*HEADER    ANTIFREEZE PROTEIN                      22-FEB-12   2LQ2              
*TITLE     SOLUTION STRUCTURE OF DE NOVO DESIGNED PEPTIDE 4M                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DE NOVO DESIGNED ANTIFREEZE PEPTIDE 4M;                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    AFP, ANTIFREEZE PROTEIN                                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.BHUNIA                                                              
*REVDAT   1   24-OCT-12 2LQ2    0                                                


 1 VAL HA 2 LYS H 3.3 2.0
 1 VAL QB 2 LYS H 3.8 2.0
 2 LYS QB 2 LYS H 3.5 2.0
 2 LYS QG 2 LYS H 3.8 2.0
 2 LYS QD 2 LYS H 4.0 2.0
 2 LYS HA 3 GLY H 3.3 2.0
 2 LYS QB 3 GLY H 3.6 2.0
 2 LYS QG 3 GLY H 3.8 2.0
 2 LYS QD 3 GLY H 4.0 2.0
 3 GLY QA 4 ARG H 3.5 2.0
 2 LYS HA 4 ARG H 4.4 2.0
 4 ARG QB 4 ARG H 3.6 2.0
 4 ARG QG 4 ARG H 3.8 2.0
 4 ARG QD 4 ARG H 4.0 2.0
 4 ARG HA 5 ILE H 4.0 2.0
 2 LYS HA 5 ILE H 3.4 2.0
 3 GLY QA 5 ILE H 4.0 2.0
 4 ARG QB 5 ILE H 3.6 2.0
 5 ILE HB 5 ILE  H 3.8 2.0
 5 ILE HG23 5 ILE H 4.2 2.0
 5 ILE QG1 5 ILE H 4.5 2.0
 5 ILE QD1 5 ILE H 4.8 2.0
 5 ILE HA 6 ASP H 3.5 2.0
 2 LYS HA 6 ASP H 4.0 2.0
 3 GLY QA 6 ASP H 3.4 2.0
 2 LYS QD 6 ASP H 3.8 2.0
 5 ILE QG2 6 ASP H 4.5 2.0
 6 ASP QB 6 ASP H 3.5 2.0
 6 ASP HA 7 ALA H 3.5 2.0
 3 GLY QA 7 ALA H 4.0 2.0
 6 ASP QB 7 ALA H 3.5 2.0
 7 ALA QB 7 ALA H 3.5 2.0
 6 ASP HA 9 ASP H 3.4 2.0
 5 ILE HA 9 ASP H 4.0 2.0
 8 PRO QB 9 ASP H 3.8 2.0
 9 ASP QB 9 ASP H 3.5 2.0
 9 ASP HA 10 PHE H 3.5 2.0
 6 ASP HA 10 PHE H 4.0 2.0
 9 ASP QB 10 PHE H 3.5 2.0
10 PHE QB 10 PHE H 3.5 2.0
11 PRO QB 12 SER H 3.5 2.0
 9 ASP HA 12 SER H 3.4 2.0
11 PRO QG 12 SER H 3.7 2.0
11 PRO QD 12 SER H 3.9 2.0
12 SER QB 12 SER H 3.5 2.0
12 SER HA 13 SER H 3.5 2.0
 9 ASP HA 13 SER H 4.0 2.0
12 SER QB 13 SER H 3.5 2.0
13 SER QB 13 SER H 3.5 2.0
14 PRO QB 15 ALA H 3.5 2.0
14 PRO QG 15 ALA H 3.7 2.0
14 PRO QD 15 ALA H 3.9 2.0
15 ALA QB 15 ALA H 3.5 2.0
15 ALA HA 16 ILE H 3.5 2.0
15 ALA QB 16 ILE H 3.5 2.0
16 ILE HB 16 ILE  H 3.8 2.0
16 ILE HG23 16 ILE H 4.2 2.0
16 ILE QG1 16 ILE H 4.5 2.0
16 ILE QD1 16 ILE H 4.8 2.0
16 ILE HA 17 LEU H 3.5 2.0
13 SER HA 17 LEU H 4.0 2.0
16 ILE HB 17 LEU  H 3.8 2.0
16 ILE HG23 17 LEU H 4.2 2.0
16 ILE QG1 17 LEU H 4.5 2.0
16 ILE QD1 17 LEU H 4.8 2.0
17 LEU QB 17 LEU H 3.5 2.0
17 LEU QQD 17 LEU H 4.0 2.0
17 LEU HA 18 GLY H 3.5 2.0
16 ILE HA 18 GLY H 4.3 2.0
15 ALA HA 18 GLY H 3.5 2.0
18 GLY QA 19 LYS H 3.5 2.0
15 ALA HA 19 LYS H 4.0 2.0
16 ILE HA 19 LYS H 3.4 2.0
17 LEU HA 19 LYS H 4.3 2.0
19 LYS QB 19 LYS H 3.8 2.0
19 LYS QG 19 LYS H 3.9 2.0
19 LYS QD 19 LYS H 4.0 2.0
19 LYS HA 20 ALA H 3.5 2.0
16 ILE HA 20 ALA H 4.0 2.0
19 LYS QB 20 ALA H 3.5     2.0
20 ALA QB 20 ALA H 3.7 2.0
20 ALA HA 21 ALA H 3.5 2.0
20 ALA QB 21 ALA H 3.5 2.0
21 ALA QB 21 ALA H 3.7 2.0
21 ALA  HA 22 THR H 3.5 2.0
19 LYS HA 22 THR H 3.4 2.0
21 ALA QB 22 THR H 3.5 2.0
22 THR HB 22 THR H 3.5 2.0
22 THR QG2 22 THR H 3.8 2.0
22 THR HA 23 ASP H 3.5 2.0
19 LYS HA 23 ASP H 4.0 2.0
20 ALA HA 23 ASP H 3.4 2.0
21 ALA HA 23 ASP H 4.2 2.0
22 THR QG2 23 ASP H 3.9 2.0
23 ASP QB 23 ASP H 3.5 2.0
23 ASP HA 24 VAL H 3.5 2.0
20 ALA HA 24 VAL H 4.0 2.0
23 ASP QB 24 VAL H 3.5 2.0
24 VAL HB 24 VAL H 3.5 2.0
24 VAL QQG 24 VAL H 4.0 2.0
24 VAL HA 25 VAL  H 3.5 2.0
24 VAL HB 25 VAL H 3.5 2.0
24 VAL QQG 25 VAL H 3.9 2.0
25 VAL HB 25 VAL H 3.5 2.0
25 VAL QQG 25 VAL H 3.9 2.0 
25 VAL HA 26 ALA H 3.5 2.0
26 ALA QB 26 ALA H 3.5 2.0
26 ALA HA 27 ALA H 3.5 2.0
23 ASP HA 27 ALA H 4.0 2.0
24 VAL HA 27 ALA H 3.4 2.0
27 ALA QB 27 ALA H 3.5 2.0
27 ALA HA 28 TRP H 3.5 2.0
27 ALA QB 28 TRP H 3.5 2.0
28 TRP QB 28 TRP H 3.5 2.0
28 TRP HA 29 LYS H 3.5 2.0
28 TRP QB 29 LYS H 3.5 2.0
29 LYS QB 29 LYS H 3.5 2.0
29 LYS QG 29 LYS H 3.6 2.0
29 LYS QD 29 LYS H 3.9 2.0
29 LYS HA 30 SER H 3.5 2.0
27 ALA HA 30 SER H 3.4 2.0
28 TRP HA 30 SER H 4.2 2.0
30 SER QB 30 SER H 3.5 2.0
29 LYS QB 30 SER H 3.5 2.0
29 LYS QG 30 SER H 3.6 2.0
29 LYS QD 30 SER H 3.9 2.0 
 2 LYS H 3 GLY H 2.8 2.0
 3 GLY H 4 ARG H 2.8 2.0
 4 ARG H 5 ILE H 2.8 2.0
 5 ILE H 6 ASP H 2.8 2.0
 6 ASP H 7 ALA H 2.8 2.0
 9 ASP H 10 PHE H 2.8 2.0
12 SER H 13 SER  H 2.8 2.0
15 ALA H 16 ILE H 2.8 2.0
16 ILE H 17 LEU H 2.8 2.0
17 LEU H 18 GLY H 2.8 2.0
18 GLY H 19 LYS H 2.8 2.0
19 LYS H 20 ALA H 2.8 2.0
20 ALA H 21 ALA H 2.8 2.0
21 ALA H 22 THR H 2.8 2.0
22 THR H 23 ASP H 2.8 2.0
23 ASP H 24 VAL H 2.8 2.0
24 VAL H 25 VAL H 2.8 2.0
25 VAL H 26 ALA H 2.8 2.0
26 ALA H 27 ALA H 2.8 2.0
27 ALA H 28 TRP H 2.9 2.0
28 TRP H 29 LYS H 2.9 2.0
29 LYS H 30 SER H 2.8 2.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   VAL   1           H        VAL   1   1.807   0.001   0.856
    2    HA   VAL   1           HA       VAL   1   2.989  -0.584  -1.081
    3    HB   VAL   1           HB       VAL   1   1.848  -0.505  -3.308
    4   HG11  VAL   1          1HG1      VAL   1   0.089  -2.384  -2.079
    5   HG12  VAL   1          2HG1      VAL   1   1.573  -2.684  -2.985
    6   HG13  VAL   1          3HG1      VAL   1   1.640  -2.418  -1.242
    7   HG21  VAL   1          3HG2      VAL   1  -0.338   0.048  -3.583
    8   HG22  VAL   1          1HG2      VAL   1  -0.799  -0.532  -1.982
    9   HG23  VAL   1          2HG2      VAL   1  -0.007   1.034  -2.158
   10    H    LYS   2           H        LYS   2   3.368   0.726  -3.304
   11    HA   LYS   2           HA       LYS   2   3.928   3.417  -2.442
   12    HB2  LYS   2           2HB      LYS   2   5.273   3.605  -4.367
   13    HB3  LYS   2           3HB      LYS   2   5.456   1.934  -3.851
   14    HG2  LYS   2           2HG      LYS   2   5.126   1.571  -6.057
   15    HG3  LYS   2           3HG      LYS   2   3.436   1.602  -5.548
   16    HD2  LYS   2           2HD      LYS   2   3.306   3.081  -7.273
   17    HD3  LYS   2           3HD      LYS   2   3.763   4.206  -5.992
   18    HE2  LYS   2           2HE      LYS   2   5.784   4.595  -6.892
   19    HE3  LYS   2           3HE      LYS   2   6.025   2.902  -7.323
   20    HZ1  LYS   2           3HZ      LYS   2   5.878   4.399  -9.258
   21    HZ2  LYS   2           1HZ      LYS   2   4.287   4.780  -8.827
   22    HZ3  LYS   2           2HZ      LYS   2   4.687   3.197  -9.269
   23    H    GLY   3           H        GLY   3   1.448   1.844  -4.204
   24    HA2  GLY   3           2HA      GLY   3   0.627   3.968  -5.886
   25    HA3  GLY   3           3HA      GLY   3  -0.371   2.615  -5.375
   26    H    ARG   4           H        ARG   4  -0.153   3.136  -2.554
   27    HA   ARG   4           HA       ARG   4  -2.307   4.950  -2.266
   28    HB2  ARG   4           2HB      ARG   4  -0.664   3.264  -0.495
   29    HB3  ARG   4           3HB      ARG   4  -1.328   4.703   0.266
   30    HG2  ARG   4           2HG      ARG   4  -2.954   3.119   0.673
   31    HG3  ARG   4           3HG      ARG   4  -3.566   3.930  -0.770
   32    HD2  ARG   4           2HD      ARG   4  -1.796   1.710  -1.397
   33    HD3  ARG   4           3HD      ARG   4  -3.197   1.211  -0.449
   34    HE   ARG   4           HE       ARG   4  -4.040   2.880  -2.549
   35   HH11  ARG   4          1HH1      ARG   4  -2.756  -0.307  -1.990
   36   HH12  ARG   4          2HH1      ARG   4  -3.510  -0.998  -3.389
   37   HH21  ARG   4          1HH2      ARG   4  -5.038   1.982  -4.393
   38   HH22  ARG   4          2HH2      ARG   4  -4.807   0.305  -4.756
   39    H    ILE   5           H        ILE   5   1.166   5.214  -1.685
   40    HA   ILE   5           HA       ILE   5   0.919   7.931  -0.709
   41    HB   ILE   5           HB       ILE   5   2.629   6.390   0.215
   42   HG12  ILE   5          2HG1      ILE   5   4.353   8.440  -0.976
