10  15.691  -5.114  10.696
   74   HG23  ILE  10          3HG2      ILE  10  15.495  -5.859   9.110
   75   HD11  ILE  10          3HD1      ILE  10  19.166  -2.611  10.848
   76   HD12  ILE  10          1HD1      ILE  10  18.649  -4.276  11.110
   77   HD13  ILE  10          2HD1      ILE  10  19.154  -3.751   9.503
   78    H    ALA  11           H        ALA  11  15.446  -3.065   6.907
   79    HA   ALA  11           HA       ALA  11  13.950  -4.842   5.600
   80    HB1  ALA  11           3HB      ALA  11  13.103  -2.761   5.296
   81    HB2  ALA  11           1HB      ALA  11  14.680  -2.045   4.964
   82    HB3  ALA  11           2HB      ALA  11  13.846  -2.964   3.710
   83    H    GLU  12           H        GLU  12  16.927  -3.452   4.238
   84    HA   GLU  12           HA       GLU  12  16.841  -4.821   1.787
   85    HB2  GLU  12           1HB      GLU  12  18.786  -3.230   3.282
   86    HB3  GLU  12           2HB      GLU  12  19.532  -4.488   2.306
   87    HG2  GLU  12           1HG      GLU  12  17.880  -3.517   0.475
   88    HG3  GLU  12           2HG      GLU  12  18.035  -2.073   1.474
   89    H    ALA  13           H        ALA  13  18.964  -5.515   4.572
   90    HA   ALA  13           HA       ALA  13  19.955  -7.942   3.736
   91    HB1  ALA  13           3HB      ALA  13  19.618  -6.611   6.336
   92    HB2  ALA  13           1HB      ALA  13  19.817  -8.363   6.402
   93    HB3  ALA  13           2HB      ALA  13  21.042  -7.364   5.619
   94    H    MET  14           H        MET  14  16.758  -7.194   4.703
   95    HA   MET  14           HA       MET  14  16.095 -10.011   5.156
   96    HB2  MET  14           1HB      MET  14  14.457  -7.501   5.548
   97    HB3  MET  14           2HB      MET  14  13.880  -9.131   5.869
   98    HG2  MET  14           1HG      MET  14  15.832  -9.343   7.476
   99    HG3  MET  14           2HG      MET  14  16.022  -7.600   7.303
  100    HE1  MET  14           3HE      MET  14  15.996  -8.295   9.859
  101    HE2  MET  14           1HE      MET  14  14.558  -7.952  10.820
  102    HE3  MET  14           2HE      MET  14  14.852  -9.586  10.227
  103    H    ALA  15           H        ALA  15  16.767  -8.866   2.511
  104    HA   ALA  15           HA       ALA  15  14.299  -9.667   1.127
  105    HB1  ALA  15           3HB      ALA  15  14.115  -7.474   0.596
  106    HB2  ALA  15           1HB      ALA  15  15.837  -7.161   0.817
  107    HB3  ALA  15           2HB      ALA  15  15.263  -7.931  -0.663
  108    H    LYS  16           H        LYS  16  17.802  -9.392   1.098
  109    HA   LYS  16           HA       LYS  16  18.109 -10.837  -1.371
  110    HB2  LYS  16           1HB      LYS  16  19.795  -9.222  -0.806
  111    HB3  LYS  16           2HB      LYS  16  20.075  -9.980   0.756
  112    HG2  LYS  16           1HG      LYS  16  20.850 -12.020  -0.487
  113    HG3  LYS  16           2HG      LYS  16  20.783 -11.052  -1.962
  114    HD2  LYS  16           1HD      LYS  16  22.262  -9.384  -0.640
  115    HD3  LYS  16           2HD      LYS  16  22.587 -10.764   0.412
  116    HE2  LYS  16           1HE      LYS  16  24.112 -11.487  -1.030
  117    HE3  LYS  16           2HE      LYS  16  22.859 -11.654  -2.258
  118    HZ1  LYS  16           3HZ      LYS  16  23.625  -9.889  -3.339
  119    HZ2  LYS  16           1HZ      LYS  16  24.988  -9.942  -2.337
  120    HZ3  LYS  16           2HZ      LYS  16  23.683  -8.942  -1.939
  121    H    GLY  17           H        GLY  17  19.035 -11.564   2.004
  122    HA2  GLY  17           1HA      GLY  17  18.699 -14.426   1.342
  123    HA3  GLY  17           2HA      GLY  17  19.943 -13.832   2.432
  Start of MODEL   11
    1    HA   SER   1           HA       SER   1  12.767  10.336  11.375
    2    HG   SER   1           HG       SER   1   9.345   9.640  11.631
    3    H1   SER   1           1H       SER   1  11.886   9.005   8.940
    4    HB2  SER   1           1HB      SER   1  10.882   8.004  10.955
    5    HB3  SER   1           2HB      SER   1  11.223   8.760  12.511
    6    H    ALA   2           H        ALA   2  13.357   8.794  13.238
    7    HA   ALA   2           HA       ALA   2  15.821   7.631  12.730
    8    HB1  ALA   2           3HB      ALA   2  15.173   6.341  14.970
    9    HB2  ALA   2           1HB      ALA   2  15.603   8.051  14.948
   10    HB3  ALA   2           2HB      ALA   2  13.907   7.569  14.988
   11    H    ALA   3           H        ALA   3  12.669   6.025  13.129
   12    HA   ALA   3           HA       ALA   3  13.616   3.400  12.728
   13    HB1  ALA   3           3HB      ALA   3  11.397   2.733  12.744
   14    HB2  ALA   3           1HB      ALA   3  11.355   4.230  13.675
   15    HB3  ALA   3           2HB      ALA   3  10.837   4.225  11.989
   16    H    GLU   4           H        GLU   4  13.128   5.983  10.555
   17    HA   GLU   4           HA       GLU   4  12.765   4.285   8.228
   18    HB2  GLU   4           1HB      GLU   4  13.100   7.277   8.494
   19    HB3  GLU   4           2HB      GLU   4  12.812   6.439   6.975
   20    HG2  GLU   4           1HG      GLU   4  10.765   5.501   8.482
   21    HG3  GLU   4           2HG      GLU   4  10.956   7.127   9.135
   22    H    ALA   5           H        ALA   5  15.324   5.782   9.972
   23    HA   ALA   5           HA       ALA   5  17.206   5.616   7.761
   24    HB1  ALA   5           3HB      ALA   5  18.097   6.213  10.533
   25    HB2  ALA   5           1HB      ALA   5  18.622   6.908   8.999
   26    HB3  ALA   5           2HB      ALA   5  17.082   7.396   9.708
   27    H    TYR   6           H        TYR   6  16.285   3.823  10.597
   28    HA   TYR   6           HA       TYR   6  18.641   2.147  10.559
   29    HD1  TYR   6           HD2      TYR   6  19.116   0.065  12.486
   30    HD2  TYR   6           HD1      TYR   6  14.879   0.454  12.446
   31    HE1  TYR   6           HE2      TYR   6  18.898  -2.318  13.057
   32    HE2  TYR   6           HE1      TYR   6  14.649  -1.927  13.019
   33    HH   TYR   6           HH       TYR   6  16.053  -3.692  14.151
   34    HB2  TYR   6           1HB      TYR   6  17.894   2.321  12.727
   35    HB3  TYR   6           2HB      TYR   6  16.199   2.368  12.255
   36    H    ALA   7           H        ALA   7  15.185   1.282  10.457
   37    HA   ALA   7           HA       ALA   7  15.396  -1.243   9.443
   38    HB1  ALA   7           3HB      ALA   7  13.210  -0.981   9.777
   39    HB2  ALA   7           1HB      ALA   7  13.315   0.769   9.582
   40    HB3  ALA   7           2HB      ALA   7  13.142  -0.269   8.166
   41    H    LYS   8           H        LYS   8  16.077   1.700   7.817
   42    HA   LYS   8           HA       LYS   8  15.595   1.233   5.175
   43    HB2  LYS   8           1HB      LYS   8  16.917   3.151   6.469
   44    HB3  LYS   8           2HB      LYS   8  18.306   2.262   5.858
   45    HG2  LYS   8           1HG      LYS   8  16.965   2.419   3.590
   46    HG3  LYS   8           2HG      LYS   8  16.252   3.822   4.391
   47    HD2  LYS   8           1HD      LYS   8  18.964   4.074   4.892
   48    HD3  LYS   8           2HD      LYS   8  18.894   3.483   3.230
   49    HE2  LYS   8           1HE      LYS   8  17.152   5.747   4.137
   50    HE3  LYS   8           2HE      LYS   8  18.825   6.030   3.657
   51    HZ1  LYS   8           3HZ      LYS   8  17.677   6.337   1.701
   52    HZ2  LYS   8           1HZ      LYS   8  16.560   5.106   2.018
   53    HZ3  LYS   8           2HZ      LYS   8  18.142   4.716   1.562
   54    H    ARG   9           H        ARG   9  18.815   0.565   6.547
   55    HA   ARG   9           HA       ARG   9  19.687  -1.064   4.467
   56    HE   ARG   9           HE       ARG   9  19.913   2.393   8.890
   57    HB2  ARG   9           1HB      ARG   9  21.142  -2.048   6.495
   58    HB3  ARG   9           2HB      ARG   9  21.468  -0.487   5.753
   59    HG2  ARG   9           1HG      ARG   9  19.533  -0.452   7.966
   60    HG3  ARG   9           2HG      ARG   9  21.190  -0.876   8.402
   61    HD2  ARG   9           1HD      ARG   9  22.015   1.162   7.402
   62    HD3  ARG   9           2HD      ARG   9  20.400   1.566   6.820
   63   HH11  ARG   9          2HH1      ARG   9  22.687   0.305   9.142
   64   HH12  ARG   9          1HH1      ARG   9  22.990   0.691  10.803
   65   HH21  ARG   9          2HH2      ARG   9  20.301   2.909  11.078
   66   HH22  ARG   9          1HH2      ARG   9  21.632   2.171  11.904
   67    H    ILE  10           H        ILE  10  18.610  -2.145   7.695
   68    HA   ILE  10           HA       ILE  10  18.623  -4.808   7.496
   69    HB   ILE  10           HB       ILE  10  16.038  -3.606   8.402
   70   HG12  ILE  10          1HG1      ILE  10  17.555  -1.985   9.247
   71   HG13  ILE  10          2HG1      ILE  10  17.235  -3.083  10.585
   72   HG21  ILE  10          1HG2      ILE  10  16.204  -5.947   8.703
   73   HG22  ILE  10          2HG2      ILE  10  17.837  -5.819   9.354
   74   HG23  ILE  10          3HG2      ILE  10  16.466  -5.224  10.290
   75   HD11  ILE  10          3HD1      ILE  10  19.342  -4.062  10.436
   76   HD12  ILE  10          1HD1      ILE  10  19.618  -3.439   8.810
   77   HD13  ILE  10          2HD1      ILE  10  19.640  -2.341  10.190
   78    H    ALA  11           H        ALA  11  15.606  -3.122   6.626
   79    HA   ALA  11           HA       ALA  11  14.196  -5.030   5.409
   80    HB1  ALA  11           3HB      ALA  11  13.070  -3.074   5.256
   81    HB2  ALA  11           1HB      ALA  11  14.514  -2.148   4.844
   82    HB3  ALA  11           2HB      ALA  11  13.700  -3.109   3.609
   83    H    GLU  12           H        GLU  12  16.835  -3.259   3.814
   84    HA   GLU  12           HA       GLU  12  16.650  -4.559   1.330
   85    HB2  GLU  12           1HB      GLU  12  18.544  -2.789   2.683
   86    HB3  GLU  12           2HB      GLU  12  19.323  -3.919   1.586
   87    HG2  GLU  12           1HG      GLU  12  17.385  -3.101  -0.027
   88    HG3  GLU  12           2HG      GLU  12  17.475  -1.679   1.010
   89    H    ALA  13           H        ALA  13  19.117  -5.071   3.859
   90    HA   ALA  13           HA       ALA  13  20.329  -7.310   2.853
   91    HB1  ALA  13           3HB      ALA  13  21.424  -6.607   4.708
   92    HB2  ALA  13           1HB      ALA  13  19.937  -6.231   5.579
   93    HB3  ALA  13           2HB      ALA  13  20.486  -7.902   5.451
   94    H    MET  14           H        MET  14  17.226  -7.082   4.448
   95    HA   MET  14           HA       MET  14  16.940  -9.972   4.597
   96    HB2  MET  14           1HB      MET  14  15.027  -7.748   5.328
   97    HB3  MET  14           2HB      MET  14  14.735  -9.460   5.603
   98    HG2  MET  14           1HG      MET  14  17.136  -9.140   6.817
   99    HG3  MET  14           2HG      MET  14  16.397  -7.564   7.091
  100    HE1  MET  14           3HE      MET  14  16.262  -9.985  10.250
  101    HE2  MET  14           1HE      MET  14  17.376  -9.094   9.213
  102    HE3  MET  14           2HE      MET  14  16.148  -8.228  10.136
  103    H    ALA  15           H        ALA  15  17.160  -8.518   2.004
  104    HA   ALA  15           HA       ALA  15  14.658  -9.517   0.811
  105    HB1  ALA  15           3HB      ALA  15  14.276  -7.622  -0.336
  106    HB2  ALA  15           1HB      ALA  15  15.270  -6.882   0.919
  107    HB3  ALA  15           2HB      ALA  15  15.990  -7.328  -0.628
  108    H    LYS  16           H        LYS  16  18.114  -9.124   0.597
  109    HA   LYS  16           HA       LYS  16  18.687  -9.870  -1.978
  110    HB2  LYS  16           1HB      LYS  16  20.830 -10.511  -1.228