   43   HG13  ILE   5          3HG1      ILE   5   2.842   9.080  -0.339
   44   HG21  ILE   5          1HG2      ILE   5   4.540   5.731  -1.033
   45   HG22  ILE   5          2HG2      ILE   5   3.126   5.310  -1.998
   46   HG23  ILE   5          3HG2      ILE   5   4.074   6.741  -2.402
   47   HD11  ILE   5          3HD1      ILE   5   4.357   9.241   1.424
   48   HD12  ILE   5          1HD1      ILE   5   3.403   7.804   1.792
   49   HD13  ILE   5          2HD1      ILE   5   5.024   7.637   1.117
   50    H    ASP   6           H        ASP   6   1.373   6.339  -3.706
   51    HA   ASP   6           HA       ASP   6   2.802   8.370  -5.081
   52    HB2  ASP   6           2HB      ASP   6   2.799   6.171  -6.018
   53    HB3  ASP   6           3HB      ASP   6   1.038   6.118  -6.045
   54    H    ALA   7           H        ALA   7  -0.610   7.748  -4.514
   55    HA   ALA   7           HA       ALA   7  -1.707   9.541  -6.357
   56    HB1  ALA   7           1HB      ALA   7  -3.616   8.785  -5.510
   57    HB2  ALA   7           2HB      ALA   7  -2.670   7.864  -4.340
   58    HB3  ALA   7           3HB      ALA   7  -3.251   9.478  -3.930
   59    HA   PRO   8           HA       PRO   8  -1.654  12.864  -2.841
   60    HB2  PRO   8           2HB      PRO   8  -0.128  12.330  -0.659
   61    HB3  PRO   8           3HB      PRO   8  -1.831  11.871  -0.776
   62    HG2  PRO   8           2HG      PRO   8   0.615  10.204  -1.223
   63    HG3  PRO   8           3HG      PRO   8  -0.878   9.791  -0.360
   64    HD2  PRO   8           2HD      PRO   8  -0.383   8.968  -2.892
   65    HD3  PRO   8           3HD      PRO   8  -2.021   9.321  -2.306
   66    H    ASP   9           H        ASP   9   1.254  10.979  -3.430
   67    HA   ASP   9           HA       ASP   9   3.020  13.242  -3.169
   68    HB2  ASP   9           2HB      ASP   9   3.415  10.397  -4.090
   69    HB3  ASP   9           3HB      ASP   9   4.707  11.593  -4.149
   70    H    PHE  10           H        PHE  10   1.039  11.942  -5.613
   71    HA   PHE  10           HA       PHE  10   2.465  12.531  -7.936
   72    HB2  PHE  10           2HB      PHE  10  -0.091  11.610  -7.326
   73    HB3  PHE  10           3HB      PHE  10  -0.373  13.114  -8.197
   74    HD1  PHE  10           HD2      PHE  10   1.529  13.277 -10.249
   75    HD2  PHE  10           HD1      PHE  10  -0.328   9.784  -8.678
   76    HE1  PHE  10           HE2      PHE  10   1.919  12.115 -12.382
   77    HE2  PHE  10           HE1      PHE  10   0.061   8.615 -10.808
   78    HZ   PHE  10           HZ       PHE  10   1.184   9.781 -12.664
   79    HA   PRO  11           HA       PRO  11   0.402  16.911  -7.842
   80    HB2  PRO  11           2HB      PRO  11  -0.713  17.687  -5.491
   81    HB3  PRO  11           3HB      PRO  11  -1.618  16.838  -6.749
   82    HG2  PRO  11           2HG      PRO  11  -0.376  15.754  -4.251
   83    HG3  PRO  11           3HG      PRO  11  -1.962  15.395  -4.959
   84    HD2  PRO  11           2HD      PRO  11   0.168  13.748  -5.246
   85    HD3  PRO  11           3HD      PRO  11  -1.082  13.918  -6.494
   86    H    SER  12           H        SER  12   1.987  15.660  -4.974
   87    HA   SER  12           HA       SER  12   3.225  18.183  -4.315
   88    HB2  SER  12           2HB      SER  12   3.144  15.461  -3.144
   89    HB3  SER  12           3HB      SER  12   4.605  16.396  -2.831
   90    HG   SER  12           HG       SER  12   2.556  16.585  -1.418
   91    H    SER  13           H        SER  13   3.883  15.563  -6.394
   92    HA   SER  13           HA       SER  13   6.670  15.481  -6.411
   93    HB2  SER  13           2HB      SER  13   4.631  14.279  -7.862
   94    HB3  SER  13           3HB      SER  13   5.517  15.202  -9.076
   95    HG   SER  13           HG       SER  13   6.447  13.145  -7.384
   96    HA   PRO  14           HA       PRO  14   6.509  18.898  -9.846
   97    HB2  PRO  14           2HB      PRO  14   4.198  20.309 -10.042
   98    HB3  PRO  14           3HB      PRO  14   4.504  18.835 -10.967
   99    HG2  PRO  14           2HG      PRO  14   2.933  19.196  -8.445
  100    HG3  PRO  14           3HG      PRO  14   2.540  18.230  -9.878
  101    HD2  PRO  14           2HD      PRO  14   3.554  17.137  -7.618
  102    HD3  PRO  14           3HD      PRO  14   3.904  16.488  -9.233
  103    H    ALA  15           H        ALA  15   4.886  19.291  -6.780
  104    HA   ALA  15           HA       ALA  15   5.523  22.090  -6.525
  105    HB1  ALA  15           1HB      ALA  15   3.936  20.147  -5.087
  106    HB2  ALA  15           2HB      ALA  15   4.905  21.133  -3.992
  107    HB3  ALA  15           3HB      ALA  15   3.801  21.905  -5.130
  108    H    ILE  16           H        ILE  16   6.785  19.036  -5.264
  109    HA   ILE  16           HA       ILE  16   8.734  20.246  -3.571
  110    HB   ILE  16           HB       ILE  16   8.422  17.442  -4.625
  111   HG12  ILE  16          2HG1      ILE  16   6.812  18.219  -2.915
  112   HG13  ILE  16          3HG1      ILE  16   7.843  16.926  -2.314
  113   HG21  ILE  16          1HG2      ILE  16  10.571  18.559  -2.838
  114   HG22  ILE  16          2HG2      ILE  16  10.204  16.840  -2.966
  115   HG23  ILE  16          3HG2      ILE  16  10.772  17.728  -4.380
  116   HD11  ILE  16          3HD1      ILE  16   7.373  19.432  -1.162
  117   HD12  ILE  16          1HD1      ILE  16   8.508  18.191  -0.631
  118   HD13  ILE  16          2HD1      ILE  16   9.040  19.458  -1.738
  119    H    LEU  17           H        LEU  17   8.782  18.917  -6.845
  120    HA   LEU  17           HA       LEU  17  11.592  19.219  -7.207
  121    HB2  LEU  17           2HB      LEU  17   9.270  18.485  -8.867
  122    HB3  LEU  17           3HB      LEU  17  10.634  19.193  -9.730
  123    HG   LEU  17           HG       LEU  17  11.064  16.883  -7.874
  124   HD11  LEU  17          1HD1      LEU  17   9.175  16.511  -9.630
  125   HD12  LEU  17          2HD1      LEU  17  10.437  15.299  -9.420
  126   HD13  LEU  17          3HD1      LEU  17  10.517  16.428 -10.772
  127   HD21  LEU  17          3HD2      LEU  17  12.672  16.584 -10.046
  128   HD22  LEU  17          1HD2      LEU  17  13.133  17.413  -8.559
  129   HD23  LEU  17          2HD2      LEU  17  12.549  18.341  -9.940
  130    H    GLY  18           H        GLY  18   8.814  21.279  -7.677
  131    HA2  GLY  18           2HA      GLY  18  10.253  23.231  -9.246
  132    HA3  GLY  18           3HA      GLY  18   8.620  23.392  -8.618
  133    H    LYS  19           H        LYS  19   9.468  22.749  -5.873
  134    HA   LYS  19           HA       LYS  19  10.208  25.422  -5.098
  135    HB2  LYS  19           2HB      LYS  19   9.185  22.997  -3.759
  136    HB3  LYS  19           3HB      LYS  19  10.223  24.019  -2.772
  137    HG2  LYS  19           2HG      LYS  19   7.936  24.646  -2.425
  138    HG3  LYS  19           3HG      LYS  19   8.762  25.942  -3.293
  139    HD2  LYS  19           2HD      LYS  19   7.858  24.742  -5.414
  140    HD3  LYS  19           3HD      LYS  19   6.724  23.990  -4.291
  141    HE2  LYS  19           2HE      LYS  19   6.906  26.830  -3.827
  142    HE3  LYS  19           3HE      LYS  19   6.500  26.495  -5.510
  143    HZ1  LYS  19           3HZ      LYS  19   4.447  26.532  -4.509
  144    HZ2  LYS  19           1HZ      LYS  19   4.996  25.827  -3.072
  145    HZ3  LYS  19           2HZ      LYS  19   4.798  24.878  -4.457
  146    H    ALA  20           H        ALA  20  11.739  22.280  -5.264
  147    HA   ALA  20           HA       ALA  20  14.013  22.897  -3.690
  148    HB1  ALA  20           1HB      ALA  20  14.118  20.683  -3.901
  149    HB2  ALA  20           2HB      ALA  20  13.102  20.694  -5.343
  150    HB3  ALA  20           3HB      ALA  20  14.839  20.965  -5.486
  151    H    ALA  21           H        ALA  21  13.219  23.353  -7.073
  152    HA   ALA  21           HA       ALA  21  15.867  23.981  -7.927
  153    HB1  ALA  21           1HB      ALA  21  14.966  23.944  -9.963
  154    HB2  ALA  21           2HB      ALA  21  13.455  23.476  -9.184
  155    HB3  ALA  21           3HB      ALA  21  13.774  25.173  -9.541
  156    H    THR  22           H        THR  22  13.083  25.890  -6.878
  157    HA   THR  22           HA       THR  22  14.417  28.402  -7.347
  158    HB   THR  22           HB       THR  22  11.973  28.240  -7.558
  159    HG1  THR  22           HG1      THR  22  11.858  30.251  -6.899
  160   HG21  THR  22          3HG2      THR  22  11.884  27.942  -4.561
  161   HG22  THR  22          1HG2      THR  22  11.721  26.581  -5.670
  162   HG23  THR  22          2HG2      THR  22  10.535  27.887  -5.695
  163    H    ASP  23           H        ASP  23  14.138  26.143  -4.756
  164    HA   ASP  23           HA       ASP  23  14.759  27.966  -2.639
  165    HB2  ASP  23           2HB      ASP  23  14.545  24.996  -2.905
  166    HB3  ASP  23           3HB      ASP  23  15.379  25.661  -1.503
  167    H    VAL  24           H        VAL  24  16.608  25.777  -4.691
  168    HA   VAL  24           HA       VAL  24  19.077  26.121  -3.306
  169    HB   VAL  24           HB       VAL  24  18.566  25.173  -6.130
  170   HG11  VAL  24          1HG1      VAL  24  21.039  25.225  -4.430
  171   HG12  VAL  24          2HG1      VAL  24  20.843  24.071  -5.751
  172   HG13  VAL  24          3HG1      VAL  24  20.821  25.804  -6.080
  173   HG21  VAL  24          3HG2      VAL  24  18.140  23.123  -5.323
  174   HG22  VAL  24          1HG2      VAL  24  19.390  23.247  -4.084
  175   HG23  VAL  24          2HG2      VAL  24  17.801  23.960  -3.808
  176    H    VAL  25           H        VAL  25  17.513  27.723  -6.013
  177    HA   VAL  25           HA       VAL  25  19.773  29.231  -6.847
  178    HB   VAL  25           HB       VAL  25  16.834  29.797  -7.264
  179   HG11  VAL  25          1HG1      VAL  25  18.116  30.913  -9.374
  180   HG12  VAL  25          2HG1      VAL  25  17.628  31.796  -7.926
  181   HG13  VAL  25          3HG1      VAL  25  19.282  31.202  -8.083
  182   HG21  VAL  25          3HG2      VAL  25  18.404  28.841  -9.527
  183   HG22  VAL  25          1HG2      VAL  25  18.301  27.675  -8.208
  184   HG23  VAL  25          2HG2      VAL  25  16.828  28.314  -8.938
  185    H    ALA  26           H        ALA  26  17.155  29.803  -4.565
  186    HA   ALA  26           HA       ALA  26  17.920  32.537  -4.074
  187    HB1  ALA  26           1HB      ALA  26  16.124  32.619  -2.541
  188    HB2  ALA  26           2HB      ALA  26  15.571  31.620  -3.886
  189    HB3  ALA  26           3HB      ALA  26  16.085  30.863  -2.378
  190    H    ALA  27           H        ALA  27  18.494  29.405  -2.613
  191    HA   ALA  27           HA       ALA  27  19.469  30.230  -0.122
  192    HB1  ALA  27           1HB      ALA  27  20.855  28.011  -0.400
  193    HB2  ALA  27           2HB      ALA  27  19.104  27.971  -0.188
  194    HB3  ALA  27           3HB      ALA  27  19.802  27.792  -1.798
  195    H    TRP  28           H        TRP  28  20.830  30.506  -3.255
  196    HA   TRP  28           HA       TRP  28  23.569  30.464  -2.682
  197    HB2  TRP  28           2HB      TRP  28  21.970  30.985  -4.921
  198    HB3  TRP  28           3HB      TRP  28  22.916  32.451  -4.685
  199    HD1  TRP  28           HD1      TRP  28  23.707  28.638  -4.705
  200    HE1  TRP  28           HE1      TRP  28  25.902  28.302  -6.007
  201    HE3  TRP  28           HE3      TRP  28  24.736  33.517  -5.834
  202    HZ2  TRP  28           HZ2      TRP  28  27.817  29.895  -7.336
  203    HZ3  TRP  28           HZ3      TRP  28  26.769  34.026  -7.123
  204    HH2  TRP  28           HH2      TRP  28  28.277  32.251  -7.857
  205    H    LYS  29           H        LYS  29  21.141  32.848  -2.045
  206    HA   LYS  29           HA       LYS  29  22.917  35.057  -1.680
  207    HB2  LYS  29           2HB      LYS  29  21.027  36.261  -0.916
  208    HB3  LYS  29           3HB      LYS  29  20.432  35.189  -2.178
  209    HG2  LYS  29           2HG      LYS  29  19.974  33.607  -0.105
  210    HG3  LYS  29           3HG      LYS  29  19.925  35.155   0.743
  211    HD2  LYS  29           2HD      LYS  29  18.413  34.967  -1.798
  212    HD3  LYS  29           3HD      LYS  29  17.777  34.063  -0.422
  213    HE2  LYS  29           2HE      LYS  29  18.552  36.955  -0.196
  214    HE3  LYS  29           3HE      LYS  29  16.956  36.466  -0.761
  215    HZ1  LYS  29           3HZ      LYS  29  16.684  35.220   1.324
  216    HZ2  LYS  29           1HZ      LYS  29  16.892  36.878   1.589
  217    HZ3  LYS  29           2HZ      LYS  29  18.173  35.810   1.867
  218    H    SER  30           H        SER  30  21.636  32.527   0.369
  219    HA   SER  30           HA       SER  30  22.380  33.699   2.850
  220    HB2  SER  30           2HB      SER  30  21.905  30.790   2.154
  221    HB3  SER  30           3HB      SER  30  21.994  31.451   3.786
  222    HG   SER  30           HG       SER  30  19.993  31.744   1.847
  Start of MODEL    2
    1    H1   VAL   1           H        VAL   1   1.168  -0.742   0.356
    2    HA   VAL   1           HA       VAL   1   3.082  -0.467  -1.110
    3    HB   VAL   1           HB       VAL   1   1.950  -0.355  -3.377
    4   HG11  VAL   1          1HG1      VAL   1   0.672  -2.502  -2.967
    5   HG12  VAL   1          2HG1      VAL   1   2.358  -2.489  -2.445
    6   HG13  VAL   1          3HG1      VAL   1   1.065  -2.300  -1.260
    7   HG21  VAL   1          3HG2      VAL   1  -0.705  -0.754  -2.324
    8   HG22  VAL   1          1HG2      VAL   1  -0.088   0.840  -1.892
    9   HG23  VAL   1          2HG2      VAL   1  -0.152   0.348  -3.584
   10    H    LYS   2           H        LYS   2   3.511   0.821  -3.330
   11    HA   LYS   2           HA       LYS   2   4.007   3.531  -2.488
   12    HB2  LYS   2           2HB      LYS   2   5.409   3.713  -4.372
   13    HB3  LYS   2           3HB      LYS   2   5.599   2.051  -3.828
   14    HG2  LYS   2           2HG      LYS   2   5.343   1.655  -6.038
   15    HG3  LYS   2           3HG      LYS   2   3.638   1.668  -5.582
   16    HD2  LYS   2           2HD      LYS   2   3.541   3.122  -7.330
   17    HD3  LYS   2           3HD      LYS   2   3.943   4.271  -6.051
   18    HE2  LYS   2           2HE      LYS   2   6.091   4.542  -6.783
   19    HE3  LYS   2           3HE      LYS   2   6.178   2.920  -7.468
   20    HZ1  LYS   2           3HZ      LYS   2   4.883   5.318  -8.624
   21    HZ2  LYS   2           1HZ      LYS   2   4.562   3.757  -9.193
   22    HZ3  LYS   2           2HZ      LYS   2   6.131   4.384  -9.282
   23    H    GLY   3           H        GLY   3   1.605   1.899  -4.304
   24    HA2  GLY   3           2HA      GLY   3   0.809   3.989  -6.040
   25    HA3  GLY   3           3HA      GLY   3  -0.187   2.629  -5.542
   26    H    ARG   4           H        ARG   4  -0.062   3.192  -2.722
   27    HA   ARG   4           HA       ARG   4  -2.250   4.978  -2.527
   28    HB2  ARG   4           2HB      ARG   4  -0.455   3.923  -0.333