  111    HB3  LYS  16           2HB      LYS  16  20.302  -9.267  -0.103
  112    HG2  LYS  16           1HG      LYS  16  19.882 -10.830   1.599
  113    HG3  LYS  16           2HG      LYS  16  19.950 -12.190   0.476
  114    HD2  LYS  16           1HD      LYS  16  22.207 -12.283   0.524
  115    HD3  LYS  16           2HD      LYS  16  22.380 -10.528   0.609
  116    HE2  LYS  16           1HE      LYS  16  22.818 -10.708   2.778
  117    HE3  LYS  16           2HE      LYS  16  21.193 -11.344   3.030
  118    HZ1  LYS  16           3HZ      LYS  16  22.006 -13.562   2.685
  119    HZ2  LYS  16           1HZ      LYS  16  22.945 -12.818   3.879
  120    HZ3  LYS  16           2HZ      LYS  16  23.555 -12.993   2.312
  121    H    GLY  17           H        GLY  17  17.544 -11.877   0.652
  122    HA2  GLY  17           1HA      GLY  17  16.349 -13.838  -0.778
  123    HA3  GLY  17           2HA      GLY  17  18.029 -14.352  -0.760
  Start of MODEL   12
    1    HA   SER   1           HA       SER   1  16.577  10.013  10.381
    2    HG   SER   1           HG       SER   1  14.562  11.333  10.420
    3    H1   SER   1           1H       SER   1  16.328   7.743   8.528
    4    HB2  SER   1           1HB      SER   1  14.296   9.624   9.000
    5    HB3  SER   1           2HB      SER   1  13.990   8.558  10.372
    6    H    ALA   2           H        ALA   2  15.335   9.193  12.550
    7    HA   ALA   2           HA       ALA   2  17.039   7.377  13.765
    8    HB1  ALA   2           3HB      ALA   2  14.912   8.976  14.567
    9    HB2  ALA   2           1HB      ALA   2  14.428   7.337  15.003
   10    HB3  ALA   2           2HB      ALA   2  15.950   7.998  15.603
   11    H    ALA   3           H        ALA   3  13.866   6.820  12.295
   12    HA   ALA   3           HA       ALA   3  14.327   3.921  12.566
   13    HB1  ALA   3           3HB      ALA   3  11.884   5.580  12.794
   14    HB2  ALA   3           1HB      ALA   3  11.716   3.994  12.039
   15    HB3  ALA   3           2HB      ALA   3  12.359   4.129  13.677
   16    H    GLU   4           H        GLU   4  14.094   6.506  10.388
   17    HA   GLU   4           HA       GLU   4  13.162   4.970   8.132
   18    HB2  GLU   4           1HB      GLU   4  14.398   7.726   8.266
   19    HB3  GLU   4           2HB      GLU   4  13.674   7.010   6.833
   20    HG2  GLU   4           1HG      GLU   4  11.672   6.764   8.675
   21    HG3  GLU   4           2HG      GLU   4  12.420   8.294   9.130
   22    H    ALA   5           H        ALA   5  16.171   5.633   9.649
   23    HA   ALA   5           HA       ALA   5  17.715   4.870   7.291
   24    HB1  ALA   5           3HB      ALA   5  18.252   6.720   9.145
   25    HB2  ALA   5           1HB      ALA   5  19.075   5.341   9.874
   26    HB3  ALA   5           2HB      ALA   5  19.508   5.869   8.247
   27    H    TYR   6           H        TYR   6  16.679   3.616  10.375
   28    HA   TYR   6           HA       TYR   6  18.488   1.393  10.398
   29    HD1  TYR   6           HD2      TYR   6  18.433  -0.599  12.592
   30    HD2  TYR   6           HD1      TYR   6  14.416   0.740  12.172
   31    HE1  TYR   6           HE2      TYR   6  17.628  -2.815  13.289
   32    HE2  TYR   6           HE1      TYR   6  13.599  -1.473  12.869
   33    HH   TYR   6           HH       TYR   6  14.862  -3.489  14.439
   34    HB2  TYR   6           1HB      TYR   6  17.808   1.855  12.543
   35    HB3  TYR   6           2HB      TYR   6  16.178   2.297  12.048
   36    H    ALA   7           H        ALA   7  14.927   1.357  10.308
   37    HA   ALA   7           HA       ALA   7  14.472  -1.178   9.489
   38    HB1  ALA   7           3HB      ALA   7  13.046   1.366   8.823
   39    HB2  ALA   7           1HB      ALA   7  12.490  -0.173   8.164
   40    HB3  ALA   7           2HB      ALA   7  12.563   0.065   9.911
   41    H    LYS   8           H        LYS   8  15.316   1.537   7.372
   42    HA   LYS   8           HA       LYS   8  15.030   0.434   4.891
   43    HB2  LYS   8           1HB      LYS   8  16.143   2.721   5.833
   44    HB3  LYS   8           2HB      LYS   8  17.581   1.872   5.283
   45    HG2  LYS   8           1HG      LYS   8  17.092   2.878   3.336
   46    HG3  LYS   8           2HG      LYS   8  15.992   1.510   3.147
   47    HD2  LYS   8           1HD      LYS   8  14.691   3.538   4.677
   48    HD3  LYS   8           2HD      LYS   8  15.366   4.269   3.219
   49    HE2  LYS   8           1HE      LYS   8  14.184   2.752   1.818
   50    HE3  LYS   8           2HE      LYS   8  13.708   1.756   3.192
   51    HZ1  LYS   8           3HZ      LYS   8  12.875   4.517   3.362
   52    HZ2  LYS   8           1HZ      LYS   8  12.004   3.101   3.675
   53    HZ3  LYS   8           2HZ      LYS   8  12.172   3.656   2.087
   54    H    ARG   9           H        ARG   9  17.999   0.237   6.863
   55    HA   ARG   9           HA       ARG   9  19.408  -1.476   5.166
   56    HE   ARG   9           HE       ARG   9  22.376  -0.305   9.555
   57    HB2  ARG   9           1HB      ARG   9  19.818  -1.778   8.091
   58    HB3  ARG   9           2HB      ARG   9  20.997  -1.550   6.807
   59    HG2  ARG   9           1HG      ARG   9  19.792   0.847   6.743
   60    HG3  ARG   9           2HG      ARG   9  19.568   0.437   8.445
   61    HD2  ARG   9           1HD      ARG   9  22.256  -0.008   7.274
   62    HD3  ARG   9           2HD      ARG   9  21.753   1.663   7.533
   63   HH11  ARG   9          2HH1      ARG   9  20.835   2.731   8.831
   64   HH12  ARG   9          1HH1      ARG   9  20.894   3.301  10.466
   65   HH21  ARG   9          2HH2      ARG   9  22.460   0.433  11.712
   66   HH22  ARG   9          1HH2      ARG   9  21.820   1.993  12.104
   67    H    ILE  10           H        ILE  10  17.683  -2.338   8.171
   68    HA   ILE  10           HA       ILE  10  17.901  -4.990   8.300
   69    HB   ILE  10           HB       ILE  10  15.100  -3.944   8.397
   70   HG12  ILE  10          1HG1      ILE  10  16.252  -2.113   9.380
   71   HG13  ILE  10          2HG1      ILE  10  15.671  -3.090  10.723
   72   HG21  ILE  10          1HG2      ILE  10  16.738  -5.872  10.023
   73   HG22  ILE  10          2HG2      ILE  10  15.141  -5.313  10.516
   74   HG23  ILE  10          3HG2      ILE  10  15.333  -6.217   9.015
   75   HD11  ILE  10          3HD1      ILE  10  18.444  -3.409   9.642
   76   HD12  ILE  10          1HD1      ILE  10  18.048  -2.178  10.841
   77   HD13  ILE  10          2HD1      ILE  10  17.805  -3.884  11.216
   78    H    ALA  11           H        ALA  11  15.099  -3.686   6.526
   79    HA   ALA  11           HA       ALA  11  14.174  -5.836   5.242
   80    HB1  ALA  11           3HB      ALA  11  12.977  -4.040   4.580
   81    HB2  ALA  11           1HB      ALA  11  14.397  -3.001   4.460
   82    HB3  ALA  11           2HB      ALA  11  14.023  -4.138   3.164
   83    H    GLU  12           H        GLU  12  16.992  -3.972   4.134
   84    HA   GLU  12           HA       GLU  12  17.525  -5.513   1.844
   85    HB2  GLU  12           1HB      GLU  12  18.888  -3.443   3.397
   86    HB3  GLU  12           2HB      GLU  12  19.996  -4.590   2.656
   87    HG2  GLU  12           1HG      GLU  12  18.466  -4.125   0.543
   88    HG3  GLU  12           2HG      GLU  12  18.191  -2.608   1.399
   89    H    ALA  13           H        ALA  13  19.304  -5.539   4.939
   90    HA   ALA  13           HA       ALA  13  20.753  -7.880   4.404
   91    HB1  ALA  13           3HB      ALA  13  20.780  -7.902   7.061
   92    HB2  ALA  13           1HB      ALA  13  21.713  -6.739   6.119
   93    HB3  ALA  13           2HB      ALA  13  20.165  -6.266   6.821
   94    H    MET  14           H        MET  14  17.474  -7.507   4.993
   95    HA   MET  14           HA       MET  14  17.226 -10.297   5.907
   96    HB2  MET  14           1HB      MET  14  15.434  -9.752   7.212
   97    HB3  MET  14           2HB      MET  14  16.274  -8.208   7.255
   98    HG2  MET  14           1HG      MET  14  14.305  -7.357   6.653
   99    HG3  MET  14           2HG      MET  14  14.739  -7.913   5.039
  100    HE1  MET  14           3HE      MET  14  12.665  -8.122   8.059
  101    HE2  MET  14           1HE      MET  14  11.515  -7.677   6.798
  102    HE3  MET  14           2HE      MET  14  11.337  -9.210   7.652
  103    H    ALA  15           H        ALA  15  17.256  -8.704   3.170
  104    HA   ALA  15           HA       ALA  15  14.916 -10.097   2.039
  105    HB1  ALA  15           3HB      ALA  15  14.462  -7.879   1.607
  106    HB2  ALA  15           1HB      ALA  15  16.161  -7.464   1.379
  107    HB3  ALA  15           2HB      ALA  15  15.297  -8.364   0.131
  108    H    LYS  16           H        LYS  16  18.313  -9.261   1.561
  109    HA   LYS  16           HA       LYS  16  18.567 -10.820  -0.839
  110    HB2  LYS  16           1HB      LYS  16  20.002  -8.901  -0.549
  111    HB3  LYS  16           2HB      LYS  16  20.619  -9.537   0.971
  112    HG2  LYS  16           1HG      LYS  16  21.643 -11.407  -0.243
  113    HG3  LYS  16           2HG      LYS  16  21.054 -10.727  -1.762
  114    HD2  LYS  16           1HD      LYS  16  22.561  -8.848  -0.087
  115    HD3  LYS  16           2HD      LYS  16  23.500 -10.223  -0.672
  116    HE2  LYS  16           1HE      LYS  16  23.238  -9.631  -2.883
  117    HE3  LYS  16           2HE      LYS  16  21.751  -8.735  -2.576
  118    HZ1  LYS  16           3HZ      LYS  16  23.848  -7.412  -3.089
  119    HZ2  LYS  16           1HZ      LYS  16  24.349  -7.804  -1.522
  120    HZ3  LYS  16           2HZ      LYS  16  22.928  -6.919  -1.758
  121    H    GLY  17           H        GLY  17  19.798 -11.168   2.493
  122    HA2  GLY  17           1HA      GLY  17  20.824 -13.793   2.038
  123    HA3  GLY  17           2HA      GLY  17  20.626 -13.011   3.599
  Start of MODEL   13
    1    HA   SER   1           HA       SER   1  15.356   9.841  10.500
    2    HG   SER   1           HG       SER   1  14.765  11.678  11.738
    3    H1   SER   1           1H       SER   1  12.999   8.524   9.549
    4    HB2  SER   1           1HB      SER   1  12.553  10.215  10.731
    5    HB3  SER   1           2HB      SER   1  13.191  10.062  12.368
    6    H    ALA   2           H        ALA   2  12.992   8.069  12.474
    7    HA   ALA   2           HA       ALA   2  15.239   6.980  14.031
    8    HB1  ALA   2           3HB      ALA   2  14.031   8.063  15.619
    9    HB2  ALA   2           1HB      ALA   2  12.510   7.884  14.745
   10    HB3  ALA   2           2HB      ALA   2  13.174   6.522  15.648
   11    H    ALA   3           H        ALA   3  12.614   6.146  11.982
   12    HA   ALA   3           HA       ALA   3  13.153   3.295  12.477
   13    HB1  ALA   3           3HB      ALA   3  10.509   3.482  11.551
   14    HB2  ALA   3           1HB      ALA   3  11.063   2.991  13.152
   15    HB3  ALA   3           2HB      ALA   3  10.672   4.682  12.834
   16    H    GLU   4           H        GLU   4  13.194   5.811  10.316
   17    HA   GLU   4           HA       GLU   4  12.693   4.112   7.980
   18    HB2  GLU   4           1HB      GLU   4  13.313   7.048   7.861
   19    HB3  GLU   4           2HB      GLU   4  12.425   6.062   6.708
   20    HG2  GLU   4           1HG      GLU   4  10.971   5.880   9.074
   21    HG3  GLU   4           2HG      GLU   4  11.463   7.569   8.964
   22    H    ALA   5           H        ALA   5  15.217   5.595   9.787
   23    HA   ALA   5           HA       ALA   5  17.168   5.372   7.645
   24    HB1  ALA   5           3HB      ALA   5  16.991   6.781  10.159