   29    HB3  ARG   4           3HB      ARG   4  -2.030   4.671  -0.104
   30    HG2  ARG   4           2HG      ARG   4  -1.618   2.164  -1.710
   31    HG3  ARG   4           3HG      ARG   4  -1.982   2.166   0.017
   32    HD2  ARG   4           2HD      ARG   4  -3.849   3.887  -1.180
   33    HD3  ARG   4           3HD      ARG   4  -3.756   2.468  -2.221
   34    HE   ARG   4           HE       ARG   4  -4.004   1.838   0.571
   35   HH11  ARG   4          1HH1      ARG   4  -5.727   2.609  -2.353
   36   HH12  ARG   4          2HH1      ARG   4  -7.195   1.842  -1.846
   37   HH21  ARG   4          1HH2      ARG   4  -5.931   0.824   1.251
   38   HH22  ARG   4          2HH2      ARG   4  -7.311   0.828   0.205
   39    H    ILE   5           H        ILE   5   1.200   5.299  -1.842
   40    HA   ILE   5           HA       ILE   5   0.885   8.025  -0.912
   41    HB   ILE   5           HB       ILE   5   2.586   6.519   0.086
   42   HG12  ILE   5          2HG1      ILE   5   4.205   8.667  -1.168
   43   HG13  ILE   5          3HG1      ILE   5   2.743   9.173  -0.329
   44   HG21  ILE   5          1HG2      ILE   5   4.549   5.879  -1.093
   45   HG22  ILE   5          2HG2      ILE   5   3.171   5.416  -2.090
   46   HG23  ILE   5          3HG2      ILE   5   4.104   6.858  -2.490
   47   HD11  ILE   5          3HD1      ILE   5   5.205   7.897   0.756
   48   HD12  ILE   5          1HD1      ILE   5   4.322   9.312   1.329
   49   HD13  ILE   5          2HD1      ILE   5   3.669   7.695   1.597
   50    H    ASP   6           H        ASP   6   1.453   6.399  -3.871
   51    HA   ASP   6           HA       ASP   6   2.900   8.429  -5.228
   52    HB2  ASP   6           2HB      ASP   6   2.952   6.222  -6.139
   53    HB3  ASP   6           3HB      ASP   6   1.194   6.141  -6.211
   54    H    ALA   7           H        ALA   7  -0.523   7.770  -4.766
   55    HA   ALA   7           HA       ALA   7  -1.580   9.531  -6.662
   56    HB1  ALA   7           1HB      ALA   7  -2.574   8.225  -4.205
   57    HB2  ALA   7           2HB      ALA   7  -3.474   9.632  -4.774
   58    HB3  ALA   7           3HB      ALA   7  -3.246   8.242  -5.835
   59    HA   PRO   8           HA       PRO   8  -1.682  12.892  -3.184
   60    HB2  PRO   8           2HB      PRO   8  -0.224  12.400  -0.947
   61    HB3  PRO   8           3HB      PRO   8  -1.917  11.919  -1.116
   62    HG2  PRO   8           2HG      PRO   8   0.562  10.277  -1.461
   63    HG3  PRO   8           3HG      PRO   8  -0.954   9.856  -0.645
   64    HD2  PRO   8           2HD      PRO   8  -0.365   9.011  -3.149
   65    HD3  PRO   8           3HD      PRO   8  -2.026   9.351  -2.622
   66    H    ASP   9           H        ASP   9   1.265  11.036  -3.659
   67    HA   ASP   9           HA       ASP   9   2.996  13.322  -3.362
   68    HB2  ASP   9           2HB      ASP   9   3.881  11.173  -2.740
   69    HB3  ASP   9           3HB      ASP   9   3.496  10.500  -4.322
   70    H    PHE  10           H        PHE  10   1.112  11.975  -5.857
   71    HA   PHE  10           HA       PHE  10   2.605  12.560  -8.138
   72    HB2  PHE  10           2HB      PHE  10   0.031  11.629  -7.595
   73    HB3  PHE  10           3HB      PHE  10  -0.220  13.107  -8.518
   74    HD1  PHE  10           HD1      PHE  10   2.172  10.241  -8.649
   75    HD2  PHE  10           HD2      PHE  10  -0.552  12.748 -10.750
   76    HE1  PHE  10           HE1      PHE  10   2.656   9.019 -10.729
   77    HE2  PHE  10           HE2      PHE  10  -0.073  11.529 -12.832
   78    HZ   PHE  10           HZ       PHE  10   1.532   9.661 -12.824
   79    HA   PRO  11           HA       PRO  11   0.487  16.914  -8.153
   80    HB2  PRO  11           2HB      PRO  11  -0.712  17.698  -5.847
   81    HB3  PRO  11           3HB      PRO  11  -1.566  16.826  -7.126
   82    HG2  PRO  11           2HG      PRO  11  -0.392  15.781  -4.578
   83    HG3  PRO  11           3HG      PRO  11  -1.950  15.396  -5.333
   84    HD2  PRO  11           2HD      PRO  11   0.208  13.773  -5.536
   85    HD3  PRO  11           3HD      PRO  11  -1.003  13.916  -6.826
   86    H    SER  12           H        SER  12   1.993  15.711  -5.223
   87    HA   SER  12           HA       SER  12   3.178  18.255  -4.549
   88    HB2  SER  12           2HB      SER  12   2.839  15.686  -3.268
   89    HB3  SER  12           3HB      SER  12   4.513  16.226  -3.134
   90    HG   SER  12           HG       SER  12   3.769  18.151  -2.216
   91    H    SER  13           H        SER  13   3.936  15.623  -6.579
   92    HA   SER  13           HA       SER  13   6.722  15.575  -6.505
   93    HB2  SER  13           2HB      SER  13   4.709  14.395  -8.064
   94    HB3  SER  13           3HB      SER  13   5.745  15.245  -9.210
   95    HG   SER  13           HG       SER  13   7.435  14.018  -8.619
   96    HA   PRO  14           HA       PRO  14   6.636  18.961  -9.974
   97    HB2  PRO  14           2HB      PRO  14   4.316  20.341 -10.261
   98    HB3  PRO  14           3HB      PRO  14   4.671  18.862 -11.162
   99    HG2  PRO  14           2HG      PRO  14   3.010  19.226  -8.698
  100    HG3  PRO  14           3HG      PRO  14   2.679  18.242 -10.136
  101    HD2  PRO  14           2HD      PRO  14   3.628  17.182  -7.832
  102    HD3  PRO  14           3HD      PRO  14   4.041  16.523  -9.428
  103    H    ALA  15           H        ALA  15   4.909  19.357  -6.967
  104    HA   ALA  15           HA       ALA  15   5.498  22.167  -6.716
  105    HB1  ALA  15           1HB      ALA  15   3.495  21.437  -5.684
  106    HB2  ALA  15           2HB      ALA  15   4.328  20.143  -4.821
  107    HB3  ALA  15           3HB      ALA  15   4.617  21.826  -4.379
  108    H    ILE  16           H        ILE  16   6.767  19.142  -5.399
  109    HA   ILE  16           HA       ILE  16   8.649  20.402  -3.660
  110    HB   ILE  16           HB       ILE  16   8.394  17.576  -4.669
  111   HG12  ILE  16          2HG1      ILE  16   8.175  18.561  -1.834
  112   HG13  ILE  16          3HG1      ILE  16   6.801  18.640  -2.932
  113   HG21  ILE  16          1HG2      ILE  16  10.473  18.748  -2.834
  114   HG22  ILE  16          2HG2      ILE  16  10.128  17.023  -2.944
  115   HG23  ILE  16          3HG2      ILE  16  10.732  17.892  -4.354
  116   HD11  ILE  16          3HD1      ILE  16   6.873  16.238  -3.228
  117   HD12  ILE  16          1HD1      ILE  16   8.293  16.136  -2.188
  118   HD13  ILE  16          2HD1      ILE  16   6.745  16.651  -1.518
  119    H    LEU  17           H        LEU  17   8.795  19.029  -6.910
  120    HA   LEU  17           HA       LEU  17  11.618  19.357  -7.190
  121    HB2  LEU  17           2HB      LEU  17  10.114  17.757  -8.466
  122    HB3  LEU  17           3HB      LEU  17   9.619  19.149  -9.426
  123    HG   LEU  17           HG       LEU  17  12.471  19.014  -9.402
  124   HD11  LEU  17          1HD1      LEU  17  12.923  16.890 -10.317
  125   HD12  LEU  17          2HD1      LEU  17  11.210  16.497 -10.456
  126   HD13  LEU  17          3HD1      LEU  17  11.966  16.593  -8.866
  127   HD21  LEU  17          3HD2      LEU  17  10.378  18.612 -11.534
  128   HD22  LEU  17          1HD2      LEU  17  12.106  18.781 -11.847
  129   HD23  LEU  17          2HD2      LEU  17  11.207  20.114 -11.122
  130    H    GLY  18           H        GLY  18   8.822  21.355  -7.784
  131    HA2  GLY  18           2HA      GLY  18  10.269  23.288  -9.374
  132    HA3  GLY  18           3HA      GLY  18   8.616  23.437  -8.794
  133    H    LYS  19           H        LYS  19   9.395  22.886  -6.011
  134    HA   LYS  19           HA       LYS  19  10.084  25.593  -5.297
  135    HB2  LYS  19           2HB      LYS  19   9.496  25.009  -3.084
  136    HB3  LYS  19           3HB      LYS  19   8.365  24.139  -4.113
  137    HG2  LYS  19           2HG      LYS  19   9.664  22.100  -3.845
  138    HG3  LYS  19           3HG      LYS  19  10.835  22.966  -2.849
  139    HD2  LYS  19           2HD      LYS  19   8.861  23.541  -1.334
  140    HD3  LYS  19           3HD      LYS  19   7.970  22.304  -2.224
  141    HE2  LYS  19           2HE      LYS  19   9.702  20.660  -1.624
  142    HE3  LYS  19           3HE      LYS  19  10.541  21.903  -0.696
  143    HZ1  LYS  19           3HZ      LYS  19   7.732  21.456  -0.058
  144    HZ2  LYS  19           1HZ      LYS  19   9.031  21.813   0.965
  145    HZ3  LYS  19           2HZ      LYS  19   8.814  20.236   0.393
  146    H    ALA  20           H        ALA  20  11.641  22.464  -5.331
  147    HA   ALA  20           HA       ALA  20  13.852  23.135  -3.687
  148    HB1  ALA  20           1HB      ALA  20  14.923  21.144  -4.797
  149    HB2  ALA  20           2HB      ALA  20  13.377  20.835  -4.006
  150    HB3  ALA  20           3HB      ALA  20  13.454  20.992  -5.761
  151    H    ALA  21           H        ALA  21  13.182  23.497  -7.109
  152    HA   ALA  21           HA       ALA  21  15.853  24.129  -7.879
  153    HB1  ALA  21           1HB      ALA  21  14.674  25.060  -9.943
  154    HB2  ALA  21           2HB      ALA  21  14.479  23.339  -9.605
  155    HB3  ALA  21           3HB      ALA  21  13.183  24.468  -9.209
  156    H    THR  22           H        THR  22  13.018  26.038  -6.981
  157    HA   THR  22           HA       THR  22  14.348  28.550  -7.465
  158    HB   THR  22           HB       THR  22  11.914  28.359  -7.760
  159    HG1  THR  22           HG1      THR  22  12.373  30.088  -5.560
  160   HG21  THR  22          3HG2      THR  22  11.715  28.143  -4.761
  161   HG22  THR  22          1HG2      THR  22  11.613  26.748  -5.834
  162   HG23  THR  22          2HG2      THR  22  10.413  28.036  -5.946
  163    H    ASP  23           H        ASP  23  13.993  26.353  -4.829
  164    HA   ASP  23           HA       ASP  23  14.523  28.234  -2.738
  165    HB2  ASP  23           2HB      ASP  23  14.311  25.264  -2.943
  166    HB3  ASP  23           3HB      ASP  23  15.132  25.945  -1.540
  167    H    VAL  24           H        VAL  24  16.461  26.009  -4.666
  168    HA   VAL  24           HA       VAL  24  18.875  26.407  -3.202
  169    HB   VAL  24           HB       VAL  24  18.474  25.387  -6.018
  170   HG11  VAL  24          1HG1      VAL  24  20.789  24.276  -5.060
  171   HG12  VAL  24          2HG1      VAL  24  20.692  25.647  -6.167
  172   HG13  VAL  24          3HG1      VAL  24  20.867  25.923  -4.434
  173   HG21  VAL  24          3HG2      VAL  24  18.023  23.358  -5.175
  174   HG22  VAL  24          1HG2      VAL  24  19.239  23.512  -3.907
  175   HG23  VAL  24          2HG2      VAL  24  17.642  24.225  -3.687
  176    H    VAL  25           H        VAL  25  17.400  27.930  -6.002
  177    HA   VAL  25           HA       VAL  25  19.678  29.435  -6.791
  178    HB   VAL  25           HB       VAL  25  16.752  29.968  -7.328
  179   HG11  VAL  25          1HG1      VAL  25  19.225  31.360  -8.110
  180   HG12  VAL  25          2HG1      VAL  25  18.080  31.050  -9.417
  181   HG13  VAL  25          3HG1      VAL  25  17.571  31.959  -7.993
  182   HG21  VAL  25          3HG2      VAL  25  16.816  28.430  -8.949
  183   HG22  VAL  25          1HG2      VAL  25  18.395  28.976  -9.517
  184   HG23  VAL  25          2HG2      VAL  25  18.285  27.839  -8.172
  185    H    ALA  26           H        ALA  26  16.974  30.042  -4.620
  186    HA   ALA  26           HA       ALA  26  17.701  32.793  -4.170
  187    HB1  ALA  26           1HB      ALA  26  15.995  32.166  -2.137
  188    HB2  ALA  26           2HB      ALA  26  15.505  32.734  -3.734
  189    HB3  ALA  26           3HB      ALA  26  15.523  31.007  -3.380
  190    H    ALA  27           H        ALA  27  18.245  29.703  -2.612
  191    HA   ALA  27           HA       ALA  27  19.123  30.596  -0.108
  192    HB1  ALA  27           1HB      ALA  27  18.612  28.268  -0.519
  193    HB2  ALA  27           2HB      ALA  27  19.954  28.146  -1.658
  194    HB3  ALA  27           3HB      ALA  27  20.273  28.423   0.054
  195    H    TRP  28           H        TRP  28  20.594  30.806  -3.196
  196    HA   TRP  28           HA       TRP  28  23.311  30.800  -2.523
  197    HB2  TRP  28           2HB      TRP  28  21.844  31.163  -4.837
  198    HB3  TRP  28           3HB      TRP  28  22.613  32.731  -4.605
  199    HD1  TRP  28           HD1      TRP  28  25.220  32.886  -4.977
  200    HE1  TRP  28           HE1      TRP  28  26.954  31.261  -5.964
  201    HE3  TRP  28           HE3      TRP  28  22.411  28.614  -4.993
  202    HZ2  TRP  28           HZ2      TRP  28  27.111  28.529  -6.659
  203    HZ3  TRP  28           HZ3      TRP  28  23.428  26.538  -5.835
  204    HH2  TRP  28           HH2      TRP  28  25.729  26.498  -6.651
  205    H    LYS  29           H        LYS  29  20.844  33.179  -2.033
  206    HA   LYS  29           HA       LYS  29  22.590  35.410  -1.659
  207    HB2  LYS  29           2HB      LYS  29  20.665  36.618  -0.993
  208    HB3  LYS  29           3HB      LYS  29  20.124  35.511  -2.249
  209    HG2  LYS  29           2HG      LYS  29  19.603  33.976  -0.157
  210    HG3  LYS  29           3HG      LYS  29  19.511  35.542   0.651
  211    HD2  LYS  29           2HD      LYS  29  18.063  35.092  -1.929
  212    HD3  LYS  29           3HD      LYS  29  17.370  34.516  -0.411
  213    HE2  LYS  29           2HE      LYS  29  16.443  36.627  -0.613
  214    HE3  LYS  29           3HE      LYS  29  17.836  36.924   0.425
  215    HZ1  LYS  29           3HZ      LYS  29  18.051  37.225  -2.501
  216    HZ2  LYS  29           1HZ      LYS  29  19.004  37.921  -1.288
  217    HZ3  LYS  29           2HZ      LYS  29  17.429  38.479  -1.551
  218    H    SER  30           H        SER  30  21.254  32.921   0.405
  219    HA   SER  30           HA       SER  30  21.927  34.168   2.877
  220    HB2  SER  30           2HB      SER  30  20.202  32.465   2.824
  221    HB3  SER  30           3HB      SER  30  21.344  31.276   2.197
  222    HG   SER  30           HG       SER  30  20.941  31.179   4.512
  Start of MODEL    3
    1    H1   VAL   1           H        VAL   1   1.526  -1.514  -3.296
    2    HA   VAL   1           HA       VAL   1   0.823   0.026  -1.760
    3    HB   VAL   1           HB       VAL   1   3.649  -0.123  -0.720
    4   HG11  VAL   1          1HG1      VAL   1   1.240   1.094   0.208
    5   HG12  VAL   1          2HG1      VAL   1   1.701  -0.196   1.320
    6   HG13  VAL   1          3HG1      VAL   1   2.841   1.097   0.948
    7   HG21  VAL   1          3HG2      VAL   1   3.058  -2.383  -1.048
    8   HG22  VAL   1          1HG2      VAL   1   2.738  -2.053   0.654
    9   HG23  VAL   1          2HG2      VAL   1   1.404  -2.113  -0.498
   10    H    LYS   2           H        LYS   2   3.173   0.833  -3.966
   11    HA   LYS   2           HA       LYS   2   3.734   3.502  -3.038
   12    HB2  LYS   2           2HB      LYS   2   5.086   3.735  -4.952
   13    HB3  LYS   2           3HB      LYS   2   5.265   2.051  -4.476
   14    HG2  LYS   2           2HG      LYS   2   4.944   1.742  -6.692