   25    HB2  ALA   5           1HB      ALA   5  18.528   5.931  10.006
   26    HB3  ALA   5           2HB      ALA   5  18.032   7.086   8.768
   27    H    TYR   6           H        TYR   6  16.228   3.698  10.577
   28    HA   TYR   6           HA       TYR   6  18.513   1.929  10.511
   29    HD1  TYR   6           HD1      TYR   6  18.952  -0.149  12.394
   30    HD2  TYR   6           HD2      TYR   6  14.764   0.524  12.716
   31    HE1  TYR   6           HE1      TYR   6  18.633  -2.494  13.065
   32    HE2  TYR   6           HE2      TYR   6  14.433  -1.818  13.389
   33    HH   TYR   6           HH       TYR   6  17.181  -4.002  13.853
   34    HB2  TYR   6           1HB      TYR   6  17.874   2.205  12.700
   35    HB3  TYR   6           2HB      TYR   6  16.165   2.329  12.300
   36    H    ALA   7           H        ALA   7  15.030   1.187  10.601
   37    HA   ALA   7           HA       ALA   7  15.117  -1.381   9.669
   38    HB1  ALA   7           3HB      ALA   7  12.800  -0.839   8.675
   39    HB2  ALA   7           1HB      ALA   7  13.037  -0.662  10.414
   40    HB3  ALA   7           2HB      ALA   7  13.046   0.762   9.372
   41    H    LYS   8           H        LYS   8  15.794   1.485   7.912
   42    HA   LYS   8           HA       LYS   8  15.159   0.776   5.302
   43    HB2  LYS   8           1HB      LYS   8  16.787   2.756   6.612
   44    HB3  LYS   8           2HB      LYS   8  17.624   2.144   5.192
   45    HG2  LYS   8           1HG      LYS   8  14.765   3.005   5.022
   46    HG3  LYS   8           2HG      LYS   8  16.075   4.186   4.949
   47    HD2  LYS   8           1HD      LYS   8  16.943   2.305   3.183
   48    HD3  LYS   8           2HD      LYS   8  15.194   2.213   2.961
   49    HE2  LYS   8           1HE      LYS   8  15.757   3.855   1.450
   50    HE3  LYS   8           2HE      LYS   8  15.359   4.817   2.872
   51    HZ1  LYS   8           3HZ      LYS   8  17.494   5.439   3.161
   52    HZ2  LYS   8           1HZ      LYS   8  17.597   5.130   1.501
   53    HZ3  LYS   8           2HZ      LYS   8  18.132   3.972   2.611
   54    H    ARG   9           H        ARG   9  18.476   0.644   6.601
   55    HA   ARG   9           HA       ARG   9  19.565  -0.955   4.637
   56    HE   ARG   9           HE       ARG   9  22.728   2.591   8.306
   57    HB2  ARG   9           1HB      ARG   9  20.502  -1.393   7.428
   58    HB3  ARG   9           2HB      ARG   9  21.431  -1.101   5.964
   59    HG2  ARG   9           1HG      ARG   9  20.219   1.277   6.199
   60    HG3  ARG   9           2HG      ARG   9  20.287   0.805   7.899
   61    HD2  ARG   9           1HD      ARG   9  22.797   0.180   6.792
   62    HD3  ARG   9           2HD      ARG   9  22.378   1.788   6.201
   63   HH11  ARG   9          2HH1      ARG   9  22.198  -0.844   8.501
   64   HH12  ARG   9          1HH1      ARG   9  22.541  -0.933  10.197
   65   HH21  ARG   9          2HH2      ARG   9  23.182   2.487  10.539
   66   HH22  ARG   9          1HH2      ARG   9  23.099   0.963  11.355
   67    H    ILE  10           H        ILE  10  18.455  -2.082   7.838
   68    HA   ILE  10           HA       ILE  10  18.781  -4.732   7.715
   69    HB   ILE  10           HB       ILE  10  16.034  -3.813   8.458
   70   HG12  ILE  10          1HG1      ILE  10  17.298  -2.009   9.334
   71   HG13  ILE  10          2HG1      ILE  10  17.057  -3.111  10.685
   72   HG21  ILE  10          1HG2      ILE  10  16.452  -6.112   8.836
   73   HG22  ILE  10          2HG2      ILE  10  18.022  -5.779   9.565
   74   HG23  ILE  10          3HG2      ILE  10  16.543  -5.326  10.412
   75   HD11  ILE  10          3HD1      ILE  10  19.470  -3.817   9.358
   76   HD12  ILE  10          1HD1      ILE  10  19.475  -2.081   9.672
   77   HD13  ILE  10          2HD1      ILE  10  19.238  -3.217  11.001
   78    H    ALA  11           H        ALA  11  15.643  -3.420   6.653
   79    HA   ALA  11           HA       ALA  11  14.537  -5.514   5.414
   80    HB1  ALA  11           3HB      ALA  11  13.683  -3.841   3.653
   81    HB2  ALA  11           1HB      ALA  11  13.295  -3.549   5.349
   82    HB3  ALA  11           2HB      ALA  11  14.592  -2.640   4.571
   83    H    GLU  12           H        GLU  12  17.016  -3.447   3.928
   84    HA   GLU  12           HA       GLU  12  17.106  -4.768   1.448
   85    HB2  GLU  12           1HB      GLU  12  18.707  -2.777   2.873
   86    HB3  GLU  12           2HB      GLU  12  19.667  -3.810   1.823
   87    HG2  GLU  12           1HG      GLU  12  17.724  -3.237   0.114
   88    HG3  GLU  12           2HG      GLU  12  17.594  -1.810   1.141
   89    H    ALA  13           H        ALA  13  19.480  -4.974   4.107
   90    HA   ALA  13           HA       ALA  13  20.841  -7.204   3.080
   91    HB1  ALA  13           3HB      ALA  13  21.955  -5.884   4.689
   92    HB2  ALA  13           1HB      ALA  13  20.649  -6.073   5.859
   93    HB3  ALA  13           2HB      ALA  13  21.677  -7.448   5.455
   94    H    MET  14           H        MET  14  17.760  -6.999   4.413
   95    HA   MET  14           HA       MET  14  17.773  -9.859   5.118
   96    HB2  MET  14           1HB      MET  14  16.266  -9.477   6.790
   97    HB3  MET  14           2HB      MET  14  17.055  -7.906   6.779
   98    HG2  MET  14           1HG      MET  14  14.983  -7.098   6.645
   99    HG3  MET  14           2HG      MET  14  15.098  -7.527   4.940
  100    HE1  MET  14           3HE      MET  14  12.400  -9.238   8.118
  101    HE2  MET  14           1HE      MET  14  14.110  -9.529   8.436
  102    HE3  MET  14           2HE      MET  14  13.524  -7.881   8.209
  103    H    ALA  15           H        ALA  15  17.207  -8.088   2.554
  104    HA   ALA  15           HA       ALA  15  14.740  -9.519   1.805
  105    HB1  ALA  15           3HB      ALA  15  14.253  -7.199   1.797
  106    HB2  ALA  15           1HB      ALA  15  15.743  -6.820   0.932
  107    HB3  ALA  15           2HB      ALA  15  14.440  -7.681   0.111
  108    H    LYS  16           H        LYS  16  18.040  -8.842   1.040
  109    HA   LYS  16           HA       LYS  16  18.230  -9.429  -1.640
  110    HB2  LYS  16           1HB      LYS  16  20.505  -9.838  -1.293
  111    HB3  LYS  16           2HB      LYS  16  20.071  -8.781   0.044
  112    HG2  LYS  16           1HG      LYS  16  19.800 -10.833   1.457
  113    HG3  LYS  16           2HG      LYS  16  20.490 -11.758   0.121
  114    HD2  LYS  16           1HD      LYS  16  22.466 -10.176   0.226
  115    HD3  LYS  16           2HD      LYS  16  21.796  -9.589   1.750
  116    HE2  LYS  16           1HE      LYS  16  22.017 -11.731   2.763
  117    HE3  LYS  16           2HE      LYS  16  22.392 -12.492   1.217
  118    HZ1  LYS  16           3HZ      LYS  16  24.516 -12.175   1.713
  119    HZ2  LYS  16           1HZ      LYS  16  24.141 -11.227   3.063
  120    HZ3  LYS  16           2HZ      LYS  16  24.273 -10.510   1.537
  121    H    GLY  17           H        GLY  17  17.867 -11.652   1.068
  122    HA2  GLY  17           1HA      GLY  17  18.106 -13.974  -0.669
  123    HA3  GLY  17           2HA      GLY  17  17.849 -13.993   1.069
  Start of MODEL   14
    1    HA   SER   1           HA       SER   1  13.732  10.640  12.524
    2    HG   SER   1           HG       SER   1  10.380  10.324  12.888
    3    H1   SER   1           1H       SER   1  12.974   9.870   9.854
    4    HB2  SER   1           1HB      SER   1  11.492   9.225  11.255
    5    HB3  SER   1           2HB      SER   1  11.937   8.584  12.836
    6    H    ALA   2           H        ALA   2  13.571   8.561  14.124
    7    HA   ALA   2           HA       ALA   2  16.022   7.152  13.659
    8    HB1  ALA   2           3HB      ALA   2  15.666   7.727  15.893
    9    HB2  ALA   2           1HB      ALA   2  14.001   7.144  15.875
   10    HB3  ALA   2           2HB      ALA   2  15.339   5.995  15.843
   11    H    ALA   3           H        ALA   3  12.722   6.547  12.991
   12    HA   ALA   3           HA       ALA   3  13.092   3.657  12.819
   13    HB1  ALA   3           3HB      ALA   3  10.647   3.731  12.125
   14    HB2  ALA   3           1HB      ALA   3  11.023   4.224  13.776
   15    HB3  ALA   3           2HB      ALA   3  10.693   5.443  12.544
   16    H    GLU   4           H        GLU   4  13.260   6.426  10.837
   17    HA   GLU   4           HA       GLU   4  12.744   4.960   8.374
   18    HB2  GLU   4           1HB      GLU   4  12.581   6.991   7.315
   19    HB3  GLU   4           2HB      GLU   4  12.122   7.457   8.947
   20    HG2  GLU   4           1HG      GLU   4  14.311   8.327   9.379
   21    HG3  GLU   4           2HG      GLU   4  14.906   7.712   7.838
   22    H    ALA   5           H        ALA   5  15.385   5.949  10.343
   23    HA   ALA   5           HA       ALA   5  17.338   5.598   8.207
   24    HB1  ALA   5           3HB      ALA   5  17.899   6.191  11.103
   25    HB2  ALA   5           1HB      ALA   5  18.960   6.442   9.717
   26    HB3  ALA   5           2HB      ALA   5  17.517   7.437   9.915
   27    H    TYR   6           H        TYR   6  15.948   3.858  10.843
   28    HA   TYR   6           HA       TYR   6  18.087   1.912  10.988
   29    HD1  TYR   6           HD1      TYR   6  18.093  -0.260  12.923
   30    HD2  TYR   6           HD2      TYR   6  13.974   0.637  12.351
   31    HE1  TYR   6           HE1      TYR   6  17.525  -2.612  13.368
   32    HE2  TYR   6           HE2      TYR   6  13.394  -1.711  12.796
   33    HH   TYR   6           HH       TYR   6  14.237  -3.810  12.990
   34    HB2  TYR   6           1HB      TYR   6  17.144   2.111  13.076
   35    HB3  TYR   6           2HB      TYR   6  15.527   2.387  12.439
   36    H    ALA   7           H        ALA   7  14.585   1.453  10.535
   37    HA   ALA   7           HA       ALA   7  14.587  -1.036   9.440
   38    HB1  ALA   7           3HB      ALA   7  12.520  -0.278   8.161
   39    HB2  ALA   7           1HB      ALA   7  12.501  -0.071   9.913
   40    HB3  ALA   7           2HB      ALA   7  12.808   1.314   8.863
   41    H    LYS   8           H        LYS   8  15.061   2.013   7.690
   42    HA   LYS   8           HA       LYS   8  15.046   1.383   5.102
   43    HB2  LYS   8           1HB      LYS   8  16.557   3.229   6.711
   44    HB3  LYS   8           2HB      LYS   8  17.558   2.637   5.391
   45    HG2  LYS   8           1HG      LYS   8  14.790   3.703   4.939
   46    HG3  LYS   8           2HG      LYS   8  16.212   4.748   4.975
   47    HD2  LYS   8           1HD      LYS   8  16.934   4.041   2.961
   48    HD3  LYS   8           2HD      LYS   8  16.464   2.367   3.269
   49    HE2  LYS   8           1HE      LYS   8  14.136   2.929   2.804
   50    HE3  LYS   8           2HE      LYS   8  14.586   4.611   2.531
   51    HZ1  LYS   8           3HZ      LYS   8  14.309   3.153   0.500
   52    HZ2  LYS   8           1HZ      LYS   8  15.756   2.402   0.949
   53    HZ3  LYS   8           2HZ      LYS   8  15.737   4.054   0.589
   54    H    ARG   9           H        ARG   9  17.913   0.740   7.129
   55    HA   ARG   9           HA       ARG   9  19.273  -0.751   5.150
   56    HE   ARG   9           HE       ARG   9  23.384  -1.585   6.782
   57    HB2  ARG   9           1HB      ARG   9  19.580  -0.458   8.123
   58    HB3  ARG   9           2HB      ARG   9  20.553  -1.623   7.234
   59    HG2  ARG   9           1HG      ARG   9  20.466   1.172   6.237
   60    HG3  ARG   9           2HG      ARG   9  21.396   0.830   7.697
   61    HD2  ARG   9           1HD      ARG   9  21.757  -0.936   5.328
   62    HD3  ARG   9           2HD      ARG   9  22.486   0.669   5.301
   63   HH11  ARG   9          2HH1      ARG   9  23.134   1.886   6.879
   64   HH12  ARG   9          1HH1      ARG   9  24.490   2.084   7.939
   65   HH21  ARG   9          2HH2      ARG   9  25.171  -1.337   8.178
   66   HH22  ARG   9          1HH2      ARG   9  25.648   0.250   8.677
   67    H    ILE  10           H        ILE  10  17.900  -1.962   8.213
   68    HA   ILE  10           HA       ILE  10  18.033  -4.607   7.944
   69    HB   ILE  10           HB       ILE  10  15.318  -3.546   8.612
   70   HG12  ILE  10          1HG1      ILE  10  16.661  -1.882   9.645
   71   HG13  ILE  10          2HG1      ILE  10  16.265  -3.032  10.918
   72   HG21  ILE  10          1HG2      ILE  10  15.571  -5.887   8.871
   73   HG22  ILE  10          2HG2      ILE  10  17.116  -5.697   9.699
   74   HG23  ILE  10          3HG2      ILE  10  15.624  -5.196  10.493
   75   HD11  ILE  10          3HD1      ILE  10  18.676  -3.893   9.736
   76   HD12  ILE  10          1HD1      ILE  10  18.816  -2.159  10.026
   77   HD13  ILE  10          2HD1      ILE  10  18.417  -3.247  11.356
   78    H    ALA  11           H        ALA  11  15.044  -3.027   6.818
   79    HA   ALA  11           HA       ALA  11  13.855  -4.959   5.413
   80    HB1  ALA  11           3HB      ALA  11  12.721  -2.963   5.319
   81    HB2  ALA  11           1HB      ALA  11  14.146  -2.051   4.821
   82    HB3  ALA  11           2HB      ALA  11  13.315  -3.090   3.663
   83    H    GLU  12           H        GLU  12  16.541  -3.009   4.137
   84    HA   GLU  12           HA       GLU  12  16.668  -4.236   1.612
   85    HB2  GLU  12           1HB      GLU  12  18.324  -2.417   3.193
   86    HB3  GLU  12           2HB      GLU  12  19.266  -3.471   2.148
   87    HG2  GLU  12           1HG      GLU  12  17.453  -2.701   0.374
   88    HG3  GLU  12           2HG      GLU  12  17.367  -1.309   1.452
   89    H    ALA  13           H        ALA  13  18.892  -4.708   4.364
   90    HA   ALA  13           HA       ALA  13  20.261  -6.896   3.375
   91    HB1  ALA  13           3HB      ALA  13  20.163  -7.380   6.089
   92    HB2  ALA  13           1HB      ALA  13  21.340  -6.366   5.252
   93    HB3  ALA  13           2HB      ALA  13  19.901  -5.640   5.969
   94    H    MET  14           H        MET  14  17.014  -6.719   4.406
   95    HA   MET  14           HA       MET  14  16.788  -9.555   4.991
   96    HB2  MET  14           1HB      MET  14  14.709  -7.363   4.871
   97    HB3  MET  14           2HB      MET  14  14.379  -9.027   5.335
   98    HG2  MET  14           1HG      MET  14  16.505  -8.215   6.951
   99    HG3  MET  14           2HG      MET  14  15.391  -6.851   6.911
  100    HE1  MET  14           3HE      MET  14  16.083 -10.419   7.613
  101    HE2  MET  14           1HE      MET  14  14.858 -10.949   8.767
  102    HE3  MET  14           2HE      MET  14  14.500 -10.949   7.040
  103    H    ALA  15           H        ALA  15  17.444  -8.314   2.260
  104    HA   ALA  15           HA       ALA  15  15.300  -9.632   0.728
  105    HB1  ALA  15           3HB      ALA  15  16.005  -7.089   0.440
  106    HB2  ALA  15           1HB      ALA  15  17.208  -7.811  -0.629
  107    HB3  ALA  15           2HB      ALA  15  15.490  -8.080  -0.925
  108    H    LYS  16           H        LYS  16  18.480  -9.941   1.740
  109    HA   LYS  16           HA       LYS  16  19.483 -11.310  -0.597
  110    HB2  LYS  16           1HB      LYS  16  20.683 -10.011   1.497
  111    HB3  LYS  16           2HB      LYS  16  20.918 -11.697   1.938
  112    HG2  LYS  16           1HG      LYS  16  21.757 -11.948  -0.507
  113    HG3  LYS  16           2HG      LYS  16  21.957 -10.196  -0.423
  114    HD2  LYS  16           1HD      LYS  16  23.594 -10.329   1.200
  115    HD3  LYS  16           2HD      LYS  16  23.049 -11.909   1.768
  116    HE2  LYS  16           1HE      LYS  16  23.876 -12.917  -0.320
  117    HE3  LYS  16           2HE      LYS  16  24.459 -11.336  -0.838
  118    HZ1  LYS  16           3HZ      LYS  16  25.371 -12.193   1.774
  119    HZ2  LYS  16           1HZ      LYS  16  26.226 -11.451   0.517
  120    HZ3  LYS  16           2HZ      LYS  16  25.945 -13.119   0.480
  121    H    GLY  17           H        GLY  17  17.220 -12.583  -0.044
  122    HA2  GLY  17           1HA      GLY  17  17.750 -15.230   0.045
  123    HA3  GLY  17           2HA      GLY  17  17.652 -14.812   1.749
  Start of MODEL   15
    1    HA   SER   1           HA       SER   1  13.991  10.856  11.439
    2    HG   SER   1           HG       SER   1  11.208  11.220  10.252
    3    H1   SER   1           1H       SER   1  13.022  10.488   8.922
    4    HB2  SER   1           1HB      SER   1  11.716   9.114  10.492
    5    HB3  SER   1           2HB      SER   1  12.051   9.376  12.204
    6    H    ALA   2           H        ALA   2  13.980   9.106  13.234
    7    HA   ALA   2           HA       ALA   2  16.224   7.475  12.880
    8    HB1  ALA   2           3HB      ALA   2  16.092   7.349  15.091
    9    HB2  ALA   2           1HB      ALA   2  14.565   8.229  15.012
   10    HB3  ALA   2           2HB      ALA   2  14.569   6.465  14.993
   11    H    ALA   3           H        ALA   3  12.777   6.591  13.024
   12    HA   ALA   3           HA       ALA   3  13.154   3.833  12.596
   13    HB1  ALA   3           3HB      ALA   3  11.066   5.124  13.415
   14    HB2  ALA   3           1HB      ALA   3  10.683   5.262  11.699
   15    HB3  ALA   3           2HB      ALA   3  10.848   3.670  12.441
   16    H    GLU   4           H        GLU   4  13.407   6.493  10.480
   17    HA   GLU   4           HA       GLU   4  12.873   4.933   8.084
   18    HB2  GLU   4           1HB      GLU   4  13.727   7.807   8.462
   19    HB3  GLU   4           2HB      GLU   4  13.423   7.062   6.899
   20    HG2  GLU   4           1HG      GLU   4  11.174   6.587   8.567
   21    HG3  GLU   4           2HG      GLU   4  11.585   8.299   8.653
   22    H    ALA   5           H        ALA   5  15.532   5.891  10.042
   23    HA   ALA   5           HA       ALA   5  17.491   5.346   7.950
   24    HB1  ALA   5           3HB      ALA   5  17.975   6.130  10.820
   25    HB2  ALA   5           1HB      ALA   5  19.146   6.139   9.500
   26    HB3  ALA   5           2HB      ALA   5  17.793   7.271   9.487
   27    H    TYR   6           H        TYR   6  16.040   3.844  10.713
   28    HA   TYR   6           HA       TYR   6  18.075   1.818  10.993
   29    HD1  TYR   6           HD1      TYR   6  17.928  -0.256  13.047
   30    HD2  TYR   6           HD2      TYR   6  13.873   0.776  12.272
   31    HE1  TYR   6           HE1      TYR   6  17.245  -2.556  13.591
   32    HE2  TYR   6           HE2      TYR   6  13.179  -1.520  12.815
   33    HH   TYR   6           HH       TYR   6  14.247  -3.456  14.334
   34    HB2  TYR   6           1HB      TYR   6  17.081   2.154  13.037
   35    HB3  TYR   6           2HB      TYR   6  15.496   2.465  12.337
   36    H    ALA   7           H        ALA   7  14.574   1.475  10.430
   37    HA   ALA   7           HA       ALA   7  14.498  -1.072   9.490
   38    HB1  ALA   7           3HB      ALA   7  12.391  -0.261   9.631
   39    HB2  ALA   7           1HB      ALA   7  12.843   1.328   9.012
   40    HB3  ALA   7           2HB      ALA   7  12.618  -0.022   7.898
   41    H    LYS   8           H        LYS   8  15.221   1.829   7.582
   42    HA   LYS   8           HA       LYS   8  15.289   1.039   5.040
   43    HB2  LYS   8           1HB      LYS   8  16.182   3.205   5.941
   44    HB3  LYS   8           2HB      LYS   8  17.682   2.369   6.319
   45    HG2  LYS   8           1HG      LYS   8  18.385   2.411   4.196
   46    HG3  LYS   8           2HG      LYS   8  16.785   2.035   3.553
   47    HD2  LYS   8           1HD      LYS   8  17.072   4.711   4.748
   48    HD3  LYS   8           2HD      LYS   8  18.011   4.433   3.280
   49    HE2  LYS   8           1HE      LYS   8  16.004   5.218   2.441
   50    HE3  LYS   8           2HE      LYS   8  15.790   3.471   2.347
   51    HZ1  LYS   8           3HZ      LYS   8  14.406   5.413   3.978
   52    HZ2  LYS   8           1HZ      LYS   8  14.857   4.006   4.802
   53    HZ3  LYS   8           2HZ      LYS   8  13.889   3.903   3.419
   54    H    ARG   9           H        ARG   9  18.022   0.374   7.237
   55    HA   ARG   9           HA       ARG   9  19.383  -1.310   5.423
   56    HE   ARG   9           HE       ARG   9  23.344  -0.763   8.095
   57    HB2  ARG   9           1HB      ARG   9  19.568  -0.849   8.384
   58    HB3  ARG   9           2HB      ARG   9  20.512  -2.119   7.618
   59    HG2  ARG   9           1HG      ARG   9  20.633   0.608   6.452
   60    HG3  ARG   9           2HG      ARG   9  21.474   0.307   7.974
   61    HD2  ARG   9           1HD      ARG   9  21.921  -1.779   5.992
   62    HD3  ARG   9           2HD      ARG   9  22.456  -0.190   5.448
   63   HH11  ARG   9          2HH1      ARG   9  23.990  -1.385   4.731
   64   HH12  ARG   9          1HH1      ARG   9  25.677  -1.692   4.977
   65   HH21  ARG   9          2HH2      ARG   9  25.564  -1.166   8.432
   66   HH22  ARG   9          1HH2      ARG   9  26.571  -1.569   7.083
   67    H    ILE  10           H        ILE  10  17.807  -2.255   8.482
   68    HA   ILE  10           HA       ILE  10  17.799  -4.913   8.379
   69    HB   ILE  10           HB       ILE  10  15.119  -3.667   8.840
   70   HG12  ILE  10          1HG1      ILE  10  16.510  -2.018   9.837
   71   HG13  ILE  10          2HG1      ILE  10  15.978  -3.058  11.155
   72   HG21  ILE  10          1HG2      ILE  10  15.228  -5.999   9.250
   73   HG22  ILE  10          2HG2      ILE  10  16.737  -5.840  10.148
   74   HG23  ILE  10          3HG2      ILE  10  15.236  -5.211  10.827
   75   HD11  ILE  10          3HD1      ILE  10  18.072  -4.053  11.368
   76   HD12  ILE  10          1HD1      ILE  10  18.599  -3.498   9.779
   77   HD13  ILE  10          2HD1      ILE  10  18.423  -2.345  11.102
   78    H    ALA  11           H        ALA  11  14.963  -3.249   7.005
   79    HA   ALA  11           HA       ALA  11  13.737  -5.201   5.660
   80    HB1  ALA  11           3HB      ALA  11  13.435  -3.392   3.762
   81    HB2  ALA  11           1HB      ALA  11  12.694  -3.194   5.350
   82    HB3  ALA  11           2HB      ALA  11  14.192  -2.347   4.963
   83    H    GLU  12           H        GLU  12  16.586  -3.477   4.410
   84    HA   GLU  12           HA       GLU  12  16.766  -4.865   1.973
   85    HB2  GLU  12           1HB      GLU  12  18.441  -3.039   3.524
   86    HB3  GLU  12           2HB      GLU  12  19.373  -4.204   2.594
   87    HG2  GLU  12           1HG      GLU  12  17.692  -3.454   0.687
   88    HG3  GLU  12           2HG      GLU  12  17.631  -1.994   1.673
   89    H    ALA  13           H        ALA  13  18.824  -5.279   4.860
   90    HA   ALA  13           HA       ALA  13  20.138  -7.575   4.091
   91    HB1  ALA  13           3HB      ALA  13  20.009  -8.004   6.728
   92    HB2  ALA  13           1HB      ALA  13  21.053  -6.782   6.003
   93    HB3  ALA  13           2HB      ALA  13  19.496  -6.318   6.689
   94    H    MET  14           H        MET  14  16.838  -7.206   4.917
   95    HA   MET  14           HA       MET  14  16.484 -10.058   5.448
   96    HB2  MET  14           1HB      MET  14  14.607  -7.702   5.617
   97    HB3  MET  14           2HB      MET  14  14.078  -9.365   5.834
   98    HG2  MET  14           1HG      MET  14  15.819  -9.528   7.666