   15    HG3  LYS   2           3HG      LYS   2   3.252   1.763  -6.189
   16    HD2  LYS   2           2HD      LYS   2   3.130   3.284  -7.877
   17    HD3  LYS   2           3HD      LYS   2   3.584   4.377  -6.568
   18    HE2  LYS   2           2HE      LYS   2   5.908   3.169  -7.792
   19    HE3  LYS   2           3HE      LYS   2   4.915   4.002  -8.987
   20    HZ1  LYS   2           3HZ      LYS   2   5.051   6.008  -7.732
   21    HZ2  LYS   2           1HZ      LYS   2   6.625   5.419  -7.923
   22    HZ3  LYS   2           2HZ      LYS   2   5.826   5.232  -6.444
   23    H    GLY   3           H        GLY   3   1.259   1.975  -4.847
   24    HA2  GLY   3           2HA      GLY   3   0.448   4.140  -6.481
   25    HA3  GLY   3           3HA      GLY   3  -0.555   2.777  -6.006
   26    H    ARG   4           H        ARG   4  -0.345   3.231  -3.172
   27    HA   ARG   4           HA       ARG   4  -2.499   5.041  -2.849
   28    HB2  ARG   4           2HB      ARG   4  -0.705   3.574  -0.936
   29    HB3  ARG   4           3HB      ARG   4  -1.885   4.739  -0.352
   30    HG2  ARG   4           2HG      ARG   4  -3.667   3.420  -0.898
   31    HG3  ARG   4           3HG      ARG   4  -2.806   2.609  -2.208
   32    HD2  ARG   4           2HD      ARG   4  -1.713   2.172   0.490
   33    HD3  ARG   4           3HD      ARG   4  -3.316   1.495   0.206
   34    HE   ARG   4           HE       ARG   4  -1.456   0.867  -1.879
   35   HH11  ARG   4          1HH1      ARG   4  -2.581  -0.046   1.286
   36   HH12  ARG   4          2HH1      ARG   4  -2.081  -1.697   1.131
   37   HH21  ARG   4          1HH2      ARG   4  -0.793  -1.305  -2.096
   38   HH22  ARG   4          2HH2      ARG   4  -1.063  -2.412  -0.793
   39    H    ILE   5           H        ILE   5   0.973   5.285  -2.249
   40    HA   ILE   5           HA       ILE   5   0.726   7.978  -1.209
   41    HB   ILE   5           HB       ILE   5   2.428   6.427  -0.305
   42   HG12  ILE   5          2HG1      ILE   5   4.034   8.583  -1.580
   43   HG13  ILE   5          3HG1      ILE   5   2.633   9.076  -0.634
   44   HG21  ILE   5          1HG2      ILE   5   4.331   5.756  -1.556
   45   HG22  ILE   5          2HG2      ILE   5   2.916   5.366  -2.532
   46   HG23  ILE   5          3HG2      ILE   5   3.885   6.789  -2.913
   47   HD11  ILE   5          3HD1      ILE   5   5.206   7.963   0.230
   48   HD12  ILE   5          1HD1      ILE   5   4.107   9.071   1.052
   49   HD13  ILE   5          2HD1      ILE   5   3.787   7.336   1.069
   50    H    ASP   6           H        ASP   6   1.188   6.458  -4.241
   51    HA   ASP   6           HA       ASP   6   2.629   8.516  -5.561
   52    HB2  ASP   6           2HB      ASP   6   2.648   6.379  -6.589
   53    HB3  ASP   6           3HB      ASP   6   0.891   6.260  -6.548
   54    H    ALA   7           H        ALA   7  -0.790   7.890  -5.030
   55    HA   ALA   7           HA       ALA   7  -1.870   9.737  -6.829
   56    HB1  ALA   7           1HB      ALA   7  -2.811   8.150  -4.611
   57    HB2  ALA   7           2HB      ALA   7  -3.576   9.740  -4.627
   58    HB3  ALA   7           3HB      ALA   7  -3.674   8.699  -6.048
   59    HA   PRO   8           HA       PRO   8  -1.825  12.965  -3.225
   60    HB2  PRO   8           2HB      PRO   8  -0.315  12.367  -1.050
   61    HB3  PRO   8           3HB      PRO   8  -2.019  11.918  -1.189
   62    HG2  PRO   8           2HG      PRO   8   0.424  10.254  -1.665
   63    HG3  PRO   8           3HG      PRO   8  -1.076   9.824  -0.823
   64    HD2  PRO   8           2HD      PRO   8  -0.568   9.067  -3.372
   65    HD3  PRO   8           3HD      PRO   8  -2.209   9.411  -2.787
   66    H    ASP   9           H        ASP   9   1.078  11.086  -3.851
   67    HA   ASP   9           HA       ASP   9   2.853  13.332  -3.517
   68    HB2  ASP   9           2HB      ASP   9   3.603  11.036  -3.030
   69    HB3  ASP   9           3HB      ASP   9   3.369  10.605  -4.722
   70    H    PHE  10           H        PHE  10   0.881  12.109  -6.007
   71    HA   PHE  10           HA       PHE  10   2.321  12.758  -8.305
   72    HB2  PHE  10           2HB      PHE  10  -0.269  11.868  -7.714
   73    HB3  PHE  10           3HB      PHE  10  -0.493  13.365  -8.613
   74    HD1  PHE  10           HD2      PHE  10   1.918  10.524  -8.852
   75    HD2  PHE  10           HD1      PHE  10  -0.973  12.956 -10.812
   76    HE1  PHE  10           HE2      PHE  10   2.335   9.317 -10.955
   77    HE2  PHE  10           HE1      PHE  10  -0.561  11.752 -12.919
   78    HZ   PHE  10           HZ       PHE  10   1.095   9.931 -12.992
   79    HA   PRO  11           HA       PRO  11   0.272  17.141  -8.098
   80    HB2  PRO  11           2HB      PRO  11  -0.853  17.854  -5.733
   81    HB3  PRO  11           3HB      PRO  11  -1.754  17.044  -7.019
   82    HG2  PRO  11           2HG      PRO  11  -0.529  15.885  -4.545
   83    HG3  PRO  11           3HG      PRO  11  -2.112  15.552  -5.271
   84    HD2  PRO  11           2HD      PRO  11   0.014  13.907  -5.594
   85    HD3  PRO  11           3HD      PRO  11  -1.229  14.116  -6.844
   86    H    SER  12           H        SER  12   1.838  15.804  -5.258
   87    HA   SER  12           HA       SER  12   3.080  18.303  -4.522
   88    HB2  SER  12           2HB      SER  12   3.681  15.512  -3.516
   89    HB3  SER  12           3HB      SER  12   4.163  17.030  -2.758
   90    HG   SER  12           HG       SER  12   2.226  17.242  -1.948
   91    H    SER  13           H        SER  13   3.741  15.741  -6.670
   92    HA   SER  13           HA       SER  13   6.528  15.649  -6.675
   93    HB2  SER  13           2HB      SER  13   4.472  14.527  -8.195
   94    HB3  SER  13           3HB      SER  13   5.432  15.442  -9.358
   95    HG   SER  13           HG       SER  13   6.699  13.770  -7.484
   96    HA   PRO  14           HA       PRO  14   6.397  19.163 -10.013
   97    HB2  PRO  14           2HB      PRO  14   4.092  20.587 -10.181
   98    HB3  PRO  14           3HB      PRO  14   4.398  19.138 -11.146
   99    HG2  PRO  14           2HG      PRO  14   2.814  19.434  -8.623
  100    HG3  PRO  14           3HG      PRO  14   2.426  18.509 -10.086
  101    HD2  PRO  14           2HD      PRO  14   3.424  17.350  -7.851
  102    HD3  PRO  14           3HD      PRO  14   3.781  16.745  -9.482
  103    H    ALA  15           H        ALA  15   4.757  19.475  -6.946
  104    HA   ALA  15           HA       ALA  15   5.403  22.263  -6.608
  105    HB1  ALA  15           1HB      ALA  15   3.582  20.529  -5.452
  106    HB2  ALA  15           2HB      ALA  15   4.743  20.852  -4.164
  107    HB3  ALA  15           3HB      ALA  15   3.912  22.190  -4.956
  108    H    ILE  16           H        ILE  16   6.649  19.170  -5.434
  109    HA   ILE  16           HA       ILE  16   8.592  20.325  -3.694
  110    HB   ILE  16           HB       ILE  16   8.275  17.552  -4.825
  111   HG12  ILE  16          2HG1      ILE  16   6.657  18.288  -3.106
  112   HG13  ILE  16          3HG1      ILE  16   7.680  16.976  -2.532
  113   HG21  ILE  16          1HG2      ILE  16  10.417  18.611  -2.995
  114   HG22  ILE  16          2HG2      ILE  16  10.044  16.898  -3.173
  115   HG23  ILE  16          3HG2      ILE  16  10.624  17.821  -4.558
  116   HD11  ILE  16          3HD1      ILE  16   9.084  18.652  -1.371
  117   HD12  ILE  16          1HD1      ILE  16   7.930  19.895  -1.856
  118   HD13  ILE  16          2HD1      ILE  16   7.421  18.587  -0.787
  119    H    LEU  17           H        LEU  17   8.650  19.089  -7.004