   99    HG3  MET  14           2HG      MET  14  15.958  -7.775   7.547
  100    HE1  MET  14           3HE      MET  14  14.823 -10.491   9.215
  101    HE2  MET  14           1HE      MET  14  14.619  -9.356  10.550
  102    HE3  MET  14           2HE      MET  14  13.224 -10.226   9.912
  103    H    ALA  15           H        ALA  15  17.185  -8.852   2.782
  104    HA   ALA  15           HA       ALA  15  14.979 -10.082   1.268
  105    HB1  ALA  15           3HB      ALA  15  15.847  -7.372   1.147
  106    HB2  ALA  15           1HB      ALA  15  16.227  -8.157  -0.386
  107    HB3  ALA  15           2HB      ALA  15  14.572  -8.168   0.225
  108    H    LYS  16           H        LYS  16  18.343  -8.938   0.930
  109    HA   LYS  16           HA       LYS  16  19.110 -10.421  -1.251
  110    HB2  LYS  16           1HB      LYS  16  20.547  -8.738  -0.220
  111    HB3  LYS  16           2HB      LYS  16  20.754  -9.756   1.199
  112    HG2  LYS  16           1HG      LYS  16  22.587 -10.542   0.232
  113    HG3  LYS  16           2HG      LYS  16  21.529 -11.376  -0.909
  114    HD2  LYS  16           1HD      LYS  16  22.666 -10.211  -2.461
  115    HD3  LYS  16           2HD      LYS  16  21.605  -8.883  -1.986
  116    HE2  LYS  16           1HE      LYS  16  23.699  -7.911  -1.857
  117    HE3  LYS  16           2HE      LYS  16  23.416  -8.413  -0.191
  118    HZ1  LYS  16           3HZ      LYS  16  25.660  -8.959  -1.083
  119    HZ2  LYS  16           1HZ      LYS  16  24.926 -10.044  -2.154
  120    HZ3  LYS  16           2HZ      LYS  16  24.808 -10.293  -0.485
  121    H    GLY  17           H        GLY  17  19.632 -11.400   2.148
  122    HA2  GLY  17           1HA      GLY  17  19.228 -14.191   1.311
  123    HA3  GLY  17           2HA      GLY  17  20.691 -13.762   2.186
  Start of MODEL   16
    1    HA   SER   1           HA       SER   1  14.113  10.512  11.317
    2    HG   SER   1           HG       SER   1  12.189  11.075  11.428
    3    H1   SER   1           1H       SER   1  14.492   8.897   8.888
    4    HB2  SER   1           1HB      SER   1  12.237   9.389   9.590
    5    HB3  SER   1           2HB      SER   1  12.236   8.313  10.987
    6    H    ALA   2           H        ALA   2  13.359   8.976  13.218
    7    HA   ALA   2           HA       ALA   2  15.631   7.455  13.947
    8    HB1  ALA   2           3HB      ALA   2  14.780   7.648  15.993
    9    HB2  ALA   2           1HB      ALA   2  13.458   8.567  15.271
   10    HB3  ALA   2           2HB      ALA   2  13.290   6.829  15.524
   11    H    ALA   3           H        ALA   3  12.319   6.508  13.060
   12    HA   ALA   3           HA       ALA   3  13.096   3.699  13.031
   13    HB1  ALA   3           3HB      ALA   3  11.008   3.522  13.785
   14    HB2  ALA   3           1HB      ALA   3  10.608   5.168  13.291
   15    HB3  ALA   3           2HB      ALA   3  10.486   3.843  12.132
   16    H    GLU   4           H        GLU   4  12.863   6.319  10.880
   17    HA   GLU   4           HA       GLU   4  12.374   4.699   8.524
   18    HB2  GLU   4           1HB      GLU   4  13.060   7.630   8.814
   19    HB3  GLU   4           2HB      GLU   4  12.656   6.836   7.298
   20    HG2  GLU   4           1HG      GLU   4  10.518   6.154   8.799
   21    HG3  GLU   4           2HG      GLU   4  10.919   7.725   9.491
   22    H    ALA   5           H        ALA   5  15.050   5.850  10.345
   23    HA   ALA   5           HA       ALA   5  16.940   5.484   8.157
   24    HB1  ALA   5           3HB      ALA   5  17.271   6.412  11.001
   25    HB2  ALA   5           1HB      ALA   5  18.625   6.159   9.899
   26    HB3  ALA   5           2HB      ALA   5  17.396   7.368   9.525
   27    H    TYR   6           H        TYR   6  15.782   3.838  10.995
   28    HA   TYR   6           HA       TYR   6  17.944   1.942  11.092
   29    HD1  TYR   6           HD2      TYR   6  18.045  -0.223  12.974
   30    HD2  TYR   6           HD1      TYR   6  13.884   0.609  12.661
   31    HE1  TYR   6           HE2      TYR   6  17.542  -2.576  13.480
   32    HE2  TYR   6           HE1      TYR   6  13.370  -1.742  13.167
   33    HH   TYR   6           HH       TYR   6  15.956  -4.084  13.839
   34    HB2  TYR   6           1HB      TYR   6  17.037   2.150  13.191
   35    HB3  TYR   6           2HB      TYR   6  15.401   2.374  12.582
   36    H    ALA   7           H        ALA   7  14.456   1.327  10.734
   37    HA   ALA   7           HA       ALA   7  14.518  -1.182   9.709
   38    HB1  ALA   7           3HB      ALA   7  12.669   1.102   9.112
   39    HB2  ALA   7           1HB      ALA   7  12.427  -0.492   8.395
   40    HB3  ALA   7           2HB      ALA   7  12.403  -0.300  10.149
   41    H    LYS   8           H        LYS   8  14.907   1.817   7.857
   42    HA   LYS   8           HA       LYS   8  14.883   1.106   5.291
   43    HB2  LYS   8           1HB      LYS   8  15.618   3.316   6.074
   44    HB3  LYS   8           2HB      LYS   8  17.157   2.629   6.577
   45    HG2  LYS   8           1HG      LYS   8  17.197   1.877   4.023
   46    HG3  LYS   8           2HG      LYS   8  16.170   3.304   3.872
   47    HD2  LYS   8           1HD      LYS   8  17.893   4.695   4.187
   48    HD3  LYS   8           2HD      LYS   8  18.490   3.769   5.566
   49    HE2  LYS   8           1HE      LYS   8  20.159   3.773   3.829
   50    HE3  LYS   8           2HE      LYS   8  19.494   2.148   3.989
   51    HZ1  LYS   8           3HZ      LYS   8  19.785   3.033   1.657
   52    HZ2  LYS   8           1HZ      LYS   8  18.486   4.069   1.976
   53    HZ3  LYS   8           2HZ      LYS   8  18.263   2.393   2.027
   54    H    ARG   9           H        ARG   9  17.779   0.586   7.311
   55    HA   ARG   9           HA       ARG   9  19.154  -0.937   5.367
   56    HE   ARG   9           HE       ARG   9  22.655   1.741   5.810
   57    HB2  ARG   9           1HB      ARG   9  19.479  -0.544   8.326
   58    HB3  ARG   9           2HB      ARG   9  20.467  -1.718   7.468
   59    HG2  ARG   9           1HG      ARG   9  20.319   1.039   6.379
   60    HG3  ARG   9           2HG      ARG   9  21.264   0.766   7.844
   61    HD2  ARG   9           1HD      ARG   9  22.521  -0.998   6.677
   62    HD3  ARG   9           2HD      ARG   9  21.599  -0.667   5.211
   63   HH11  ARG   9          2HH1      ARG   9  24.032  -1.441   5.493
   64   HH12  ARG   9          1HH1      ARG   9  25.574  -0.862   4.956
   65   HH21  ARG   9          2HH2      ARG   9  24.681   2.516   5.104
   66   HH22  ARG   9          1HH2      ARG   9  25.942   1.389   4.735
   67    H    ILE  10           H        ILE  10  17.836  -2.083   8.480
   68    HA   ILE  10           HA       ILE  10  18.020  -4.730   8.292
   69    HB   ILE  10           HB       ILE  10  15.288  -3.704   8.946
   70   HG12  ILE  10          1HG1      ILE  10  16.610  -1.983   9.915
   71   HG13  ILE  10          2HG1      ILE  10  16.236  -3.096  11.226
   72   HG21  ILE  10          1HG2      ILE  10  15.642  -5.288  10.876
   73   HG22  ILE  10          2HG2      ILE  10  15.587  -6.029   9.278
   74   HG23  ILE  10          3HG2      ILE  10  17.136  -5.787  10.084
   75   HD11  ILE  10          3HD1      ILE  10  18.796  -3.298   9.688
   76   HD12  ILE  10          1HD1      ILE  10  18.615  -2.198  11.055
   77   HD13  ILE  10          2HD1      ILE  10  18.408  -3.935  11.286
   78    H    ALA  11           H        ALA  11  14.991  -3.250   7.138
   79    HA   ALA  11           HA       ALA  11  13.834  -5.249   5.804
   80    HB1  ALA  11           3HB      ALA  11  12.644  -3.301   5.631
   81    HB2  ALA  11           1HB      ALA  11  14.051  -2.354   5.147
   82    HB3  ALA  11           2HB      ALA  11  13.272  -3.432   3.988
   83    H    GLU  12           H        GLU  12  16.472  -3.288   4.447
   84    HA   GLU  12           HA       GLU  12  16.607  -4.598   1.963
   85    HB2  GLU  12           1HB      GLU  12  18.234  -2.690   3.468
   86    HB3  GLU  12           2HB      GLU  12  19.191  -3.759   2.452
   87    HG2  GLU  12           1HG      GLU  12  17.349  -3.089   0.668
   88    HG3  GLU  12           2HG      GLU  12  17.240  -1.664   1.699
   89    H    ALA  13           H        ALA  13  18.860  -4.926   4.713
   90    HA   ALA  13           HA       ALA  13  20.263  -7.123   3.784
   91    HB1  ALA  13           3HB      ALA  13  20.270  -7.525   6.489
   92    HB2  ALA  13           1HB      ALA  13  21.346  -6.434   5.615
   93    HB3  ALA  13           2HB      ALA  13  19.876  -5.811   6.365
   94    H    MET  14           H        MET  14  17.036  -6.965   4.910
   95    HA   MET  14           HA       MET  14  16.914  -9.842   5.421
   96    HB2  MET  14           1HB      MET  14  15.088  -7.536   5.989
   97    HB3  MET  14           2HB      MET  14  14.440  -9.170   5.946
   98    HG2  MET  14           1HG      MET  14  16.643  -9.453   7.543
   99    HG3  MET  14           2HG      MET  14  16.060  -7.846   7.971
  100    HE1  MET  14           3HE      MET  14  12.767  -7.963   8.991
  101    HE2  MET  14           1HE      MET  14  13.362  -7.859   7.334
  102    HE3  MET  14           2HE      MET  14  12.281  -9.172   7.801
  103    H    ALA  15           H        ALA  15  17.230  -8.515   2.729
  104    HA   ALA  15           HA       ALA  15  14.896  -9.770   1.437
  105    HB1  ALA  15           3HB      ALA  15  15.547  -7.105   1.310
  106    HB2  ALA  15           1HB      ALA  15  16.249  -7.754  -0.173
  107    HB3  ALA  15           2HB      ALA  15  14.531  -7.975   0.160
  108    H    LYS  16           H        LYS  16  18.334  -9.417   1.580
  109    HA   LYS  16           HA       LYS  16  18.985 -10.554  -0.931
  110    HB2  LYS  16           1HB      LYS  16  20.389  -9.443   1.216
  111    HB3  LYS  16           2HB      LYS  16  20.951 -11.108   1.128
  112    HG2  LYS  16           1HG      LYS  16  21.572 -10.808  -1.193
  113    HG3  LYS  16           2HG      LYS  16  20.936  -9.162  -1.170
  114    HD2  LYS  16           1HD      LYS  16  23.249  -8.905  -0.885
  115    HD3  LYS  16           2HD      LYS  16  22.583  -8.744   0.741
  116    HE2  LYS  16           1HE      LYS  16  24.285 -10.199   1.174
  117    HE3  LYS  16           2HE      LYS  16  23.012 -11.353   0.783
  118    HZ1  LYS  16           3HZ      LYS  16  23.900 -11.229  -1.571
  119    HZ2  LYS  16           1HZ      LYS  16  24.865 -12.037  -0.440
  120    HZ3  LYS  16           2HZ      LYS  16  25.261 -10.464  -0.920
  121    H    GLY  17           H        GLY  17  19.454 -12.644  -1.528
  122    HA2  GLY  17           1HA      GLY  17  19.839 -14.849   0.091
  123    HA3  GLY  17           2HA      GLY  17  18.098 -14.713  -0.111
  Start of MODEL   17
    1    HA   SER   1           HA       SER   1  14.193   9.694  11.691
    2    HG   SER   1           HG       SER   1  11.788  10.370  11.407
    3    H1   SER   1           1H       SER   1  14.623   9.012   9.148
    4    HB2  SER   1           1HB      SER   1  12.511   9.192   9.703
    5    HB3  SER   1           2HB      SER   1  12.245   7.703  10.609
    6    H    ALA   2           H        ALA   2  12.792   8.210  13.305
    7    HA   ALA   2           HA       ALA   2  14.555   6.627  14.699
    8    HB1  ALA   2           3HB      ALA   2  11.843   7.360  14.936
    9    HB2  ALA   2           1HB      ALA   2  11.923   5.609  15.131
   10    HB3  ALA   2           2HB      ALA   2  12.893   6.657  16.167
   11    H    ALA   3           H        ALA   3  12.454   5.738  12.045
   12    HA   ALA   3           HA       ALA   3  13.579   3.014  12.137