  120    HA   LEU  17           HA       LEU  17  11.463  19.376  -7.346
  121    HB2  LEU  17           2HB      LEU  17   9.728  17.969  -8.682
  122    HB3  LEU  17           3HB      LEU  17   9.519  19.449  -9.616
  123    HG   LEU  17           HG       LEU  17  12.162  19.260  -9.795
  124   HD11  LEU  17          1HD1      LEU  17  12.915  16.988  -9.958
  125   HD12  LEU  17          2HD1      LEU  17  11.302  16.380  -9.591
  126   HD13  LEU  17          3HD1      LEU  17  12.221  17.239  -8.357
  127   HD21  LEU  17          3HD2      LEU  17  11.407  17.514 -11.781
  128   HD22  LEU  17          1HD2      LEU  17  11.346  19.274 -11.873
  129   HD23  LEU  17          2HD2      LEU  17   9.908  18.365 -11.407
  130    H    GLY  18           H        GLY  18   8.697  21.470  -7.818
  131    HA2  GLY  18           2HA      GLY  18  10.200  23.467  -9.268
  132    HA3  GLY  18           3HA      GLY  18   8.543  23.613  -8.700
  133    H    LYS  19           H        LYS  19   9.326  22.854  -5.946
  134    HA   LYS  19           HA       LYS  19  10.004  25.505  -5.046
  135    HB2  LYS  19           2HB      LYS  19   9.206  22.947  -3.702
  136    HB3  LYS  19           3HB      LYS  19   9.889  24.259  -2.751
  137    HG2  LYS  19           2HG      LYS  19   8.096  25.678  -3.197
  138    HG3  LYS  19           3HG      LYS  19   7.563  24.720  -4.580
  139    HD2  LYS  19           2HD      LYS  19   7.186  22.847  -2.837
  140    HD3  LYS  19           3HD      LYS  19   7.248  24.155  -1.653
  141    HE2  LYS  19           2HE      LYS  19   5.472  24.391  -4.045
  142    HE3  LYS  19           3HE      LYS  19   4.963  23.414  -2.669
  143    HZ1  LYS  19           3HZ      LYS  19   5.277  26.306  -2.880
  144    HZ2  LYS  19           1HZ      LYS  19   5.693  25.600  -1.399
  145    HZ3  LYS  19           2HZ      LYS  19   4.133  25.401  -2.022
  146    H    ALA  20           H        ALA  20  11.594  22.407  -5.332
  147    HA   ALA  20           HA       ALA  20  13.813  22.975  -3.660
  148    HB1  ALA  20           1HB      ALA  20  13.647  20.729  -4.019
  149    HB2  ALA  20           2HB      ALA  20  13.165  20.919  -5.705
  150    HB3  ALA  20           3HB      ALA  20  14.854  21.129  -5.242
  151    H    ALA  21           H        ALA  21  13.107  23.585  -7.040
  152    HA   ALA  21           HA       ALA  21  15.764  24.305  -7.783
  153    HB1  ALA  21           1HB      ALA  21  14.565  23.741  -9.639
  154    HB2  ALA  21           2HB      ALA  21  13.079  24.482  -9.043
  155    HB3  ALA  21           3HB      ALA  21  14.371  25.494  -9.689
  156    H    THR  22           H        THR  22  12.917  26.108  -6.718
  157    HA   THR  22           HA       THR  22  14.214  28.664  -7.023
  158    HB   THR  22           HB       THR  22  11.780  28.468  -7.309
  159    HG1  THR  22           HG1      THR  22  11.354  30.356  -6.253
  160   HG21  THR  22          3HG2      THR  22  11.610  28.028  -4.333
  161   HG22  THR  22          1HG2      THR  22  11.519  26.713  -5.504
  162   HG23  THR  22          2HG2      THR  22  10.301  27.988  -5.513
  163    H    ASP  23           H        ASP  23  13.910  26.271  -4.557
  164    HA   ASP  23           HA       ASP  23  14.445  27.998  -2.337
  165    HB2  ASP  23           2HB      ASP  23  13.305  26.001  -1.799
  166    HB3  ASP  23           3HB      ASP  23  14.447  25.009  -2.702
  167    H    VAL  24           H        VAL  24  16.376  25.947  -4.451
  168    HA   VAL  24           HA       VAL  24  18.803  26.244  -2.982
  169    HB   VAL  24           HB       VAL  24  18.369  25.430  -5.859
  170   HG11  VAL  24          1HG1      VAL  24  20.586  25.859  -5.960
  171   HG12  VAL  24          2HG1      VAL  24  20.797  25.757  -4.211
  172   HG13  VAL  24          3HG1      VAL  24  20.699  24.284  -5.176
  173   HG21  VAL  24          3HG2      VAL  24  17.429  24.063  -3.822
  174   HG22  VAL  24          1HG2      VAL  24  18.221  23.246  -5.170
  175   HG23  VAL  24          2HG2      VAL  24  19.107  23.542  -3.674
  176    H    VAL  25           H        VAL  25  17.290  27.964  -5.645
  177    HA   VAL  25           HA       VAL  25  19.552  29.540  -6.339
  178    HB   VAL  25           HB       VAL  25  16.618  30.091  -6.807
  179   HG11  VAL  25          1HG1      VAL  25  17.929  32.123  -6.993
  180   HG12  VAL  25          2HG1      VAL  25  19.070  31.314  -8.069
  181   HG13  VAL  25          3HG1      VAL  25  17.408  31.590  -8.591
  182   HG21  VAL  25          3HG2      VAL  25  16.676  28.691  -8.550
  183   HG22  VAL  25          1HG2      VAL  25  18.256  29.275  -9.074
  184   HG23  VAL  25          2HG2      VAL  25  18.143  28.039  -7.820
  185    H    ALA  26           H        ALA  26  16.865  29.963  -4.104
  186    HA   ALA  26           HA       ALA  26  17.580  32.678  -3.454
  187    HB1  ALA  26           1HB      ALA  26  15.656  32.759  -2.232
  188    HB2  ALA  26           2HB      ALA  26  15.250  31.436  -3.326
  189    HB3  ALA  26           3HB      ALA  26  15.799  31.087  -1.686
  190    H    ALA  27           H        ALA  27  18.158  29.482  -2.140
  191    HA   ALA  27           HA       ALA  27  19.273  30.459   0.331
  192    HB1  ALA  27           1HB      ALA  27  19.737  28.159   0.838
  193    HB2  ALA  27           2HB      ALA  27  18.119  28.268   0.143
  194    HB3  ALA  27           3HB      ALA  27  19.464  27.689  -0.840
  195    H    TRP  28           H        TRP  28  20.409  29.893  -2.852
  196    HA   TRP  28           HA       TRP  28  23.096  29.263  -2.384
  197    HB2  TRP  28           2HB      TRP  28  21.483  29.871  -4.619
  198    HB3  TRP  28           3HB      TRP  28  22.844  30.989  -4.673
  199    HD1  TRP  28           HD1      TRP  28  21.962  27.329  -5.121
  200    HE1  TRP  28           HE1      TRP  28  24.021  26.068  -6.012
  201    HE3  TRP  28           HE3      TRP  28  25.464  31.015  -4.588
  202    HZ2  TRP  28           HZ2      TRP  28  26.767  26.569  -6.432
  203    HZ3  TRP  28           HZ3      TRP  28  27.784  30.543  -5.257
  204    HH2  TRP  28           HH2      TRP  28  28.420  28.365  -6.160
  205    H    LYS  29           H        LYS  29  21.393  32.327  -2.342
  206    HA   LYS  29           HA       LYS  29  23.715  33.974  -2.283
  207    HB2  LYS  29           2HB      LYS  29  22.244  35.782  -1.867
  208    HB3  LYS  29           3HB      LYS  29  21.366  34.686  -2.926
  209    HG2  LYS  29           2HG      LYS  29  20.518  33.749  -0.581
  210    HG3  LYS  29           3HG      LYS  29  20.866  35.412  -0.103
  211    HD2  LYS  29           2HD      LYS  29  19.253  34.805  -2.560
  212    HD3  LYS  29           3HD      LYS  29  18.503  34.851  -0.962
  213    HE2  LYS  29           2HE      LYS  29  20.031  37.156  -1.047
  214    HE3  LYS  29           3HE      LYS  29  19.376  37.028  -2.679
  215    HZ1  LYS  29           3HZ      LYS  29  17.846  37.091  -0.138
  216    HZ2  LYS  29           1HZ      LYS  29  17.154  36.747  -1.643
  217    HZ3  LYS  29           2HZ      LYS  29  17.851  38.261  -1.360
  218    H    SER  30           H        SER  30  21.790  32.352   0.145
  219    HA   SER  30           HA       SER  30  22.968  33.741   2.365
  220    HB2  SER  30           2HB      SER  30  20.670  32.656   2.350
  221    HB3  SER  30           3HB      SER  30  21.498  31.103   2.463
  222    HG   SER  30           HG       SER  30  20.800  32.249   4.491
  Start of MODEL    4
    1    H1   VAL   1           H        VAL   1   1.060   0.626   0.189