   13    HB1  ALA   3           3HB      ALA   3  11.021   3.352  10.729
   14    HB2  ALA   3           1HB      ALA   3  11.569   2.064  11.802
   15    HB3  ALA   3           2HB      ALA   3  10.956   3.575  12.477
   16    H    GLU   4           H        GLU   4  13.102   5.879  10.339
   17    HA   GLU   4           HA       GLU   4  13.435   4.706   7.735
   18    HB2  GLU   4           1HB      GLU   4  13.479   7.552   8.733
   19    HB3  GLU   4           2HB      GLU   4  13.760   7.132   7.049
   20    HG2  GLU   4           1HG      GLU   4  11.471   5.825   7.414
   21    HG3  GLU   4           2HG      GLU   4  11.262   7.085   8.628
   22    H    ALA   5           H        ALA   5  15.504   5.913  10.234
   23    HA   ALA   5           HA       ALA   5  17.821   5.959   8.446
   24    HB1  ALA   5           3HB      ALA   5  18.367   7.696   9.722
   25    HB2  ALA   5           1HB      ALA   5  17.105   7.312  10.893
   26    HB3  ALA   5           2HB      ALA   5  18.691   6.549  11.023
   27    H    TYR   6           H        TYR   6  16.192   3.745  10.271
   28    HA   TYR   6           HA       TYR   6  18.642   2.200  10.815
   29    HD1  TYR   6           HD1      TYR   6  15.090   0.173  11.890
   30    HD2  TYR   6           HD2      TYR   6  18.989   0.612  13.535
   31    HE1  TYR   6           HE1      TYR   6  15.059  -2.188  12.578
   32    HE2  TYR   6           HE2      TYR   6  18.969  -1.748  14.227
   33    HH   TYR   6           HH       TYR   6  17.099  -3.992  13.058
   34    HB2  TYR   6           1HB      TYR   6  17.693   2.549  12.924
   35    HB3  TYR   6           2HB      TYR   6  16.049   2.390  12.318
   36    H    ALA   7           H        ALA   7  15.160   1.527  10.425
   37    HA   ALA   7           HA       ALA   7  15.301  -1.040   9.503
   38    HB1  ALA   7           3HB      ALA   7  13.211   0.176  10.009
   39    HB2  ALA   7           1HB      ALA   7  13.374   1.043   8.482
   40    HB3  ALA   7           2HB      ALA   7  13.139  -0.705   8.483
   41    H    LYS   8           H        LYS   8  16.339   1.800   7.884
   42    HA   LYS   8           HA       LYS   8  16.087   1.303   5.220
   43    HB2  LYS   8           1HB      LYS   8  17.349   3.196   6.488
   44    HB3  LYS   8           2HB      LYS   8  18.756   2.159   6.294
   45    HG2  LYS   8           1HG      LYS   8  19.056   2.975   4.263
   46    HG3  LYS   8           2HG      LYS   8  17.491   2.319   3.777
   47    HD2  LYS   8           1HD      LYS   8  16.471   4.415   4.794
   48    HD3  LYS   8           2HD      LYS   8  18.114   5.058   4.855
   49    HE2  LYS   8           1HE      LYS   8  17.142   5.848   2.840
   50    HE3  LYS   8           2HE      LYS   8  18.279   4.577   2.393
   51    HZ1  LYS   8           3HZ      LYS   8  16.570   3.107   1.916
   52    HZ2  LYS   8           1HZ      LYS   8  15.973   4.574   1.322
   53    HZ3  LYS   8           2HZ      LYS   8  15.420   3.974   2.803
   54    H    ARG   9           H        ARG   9  19.090   0.406   6.918
   55    HA   ARG   9           HA       ARG   9  20.025  -1.336   4.961
   56    HE   ARG   9           HE       ARG   9  19.333   1.500   8.320
   57    HB2  ARG   9           1HB      ARG   9  21.229  -2.389   7.075
   58    HB3  ARG   9           2HB      ARG   9  21.684  -0.811   6.447
   59    HG2  ARG   9           1HG      ARG   9  19.535  -0.655   8.394
   60    HG3  ARG   9           2HG      ARG   9  20.997  -1.397   9.045
   61    HD2  ARG   9           1HD      ARG   9  21.641   0.726   9.400
   62    HD3  ARG   9           2HD      ARG   9  22.042   0.701   7.683
   63   HH11  ARG   9          2HH1      ARG   9  22.601   2.509   7.675
   64   HH12  ARG   9          1HH1      ARG   9  22.152   4.119   7.217
   65   HH21  ARG   9          2HH2      ARG   9  18.729   3.616   7.720
   66   HH22  ARG   9          1HH2      ARG   9  19.949   4.747   7.244
   67    H    ILE  10           H        ILE  10  18.567  -2.267   8.085
   68    HA   ILE  10           HA       ILE  10  18.367  -4.922   7.914
   69    HB   ILE  10           HB       ILE  10  15.819  -3.493   8.557
   70   HG12  ILE  10          1HG1      ILE  10  17.382  -1.988   9.524
   71   HG13  ILE  10          2HG1      ILE  10  16.846  -3.029  10.838
   72   HG21  ILE  10          1HG2      ILE  10  15.931  -5.104  10.496
   73   HG22  ILE  10          2HG2      ILE  10  15.757  -5.832   8.900
   74   HG23  ILE  10          3HG2      ILE  10  17.328  -5.829   9.701
   75   HD11  ILE  10          3HD1      ILE  10  18.867  -4.182  10.903
   76   HD12  ILE  10          1HD1      ILE  10  19.347  -3.617   9.303
   77   HD13  ILE  10          2HD1      ILE  10  19.332  -2.498  10.666
   78    H    ALA  11           H        ALA  11  15.598  -3.008   6.745
   79    HA   ALA  11           HA       ALA  11  14.155  -4.817   5.417
   80    HB1  ALA  11           3HB      ALA  11  13.232  -2.755   5.183
   81    HB2  ALA  11           1HB      ALA  11  14.776  -1.982   4.820
   82    HB3  ALA  11           2HB      ALA  11  13.940  -2.912   3.575
   83    H    GLU  12           H        GLU  12  17.063  -3.283   4.063
   84    HA   GLU  12           HA       GLU  12  17.006  -4.599   1.581
   85    HB2  GLU  12           1HB      GLU  12  18.902  -2.967   3.095
   86    HB3  GLU  12           2HB      GLU  12  19.687  -4.172   2.083
   87    HG2  GLU  12           1HG      GLU  12  17.980  -3.225   0.290
   88    HG3  GLU  12           2HG      GLU  12  18.089  -1.799   1.321
   89    H    ALA  13           H        ALA  13  19.171  -5.274   4.338
   90    HA   ALA  13           HA       ALA  13  20.261  -7.634   3.442
   91    HB1  ALA  13           3HB      ALA  13  19.894  -7.968   6.212
   92    HB2  ALA  13           1HB      ALA  13  21.326  -7.376   5.369
   93    HB3  ALA  13           2HB      ALA  13  20.101  -6.239   5.932
   94    H    MET  14           H        MET  14  17.083  -7.071   4.755
   95    HA   MET  14           HA       MET  14  16.537  -9.934   4.937
   96    HB2  MET  14           1HB      MET  14  14.845  -7.530   5.643
   97    HB3  MET  14           2HB      MET  14  14.341  -9.202   5.854
   98    HG2  MET  14           1HG      MET  14  16.838  -8.963   7.115
   99    HG3  MET  14           2HG      MET  14  15.901  -7.546   7.583
  100    HE1  MET  14           3HE      MET  14  14.730  -8.009  10.192
  101    HE2  MET  14           1HE      MET  14  15.426  -9.540  10.724
  102    HE3  MET  14           2HE      MET  14  16.416  -8.384   9.832
  103    H    ALA  15           H        ALA  15  16.975  -8.473   2.369
  104    HA   ALA  15           HA       ALA  15  14.432  -9.222   1.085
  105    HB1  ALA  15           3HB      ALA  15  14.367  -6.919   0.870
  106    HB2  ALA  15           1HB      ALA  15  16.114  -6.786   0.664
  107    HB3  ALA  15           2HB      ALA  15  15.116  -7.419  -0.646
  108    H    LYS  16           H        LYS  16  17.924  -9.106   0.937
  109    HA   LYS  16           HA       LYS  16  18.506  -9.907  -1.604
  110    HB2  LYS  16           1HB      LYS  16  20.539 -10.808  -0.781
  111    HB3  LYS  16           2HB      LYS  16  20.122  -9.486   0.301
  112    HG2  LYS  16           1HG      LYS  16  19.927 -10.837   2.069
  113    HG3  LYS  16           2HG      LYS  16  19.078 -12.081   1.148
  114    HD2  LYS  16           1HD      LYS  16  21.140 -13.028   1.859
  115    HD3  LYS  16           2HD      LYS  16  21.297 -12.693   0.133
  116    HE2  LYS  16           1HE      LYS  16  22.720 -10.894   0.483
  117    HE3  LYS  16           2HE      LYS  16  22.187 -10.670   2.149
  118    HZ1  LYS  16           3HZ      LYS  16  23.283 -13.214   1.988
  119    HZ2  LYS  16           1HZ      LYS  16  23.923 -11.864   2.782
  120    HZ3  LYS  16           2HZ      LYS  16  24.357 -12.187   1.180
  121    H    GLY  17           H        GLY  17  19.191 -12.113  -2.374
  122    HA2  GLY  17           1HA      GLY  17  18.573 -14.232  -3.004
  123    HA3  GLY  17           2HA      GLY  17  18.267 -14.502  -1.295
  Start of MODEL   18
    1    HA   SER   1           HA       SER   1  15.826  10.281  10.646
    2    HG   SER   1           HG       SER   1  13.743  12.728  10.949
    3    H1   SER   1           1H       SER   1  13.523   9.087   9.477
    4    HB2  SER   1           1HB      SER   1  13.031  10.757  10.638
    5    HB3  SER   1           2HB      SER   1  13.522  10.600  12.325
    6    H    ALA   2           H        ALA   2  13.246   8.618  12.435
    7    HA   ALA   2           HA       ALA   2  15.316   7.474  14.185
    8    HB1  ALA   2           3HB      ALA   2  13.589   9.007  15.180
    9    HB2  ALA   2           1HB      ALA   2  12.389   7.765  14.822
   10    HB3  ALA   2           2HB      ALA   2  13.713   7.418  15.935
   11    H    ALA   3           H        ALA   3  12.844   6.701  11.931
   12    HA   ALA   3           HA       ALA   3  13.242   3.840  12.500
   13    HB1  ALA   3           3HB      ALA   3  10.747   3.869  11.422
   14    HB2  ALA   3           1HB      ALA   3  11.095   3.813  13.150
   15    HB3  ALA   3           2HB      ALA   3  10.735   5.355  12.372
   16    H    GLU   4           H        GLU   4  13.542   6.329  10.319
   17    HA   GLU   4           HA       GLU   4  13.093   4.700   7.944
   18    HB2  GLU   4           1HB      GLU   4  14.101   7.543   8.090
   19    HB3  GLU   4           2HB      GLU   4  13.460   6.713   6.679
   20    HG2  GLU   4           1HG      GLU   4  11.532   6.646   8.792
   21    HG3  GLU   4           2HG      GLU   4  12.075   8.302   8.527
   22    H    ALA   5           H        ALA   5  15.648   5.693  10.009
   23    HA   ALA   5           HA       ALA   5  17.709   5.096   8.030
   24    HB1  ALA   5           3HB      ALA   5  19.155   5.637  10.184
   25    HB2  ALA   5           1HB      ALA   5  18.459   6.911   9.181
   26    HB3  ALA   5           2HB      ALA   5  17.661   6.432  10.679
   27    H    TYR   6           H        TYR   6  16.049   3.625  10.656
   28    HA   TYR   6           HA       TYR   6  18.091   1.617  11.118
   29    HD1  TYR   6           HD2      TYR   6  17.868  -0.456  13.027
   30    HD2  TYR   6           HD1      TYR   6  13.815   0.718  12.483
   31    HE1  TYR   6           HE2      TYR   6  17.137  -2.731  13.610
   32    HE2  TYR   6           HE1      TYR   6  13.072  -1.553  13.065
   33    HH   TYR   6           HH       TYR   6  13.697  -3.555  13.832
   34    HB2  TYR   6           1HB      TYR   6  17.034   2.020  13.118
   35    HB3  TYR   6           2HB      TYR   6  15.478   2.331  12.358
   36    H    ALA   7           H        ALA   7  14.606   1.294  10.450
   37    HA   ALA   7           HA       ALA   7  14.536  -1.279   9.578
   38    HB1  ALA   7           3HB      ALA   7  12.619  -0.536   8.082
   39    HB2  ALA   7           1HB      ALA   7  12.487  -0.149   9.798
   40    HB3  ALA   7           2HB      ALA   7  12.957   1.101   8.644
   41    H    LYS   8           H        LYS   8  15.343   1.565   7.618
   42    HA   LYS   8           HA       LYS   8  15.480   0.707   5.100
   43    HB2  LYS   8           1HB      LYS   8  16.752   2.722   6.538
   44    HB3  LYS   8           2HB      LYS   8  18.072   1.842   5.780
   45    HG2  LYS   8           1HG      LYS   8  17.300   2.301   3.627
   46    HG3  LYS   8           2HG      LYS   8  15.690   2.740   4.200
   47    HD2  LYS   8           1HD      LYS   8  17.468   4.474   5.502
   48    HD3  LYS   8           2HD      LYS   8  18.010   4.399   3.824
   49    HE2  LYS   8           1HE      LYS   8  15.330   4.621   3.491
   50    HE3  LYS   8           2HE      LYS   8  15.555   5.540   4.979
   51    HZ1  LYS   8           3HZ      LYS   8  15.787   6.673   2.651
   52    HZ2  LYS   8           1HZ      LYS   8  17.361   6.057   2.729
   53    HZ3  LYS   8           2HZ      LYS   8  16.805   7.112   3.929
   54    H    ARG   9           H        ARG   9  18.135   0.074   7.400
   55    HA   ARG   9           HA       ARG   9  19.536  -1.669   5.671
   56    HE   ARG   9           HE       ARG   9  24.070   0.071   6.566
   57    HB2  ARG   9           1HB      ARG   9  19.638  -1.130   8.624
   58    HB3  ARG   9           2HB      ARG   9  20.594  -2.426   7.918
   59    HG2  ARG   9           1HG      ARG   9  20.770   0.268   6.684
   60    HG3  ARG   9           2HG      ARG   9  21.563   0.003   8.239
   61    HD2  ARG   9           1HD      ARG   9  22.898  -1.755   7.344
   62    HD3  ARG   9           2HD      ARG   9  21.968  -1.779   5.847
   63   HH11  ARG   9          2HH1      ARG   9  21.374  -0.601   4.469
   64   HH12  ARG   9          1HH1      ARG   9  21.907   0.477   3.222
   65   HH21  ARG   9          2HH2      ARG   9  24.783   1.494   4.932
   66   HH22  ARG   9          1HH2      ARG   9  23.847   1.667   3.486
   67    H    ILE  10           H        ILE  10  17.857  -2.513   8.705
   68    HA   ILE  10           HA       ILE  10  17.829  -5.174   8.673
   69    HB   ILE  10           HB       ILE  10  15.151  -3.892   9.028
   70   HG12  ILE  10          1HG1      ILE  10  16.525  -2.229  10.022
   71   HG13  ILE  10          2HG1      ILE  10  15.957  -3.234  11.352
   72   HG21  ILE  10          1HG2      ILE  10  15.223  -6.212   9.503
   73   HG22  ILE  10          2HG2      ILE  10  16.711  -6.045  10.434
   74   HG23  ILE  10          3HG2      ILE  10  15.201  -5.383  11.060
   75   HD11  ILE  10          3HD1      ILE  10  18.626  -2.618  10.568
   76   HD12  ILE  10          1HD1      ILE  10  18.055  -3.505  11.981
   77   HD13  ILE  10          2HD1      ILE  10  18.374  -4.361  10.472
   78    H    ALA  11           H        ALA  11  15.048  -3.522   7.180
   79    HA   ALA  11           HA       ALA  11  13.838  -5.495   5.854
   80    HB1  ALA  11           3HB      ALA  11  14.353  -2.670   5.077
   81    HB2  ALA  11           1HB      ALA  11  13.594  -3.745   3.903
   82    HB3  ALA  11           2HB      ALA  11  12.835  -3.475   5.473
   83    H    GLU  12           H        GLU  12  16.738  -3.836   4.636
   84    HA   GLU  12           HA       GLU  12  16.970  -5.290   2.243
   85    HB2  GLU  12           1HB      GLU  12  18.623  -3.443   3.792
   86    HB3  GLU  12           2HB      GLU  12  19.567  -4.644   2.921
   87    HG2  GLU  12           1HG      GLU  12  17.951  -3.927   0.946
   88    HG3  GLU  12           2HG      GLU  12  17.879  -2.440   1.891
   89    H    ALA  13           H        ALA  13  18.942  -5.653   5.196
   90    HA   ALA  13           HA       ALA  13  20.346  -7.893   4.620
   91    HB1  ALA  13           3HB      ALA  13  20.874  -7.928   6.799
   92    HB2  ALA  13           1HB      ALA  13  19.907  -6.456   6.887
   93    HB3  ALA  13           2HB      ALA  13  19.188  -8.011   7.309
   94    H    MET  14           H        MET  14  16.936  -7.733   5.432
   95    HA   MET  14           HA       MET  14  16.690 -10.629   5.477
   96    HB2  MET  14           1HB      MET  14  14.542  -8.515   5.710
   97    HB3  MET  14           2HB      MET  14  14.353 -10.231   6.043
   98    HG2  MET  14           1HG      MET  14  16.275  -9.805   7.761
   99    HG3  MET  14           2HG      MET  14  15.737  -8.132   7.634
  100    HE1  MET  14           3HE      MET  14  13.226  -7.798   7.271
  101    HE2  MET  14           1HE      MET  14  12.037  -9.065   7.571
  102    HE3  MET  14           2HE      MET  14  12.382  -7.867   8.819
  103    H    ALA  15           H        ALA  15  17.553  -9.390   3.020
  104    HA   ALA  15           HA       ALA  15  15.364 -10.299   1.281
  105    HB1  ALA  15           3HB      ALA  15  17.020  -7.810   0.903
  106    HB2  ALA  15           1HB      ALA  15  15.977  -8.507  -0.337
  107    HB3  ALA  15           2HB      ALA  15  15.280  -7.908   1.169
  108    H    LYS  16           H        LYS  16  18.823  -9.562   1.544
  109    HA   LYS  16           HA       LYS  16  19.702 -10.736  -0.817
  110    HB2  LYS  16           1HB      LYS  16  20.879  -9.711   1.568
  111    HB3  LYS  16           2HB      LYS  16  21.622 -11.267   1.223
  112    HG2  LYS  16           1HG      LYS  16  22.974 -10.142  -0.137
  113    HG3  LYS  16           2HG      LYS  16  21.597 -10.048  -1.237
  114    HD2  LYS  16           1HD      LYS  16  21.242  -7.855  -0.811
  115    HD3  LYS  16           2HD      LYS  16  21.684  -8.007   0.891
  116    HE2  LYS  16           1HE      LYS  16  23.334  -6.641  -0.136
  117    HE3  LYS  16           2HE      LYS  16  24.073  -8.216   0.146
  118    HZ1  LYS  16           3HZ      LYS  16  24.653  -7.494  -2.032
  119    HZ2  LYS  16           1HZ      LYS  16  23.042  -7.162  -2.429
  120    HZ3  LYS  16           2HZ      LYS  16  23.545  -8.761  -2.201
  121    H    GLY  17           H        GLY  17  19.957 -12.775  -1.511
  122    HA2  GLY  17           1HA      GLY  17  20.580 -15.077  -1.068
  123    HA3  GLY  17           2HA      GLY  17  19.746 -14.948   0.473
  Start of MODEL   19
    1    HA   SER   1           HA       SER   1  14.479  10.493  11.920
    2    HG   SER   1           HG       SER   1  12.403  11.327  11.583
    3    H1   SER   1           1H       SER   1  13.629   9.867   9.285
    4    HB2  SER   1           1HB      SER   1  12.205   9.035  10.688
    5    HB3  SER   1           2HB      SER   1  12.583   8.635  12.364
    6    H    ALA   2           H        ALA   2  14.403   8.607  13.616
    7    HA   ALA   2           HA       ALA   2  16.676   6.955  13.056
    8    HB1  ALA   2           3HB      ALA   2  14.993   7.543  15.421
    9    HB2  ALA   2           1HB      ALA   2  15.882   6.019  15.419
   10    HB3  ALA   2           2HB      ALA   2  16.748   7.547  15.247
   11    H    ALA   3           H        ALA   3  13.299   6.591  12.723
   12    HA   ALA   3           HA       ALA   3  13.437   3.670  12.774
   13    HB1  ALA   3           3HB      ALA   3  11.231   3.661  13.214
   14    HB2  ALA   3           1HB      ALA   3  11.509   5.342  13.670
   15    HB3  ALA   3           2HB      ALA   3  10.889   4.954  12.065
   16    H    GLU   4           H        GLU   4  13.634   6.246  10.580
   17    HA   GLU   4           HA       GLU   4  12.710   4.647   8.315
   18    HB2  GLU   4           1HB      GLU   4  12.492   6.598   7.128
   19    HB3  GLU   4           2HB      GLU   4  12.259   7.209   8.760
   20    HG2  GLU   4           1HG      GLU   4  14.530   7.986   8.852
   21    HG3  GLU   4           2HG      GLU   4  14.883   7.249   7.290
   22    H    ALA   5           H        ALA   5  15.595   5.599   9.902
   23    HA   ALA   5           HA       ALA   5  17.272   5.029   7.583
   24    HB1  ALA   5           3HB      ALA   5  17.536   6.709   9.819
   25    HB2  ALA   5           1HB      ALA   5  18.775   5.464   9.982
   26    HB3  ALA   5           2HB      ALA   5  18.699   6.447   8.519
   27    H    TYR   6           H        TYR   6  16.261   3.608  10.600
   28    HA   TYR   6           HA       TYR   6  18.271   1.548  10.587
   29    HD1  TYR   6           HD2      TYR   6  18.406  -0.510  12.620
   30    HD2  TYR   6           HD1      TYR   6  14.300   0.606  12.563
   31    HE1  TYR   6           HE2      TYR   6  17.783  -2.789  13.301
   32    HE2  TYR   6           HE1      TYR   6  13.666  -1.671  13.244
   33    HH   TYR   6           HH       TYR   6  16.081  -4.063  14.130
   34    HB2  TYR   6           1HB      TYR   6  17.602   1.929  12.751
   35    HB3  TYR   6           2HB      TYR   6  15.933   2.253  12.293
   36    H    ALA   7           H        ALA   7  14.722   1.235  10.576
   37    HA   ALA   7           HA       ALA   7  14.444  -1.314   9.727
   38    HB1  ALA   7           3HB      ALA   7  12.466  -0.068   8.271
   39    HB2  ALA   7           1HB      ALA   7  12.355  -0.569   9.959
   40    HB3  ALA   7           2HB      ALA   7  12.812   1.087   9.558
   41    H    LYS   8           H        LYS   8  15.053   1.483   7.638
   42    HA   LYS   8           HA       LYS   8  14.773   0.512   5.138
   43    HB2  LYS   8           1HB      LYS   8  15.794   2.756   5.985
   44    HB3  LYS   8           2HB      LYS   8  17.334   1.922   5.816
   45    HG2  LYS   8           1HG      LYS   8  16.868   1.522   3.457
   46    HG3  LYS   8           2HG      LYS   8  15.313   2.341   3.622
   47    HD2  LYS   8           1HD      LYS   8  17.426   4.001   4.644
   48    HD3  LYS   8           2HD      LYS   8  17.799   3.486   2.997
   49    HE2  LYS   8           1HE      LYS   8  15.087   4.548   3.702
   50    HE3  LYS   8           2HE      LYS   8  16.423   5.646   3.357
   51    HZ1  LYS   8           3HZ      LYS   8  16.115   5.327   1.203
   52    HZ2  LYS   8           1HZ      LYS   8  14.775   4.348   1.535
   53    HZ3  LYS   8           2HZ      LYS   8  16.309   3.654   1.369
   54    H    ARG   9           H        ARG   9  17.814   0.159   6.977
   55    HA   ARG   9           HA       ARG   9  19.085  -1.549   5.174
   56    HE   ARG   9           HE       ARG   9  21.326   1.842   6.258
   57    HB2  ARG   9           1HB      ARG   9  19.620  -1.945   8.068
   58    HB3  ARG   9           2HB      ARG   9  20.745  -1.721   6.735
   59    HG2  ARG   9           1HG      ARG   9  19.619   0.714   6.788
   60    HG3  ARG   9           2HG      ARG   9  19.460   0.266   8.488
   61    HD2  ARG   9           1HD      ARG   9  21.622   0.638   8.845
   62    HD3  ARG   9           2HD      ARG   9  22.070  -0.436   7.520
   63   HH11  ARG   9          2HH1      ARG   9  23.556   1.141   8.838
   64   HH12  ARG   9          1HH1      ARG   9  24.626   2.445   8.443
   65   HH21  ARG   9          2HH2      ARG   9  22.727   3.562   5.728
   66   HH22  ARG   9          1HH2      ARG   9  24.153   3.822   6.674
   67    H    ILE  10           H        ILE  10  17.559  -2.479   8.266
   68    HA   ILE  10           HA       ILE  10  17.681  -5.135   8.270
   69    HB   ILE  10           HB       ILE  10  14.933  -4.010   8.621
   70   HG12  ILE  10          1HG1      ILE  10  16.215  -2.251   9.576
   71   HG13  ILE  10          2HG1      ILE  10  15.704  -3.260  10.925
   72   HG21  ILE  10          1HG2      ILE  10  15.156  -6.316   9.131
   73   HG22  ILE  10          2HG2      ILE  10  16.628  -6.036  10.060
   74   HG23  ILE  10          3HG2      ILE  10  15.078  -5.463  10.672
   75   HD11  ILE  10          3HD1      ILE  10  18.112  -2.422  10.890
   76   HD12  ILE  10          1HD1      ILE  10  17.840  -4.130  11.234
   77   HD13  ILE  10          2HD1      ILE  10  18.376  -3.628   9.630
   78    H    ALA  11           H        ALA  11  14.802  -3.669   6.768
   79    HA   ALA  11           HA       ALA  11  13.756  -5.777   5.462
   80    HB1  ALA  11           3HB      ALA  11  13.893  -2.891   4.803
   81    HB2  ALA  11           1HB      ALA  11  13.316  -3.986   3.546
   82    HB3  ALA  11           2HB      ALA  11  12.494  -3.921   5.106
   83    H    GLU  12           H        GLU  12  16.569  -3.922   4.409
   84    HA   GLU  12           HA       GLU  12  16.849  -5.325   1.928
   85    HB2  GLU  12           1HB      GLU  12  18.305  -3.216   3.386
   86    HB3  GLU  12           2HB      GLU  12  19.307  -4.241   2.369
   87    HG2  GLU  12           1HG      GLU  12  17.386  -3.735   0.615
   88    HG3  GLU  12           2HG      GLU  12  17.204  -2.298   1.620
   89    H    ALA  13           H        ALA  13  18.938  -5.238   4.822
   90    HA   ALA  13           HA       ALA  13  20.514  -7.439   4.116
   91    HB1  ALA  13           3HB      ALA  13  19.952  -6.017   6.677
   92    HB2  ALA  13           1HB      ALA  13  20.854  -7.533   6.707
   93    HB3  ALA  13           2HB      ALA  13  21.461  -6.163   5.776
   94    H    MET  14           H        MET  14  17.277  -7.347   5.041
   95    HA   MET  14           HA       MET  14  17.326 -10.116   6.020
   96    HB2  MET  14           1HB      MET  14  15.411  -9.696   7.205
   97    HB3  MET  14           2HB      MET  14  16.107  -8.081   7.194
   98    HG2  MET  14           1HG      MET  14  14.695  -7.516   5.258
   99    HG3  MET  14           2HG      MET  14  13.961  -9.115   5.356
  100    HE1  MET  14           3HE      MET  14  11.882  -7.483   5.177
  101    HE2  MET  14           1HE      MET  14  11.381  -8.851   6.171
  102    HE3  MET  14           2HE      MET  14  10.951  -7.209   6.650
  103    H    ALA  15           H        ALA  15  17.256  -8.739   3.163
  104    HA   ALA  15           HA       ALA  15  15.124 -10.471   2.092
  105    HB1  ALA  15           3HB      ALA  15  15.417  -8.875   0.048
  106    HB2  ALA  15           1HB      ALA  15  14.466  -8.364   1.442
  107    HB3  ALA  15           2HB      ALA  15  16.122  -7.789   1.245
  108    H    LYS  16           H        LYS  16  18.360  -9.172   1.384
  109    HA   LYS  16           HA       LYS  16  19.133 -10.423  -0.845
  110    HB2  LYS  16           1HB      LYS  16  20.466  -9.358   1.382
  111    HB3  LYS  16           2HB      LYS  16  21.163 -10.955   1.144
  112    HG2  LYS  16           1HG      LYS  16  20.948  -9.695  -1.392
  113    HG3  LYS  16           2HG      LYS  16  21.705  -8.565  -0.266
  114    HD2  LYS  16           1HD      LYS  16  23.167 -10.588   0.413
  115    HD3  LYS  16           2HD      LYS  16  22.620 -11.292  -1.110
  116    HE2  LYS  16           1HE      LYS  16  23.644  -9.623  -2.384
  117    HE3  LYS  16           2HE      LYS  16  23.786  -8.532  -1.007
  118    HZ1  LYS  16           3HZ      LYS  16  25.922  -9.319  -1.254
  119    HZ2  LYS  16           1HZ      LYS  16  25.429 -10.879  -1.685
  120    HZ3  LYS  16           2HZ      LYS  16  25.313 -10.370  -0.076
  121    H    GLY  17           H        GLY  17  19.314 -12.026   2.342
  122    HA2  GLY  17           1HA      GLY  17  18.208 -14.442   1.655
  123    HA3  GLY  17           2HA      GLY  17  19.896 -14.581   1.185
  Start of MODEL   20
    1    HA   SER   1           HA       SER   1  12.530   9.956  11.612
    2    HG   SER   1           HG       SER   1  10.376   9.526  12.502
    3    H1   SER   1           1H       SER   1  13.187   9.095   8.921
    4    HB2  SER   1           1HB      SER   1  10.751   8.262   9.991
    5    HB3  SER   1           2HB      SER   1  11.129   7.604  11.583
    6    H    ALA   2           H        ALA   2  12.849   8.054  13.177
    7    HA   ALA   2           HA       ALA   2  15.467   7.079  12.874
    8    HB1  ALA   2           3HB      ALA   2  13.619   7.254  14.939
    9    HB2  ALA   2           1HB      ALA   2  13.917   5.525  14.755
   10    HB3  ALA   2           2HB      ALA   2  15.264   6.626  15.042
   11    H    ALA   3           H        ALA   3  12.322   5.467  12.538
   12    HA   ALA   3           HA       ALA   3  13.384   2.903  11.959
   13    HB1  ALA   3           3HB      ALA   3  11.251   2.445  12.383
   14    HB2  ALA   3           1HB      ALA   3  10.778   4.127  12.140
   15    HB3  ALA   3           2HB      ALA   3  10.873   3.029  10.763
   16    H    GLU   4           H        GLU   4  13.115   5.756  10.112
   17    HA   GLU   4           HA       GLU   4  13.117   4.378   7.551
   18    HB2  GLU   4           1HB      GLU   4  13.231   7.310   8.271
   19    HB3  GLU   4           2HB      GLU   4  13.249   6.704   6.621
   20    HG2  GLU   4           1HG      GLU   4  11.052   5.522   7.973
   21    HG3  GLU   4           2HG      GLU   4  11.025   7.257   8.279
   22    H    ALA   5           H        ALA   5  15.352   5.718   9.800
   23    HA   ALA   5           HA       ALA   5  17.511   5.796   7.831
   24    HB1  ALA   5           3HB      ALA   5  17.141   7.609   9.583
   25    HB2  ALA   5           1HB      ALA   5  17.769   6.446  10.751
   26    HB3  ALA   5           2HB      ALA   5  18.780   6.982   9.409
   27    H    TYR   6           H        TYR   6  16.333   3.898  10.500
   28    HA   TYR   6           HA       TYR   6  18.769   2.310  10.632
   29    HD1  TYR   6           HD2      TYR   6  19.273   0.628  13.206
   30    HD2  TYR   6           HD1      TYR   6  15.221   0.260  11.960
   31    HE1  TYR   6           HE2      TYR   6  19.282  -1.734  13.891
   32    HE2  TYR   6           HE1      TYR   6  15.219  -2.102  12.643
   33    HH   TYR   6           HH       TYR   6  18.085  -3.789  13.436
   34    HB2  TYR   6           1HB      TYR   6  17.910   2.600  12.772
   35    HB3  TYR   6           2HB      TYR   6  16.241   2.443  12.235
   36    H    ALA   7           H        ALA   7  15.327   1.402  10.438
   37    HA   ALA   7           HA       ALA   7  15.504  -1.142   9.567
   38    HB1  ALA   7           3HB      ALA   7  13.345  -0.924   8.586
   39    HB2  ALA   7           1HB      ALA   7  13.403   0.159   9.977
   40    HB3  ALA   7           2HB      ALA   7  13.563   0.809   8.345
   41    H    LYS   8           H        LYS   8  16.389   1.677   7.768
   42    HA   LYS   8           HA       LYS   8  16.227   1.066   5.157
   43    HB2  LYS   8           1HB      LYS   8  17.497   2.991   6.354
   44    HB3  LYS   8           2HB      LYS   8  18.895   1.932   6.231
   45    HG2  LYS   8           1HG      LYS   8  19.232   2.581   4.146
   46    HG3  LYS   8           2HG      LYS   8  17.614   2.043   3.691
   47    HD2  LYS   8           1HD      LYS   8  17.839   4.623   5.139
   48    HD3  LYS   8           2HD      LYS   8  18.395   4.581   3.464
   49    HE2  LYS   8           1HE      LYS   8  15.779   3.322   4.026
   50    HE3  LYS   8           2HE      LYS   8  15.853   5.077   4.166
   51    HZ1  LYS   8           3HZ      LYS   8  15.764   5.227   1.974
   52    HZ2  LYS   8           1HZ      LYS   8  15.668   3.543   1.842
   53    HZ3  LYS   8           2HZ      LYS   8  17.176   4.309   1.817
   54    H    ARG   9           H        ARG   9  19.103   0.091   7.034
   55    HA   ARG   9           HA       ARG   9  20.089  -1.687   5.106
   56    HE   ARG   9           HE       ARG   9  22.667  -0.004   9.605
   57    HB2  ARG   9           1HB      ARG   9  21.155  -2.717   7.342
   58    HB3  ARG   9           2HB      ARG   9  21.739  -1.233   6.600
   59    HG2  ARG   9           1HG      ARG   9  19.551  -0.945   8.560
   60    HG3  ARG   9           2HG      ARG   9  21.122  -1.441   9.192
   61    HD2  ARG   9           1HD      ARG   9  21.196   0.771   7.258
   62    HD3  ARG   9           2HD      ARG   9  20.368   1.133   8.772
   63   HH11  ARG   9          2HH1      ARG   9  21.970   2.577   7.376
   64   HH12  ARG   9          1HH1      ARG   9  23.449   3.423   7.689
   65   HH21  ARG   9          2HH2      ARG   9  24.618   1.100  10.026
   66   HH22  ARG   9          1HH2      ARG   9  24.955   2.581   9.196
   67    H    ILE  10           H        ILE  10  18.627  -2.574   8.240
   68    HA   ILE  10           HA       ILE  10  18.340  -5.216   8.057
   69    HB   ILE  10           HB       ILE  10  15.845  -3.723   8.753
   70   HG12  ILE  10          1HG1      ILE  10  17.457  -2.259   9.697
   71   HG13  ILE  10          2HG1      ILE  10  16.928  -3.296  11.017
   72   HG21  ILE  10          1HG2      ILE  10  15.944  -5.342  10.682
   73   HG22  ILE  10          2HG2      ILE  10  15.737  -6.065   9.087
   74   HG23  ILE  10          3HG2      ILE  10  17.317  -6.096   9.871
   75   HD11  ILE  10          3HD1      ILE  10  19.140  -4.555   9.806
   76   HD12  ILE  10          1HD1      ILE  10  19.554  -2.855  10.030
   77   HD13  ILE  10          2HD1      ILE  10  19.034  -3.825  11.408
   78    H    ALA  11           H        ALA  11  15.608  -3.216   6.947
   79    HA   ALA  11           HA       ALA  11  14.118  -5.013   5.622
   80    HB1  ALA  11           3HB      ALA  11  13.775  -3.081   3.872
   81    HB2  ALA  11           1HB      ALA  11  13.215  -2.911   5.536
   82    HB3  ALA  11           2HB      ALA  11  14.730  -2.160   5.033
   83    H    GLU  12           H        GLU  12  17.097  -3.564   4.387
   84    HA   GLU  12           HA       GLU  12  16.926  -4.852   1.836
   85    HB2  GLU  12           1HB      GLU  12  18.823  -3.077   3.229
   86    HB3  GLU  12           2HB      GLU  12  19.555  -4.186   2.078
   87    HG2  GLU  12           1HG      GLU  12  17.588  -3.293   0.543
   88    HG3  GLU  12           2HG      GLU  12  17.727  -1.903   1.619
   89    H    ALA  13           H        ALA  13  19.264  -5.247   4.505
   90    HA   ALA  13           HA       ALA  13  20.389  -7.629   3.556
   91    HB1  ALA  13           3HB      ALA  13  21.719  -6.680   5.145
   92    HB2  ALA  13           1HB      ALA  13  20.358  -6.209   6.164
   93    HB3  ALA  13           2HB      ALA  13  20.903  -7.887   6.140
   94    H    MET  14           H        MET  14  17.307  -7.090   4.760
   95    HA   MET  14           HA       MET  14  17.009  -9.878   5.646
   96    HB2  MET  14           1HB      MET  14  15.317  -9.230   7.049
   97    HB3  MET  14           2HB      MET  14  16.264  -7.749   7.029
   98    HG2  MET  14           1HG      MET  14  14.775  -6.857   5.280
   99    HG3  MET  14           2HG      MET  14  13.800  -8.320   5.401
  100    HE1  MET  14           3HE      MET  14  11.391  -6.050   6.601
  101    HE2  MET  14           1HE      MET  14  11.862  -7.468   5.662
  102    HE3  MET  14           2HE      MET  14  11.248  -7.662   7.304
  103    H    ALA  15           H        ALA  15  16.877  -8.348   2.872
  104    HA   ALA  15           HA       ALA  15  14.372  -9.615   1.975
  105    HB1  ALA  15           3HB      ALA  15  15.638  -7.057   1.337
  106    HB2  ALA  15           1HB      ALA  15  15.097  -7.964  -0.076
  107    HB3  ALA  15           2HB      ALA  15  13.952  -7.556   1.202
  108    H    LYS  16           H        LYS  16  17.789  -9.140   1.224
  109    HA   LYS  16           HA       LYS  16  17.885 -10.592  -1.170
  110    HB2  LYS  16           1HB      LYS  16  19.701  -9.123  -0.299
  111    HB3  LYS  16           2HB      LYS  16  20.070 -10.350   0.905
  112    HG2  LYS  16           1HG      LYS  16  20.795 -11.883  -0.742
  113    HG3  LYS  16           2HG      LYS  16  20.139 -10.894  -2.049
  114    HD2  LYS  16           1HD      LYS  16  22.511 -10.583  -2.005
  115    HD3  LYS  16           2HD      LYS  16  21.758  -9.104  -1.404
  116    HE2  LYS  16           1HE      LYS  16  22.628 -11.252   0.492
  117    HE3  LYS  16           2HE      LYS  16  23.797 -10.098  -0.147
  118    HZ1  LYS  16           3HZ      LYS  16  21.683  -8.566   0.673
  119    HZ2  LYS  16           1HZ      LYS  16  23.153  -8.763   1.487
  120    HZ3  LYS  16           2HZ      LYS  16  21.829  -9.738   1.884
  121    H    GLY  17           H        GLY  17  18.473 -11.650   2.178
  122    HA2  GLY  17           1HA      GLY  17  17.867 -14.397   1.302
  123    HA3  GLY  17           2HA      GLY  17  19.294 -14.080   2.277