    2    HA   VAL   1           HA       VAL   1   3.114  -0.702  -1.393
    3    HB   VAL   1           HB       VAL   1   1.726  -0.474  -3.476
    4   HG11  VAL   1          1HG1      VAL   1   1.711  -2.675  -3.127
    5   HG12  VAL   1          2HG1      VAL   1   1.531  -2.474  -1.383
    6   HG13  VAL   1          3HG1      VAL   1   0.108  -2.454  -2.426
    7   HG21  VAL   1          3HG2      VAL   1  -0.006   0.901  -1.854
    8   HG22  VAL   1          1HG2      VAL   1  -0.386   0.264  -3.455
    9   HG23  VAL   1          2HG2      VAL   1  -0.794  -0.669  -2.015
   10    H    LYS   2           H        LYS   2   3.511   0.673  -3.464
   11    HA   LYS   2           HA       LYS   2   4.024   3.361  -2.562
   12    HB2  LYS   2           2HB      LYS   2   5.400   3.587  -4.457
   13    HB3  LYS   2           3HB      LYS   2   5.587   1.908  -3.971
   14    HG2  LYS   2           2HG      LYS   2   5.298   1.592  -6.191
   15    HG3  LYS   2           3HG      LYS   2   3.601   1.589  -5.705
   16    HD2  LYS   2           2HD      LYS   2   3.246   3.752  -6.490
   17    HD3  LYS   2           3HD      LYS   2   4.968   4.141  -6.480
   18    HE2  LYS   2           2HE      LYS   2   4.838   2.026  -8.223
   19    HE3  LYS   2           3HE      LYS   2   3.334   2.885  -8.551
   20    HZ1  LYS   2           3HZ      LYS   2   4.470   4.798  -9.166
   21    HZ2  LYS   2           1HZ      LYS   2   5.410   3.564  -9.841
   22    HZ3  LYS   2           2HZ      LYS   2   5.909   4.322  -8.414
   23    H    GLY   3           H        GLY   3   1.588   1.776  -4.371
   24    HA2  GLY   3           2HA      GLY   3   0.762   3.890  -6.056
   25    HA3  GLY   3           3HA      GLY   3  -0.235   2.537  -5.543
   26    H    ARG   4           H        ARG   4  -0.025   3.080  -2.721
   27    HA   ARG   4           HA       ARG   4  -2.190   4.886  -2.455
   28    HB2  ARG   4           2HB      ARG   4  -0.409   3.434  -0.531
   29    HB3  ARG   4           3HB      ARG   4  -1.508   4.672   0.061
   30    HG2  ARG   4           2HG      ARG   4  -2.347   2.269  -1.546
   31    HG3  ARG   4           3HG      ARG   4  -2.423   2.385   0.214
   32    HD2  ARG   4           2HD      ARG   4  -3.670   4.671  -1.021
   33    HD3  ARG   4           3HD      ARG   4  -4.373   3.172  -1.629
   34    HE   ARG   4           HE       ARG   4  -4.629   4.257   1.019
   35   HH11  ARG   4          1HH1      ARG   4  -4.722   1.357  -0.905
   36   HH12  ARG   4          2HH1      ARG   4  -5.735   0.497   0.206
   37   HH21  ARG   4          1HH2      ARG   4  -5.963   3.135   2.490
   38   HH22  ARG   4          2HH2      ARG   4  -6.441   1.509   2.136
   39    H    ILE   5           H        ILE   5   1.280   5.168  -1.860
   40    HA   ILE   5           HA       ILE   5   1.016   7.892  -0.907
   41    HB   ILE   5           HB       ILE   5   2.725   6.373   0.047
   42   HG12  ILE   5          2HG1      ILE   5   4.484   8.379  -1.139
   43   HG13  ILE   5          3HG1      ILE   5   2.955   9.059  -0.594
   44   HG21  ILE   5          1HG2      ILE   5   4.160   6.674  -2.583
   45   HG22  ILE   5          2HG2      ILE   5   4.658   5.718  -1.188
   46   HG23  ILE   5          3HG2      ILE   5   3.242   5.241  -2.123
   47   HD11  ILE   5          3HD1      ILE   5   4.270   7.239   1.299
   48   HD12  ILE   5          1HD1      ILE   5   5.121   8.748   0.970
   49   HD13  ILE   5          2HD1      ILE   5   3.463   8.783   1.573
   50    H    ASP   6           H        ASP   6   1.495   6.276  -3.887
   51    HA   ASP   6           HA       ASP   6   2.928   8.299  -5.270
   52    HB2  ASP   6           2HB      ASP   6   2.973   6.146  -6.243
   53    HB3  ASP   6           3HB      ASP   6   1.220   5.988  -6.172
   54    H    ALA   7           H        ALA   7  -0.488   7.673  -4.723
   55    HA   ALA   7           HA       ALA   7  -1.574   9.453  -6.585
   56    HB1  ALA   7           1HB      ALA   7  -3.441   8.581  -5.770
   57    HB2  ALA   7           2HB      ALA   7  -2.528   7.844  -4.454
   58    HB3  ALA   7           3HB      ALA   7  -3.203   9.462  -4.261
   59    HA   PRO   8           HA       PRO   8  -1.555  12.798  -3.090
   60    HB2  PRO   8           2HB      PRO   8  -0.047  12.280  -0.892
   61    HB3  PRO   8           3HB      PRO   8  -1.748  11.817  -1.021
   62    HG2  PRO   8           2HG      PRO   8   0.704  10.152  -1.436
   63    HG3  PRO   8           3HG      PRO   8  -0.796   9.742  -0.584
   64    HD2  PRO   8           2HD      PRO   8  -0.277   8.904  -3.106
   65    HD3  PRO   8           3HD      PRO   8  -1.921   9.258  -2.536
   66    H    ASP   9           H        ASP   9   1.360  10.915  -3.647
   67    HA   ASP   9           HA       ASP   9   3.121  13.181  -3.383
   68    HB2  ASP   9           2HB      ASP   9   3.900  10.924  -2.812
   69    HB3  ASP   9           3HB      ASP   9   3.640  10.408  -4.476
   70    H    PHE  10           H        PHE  10   1.162  11.865  -5.836
   71    HA   PHE  10           HA       PHE  10   2.605  12.445  -8.150
   72    HB2  PHE  10           2HB      PHE  10   0.039  11.532  -7.551
   73    HB3  PHE  10           3HB      PHE  10  -0.227  13.023  -8.450
   74    HD1  PHE  10           HD1      PHE  10   2.042  10.062  -8.654
   75    HD2  PHE  10           HD2      PHE  10  -0.525  12.771 -10.702
   76    HE1  PHE  10           HE1      PHE  10   2.458   8.860 -10.760
   77    HE2  PHE  10           HE2      PHE  10  -0.113  11.572 -12.810
   78    HZ   PHE  10           HZ       PHE  10   1.380   9.613 -12.841
   79    HA   PRO  11           HA       PRO  11   0.532  16.821  -8.094
   80    HB2  PRO  11           2HB      PRO  11  -0.602  17.607  -5.756
   81    HB3  PRO  11           3HB      PRO  11  -1.496  16.749  -7.017
   82    HG2  PRO  11           2HG      PRO  11  -0.271  15.681  -4.503
   83    HG3  PRO  11           3HG      PRO  11  -1.851  15.315  -5.222
   84    HD2  PRO  11           2HD      PRO  11   0.285  13.671  -5.484
   85    HD3  PRO  11           3HD      PRO  11  -0.956  13.833  -6.743
   86    H    SER  12           H        SER  12   2.097  15.588  -5.208
   87    HA   SER  12           HA       SER  12   3.325  18.117  -4.552
   88    HB2  SER  12           2HB      SER  12   4.036  15.396  -3.446
   89    HB3  SER  12           3HB      SER  12   4.335  16.969  -2.708
   90    HG   SER  12           HG       SER  12   2.007  15.464  -2.815
   91    H    SER  13           H        SER  13   4.005  15.488  -6.612
   92    HA   SER  13           HA       SER  13   6.792  15.411  -6.607
   93    HB2  SER  13           2HB      SER  13   4.777  14.183  -8.055
   94    HB3  SER  13           3HB      SER  13   5.637  15.120  -9.277
   95    HG   SER  13           HG       SER  13   6.362  12.825  -8.164
   96    HA   PRO  14           HA       PRO  14   6.651  18.811 -10.060
   97    HB2  PRO  14           2HB      PRO  14   4.339  20.217 -10.281
   98    HB3  PRO  14           3HB      PRO  14   4.655  18.738 -11.197
   99    HG2  PRO  14           2HG      PRO  14   3.063  19.109  -8.689
  100    HG3  PRO  14           3HG      PRO  14   2.684  18.135 -10.121
  101    HD2  PRO  14           2HD      PRO  14   3.682  17.055  -7.847
  102    HD3  PRO  14           3HD      PRO  14   4.046  16.399  -9.456
  103    H    ALA  15           H        ALA  15   5.002  19.217  -7.010
  104    HA   ALA  15           HA       ALA  15   5.633  22.018  -6.763
  105    HB1  ALA  15           1HB      ALA  15   4.524  21.952  -4.696
  106    HB2  ALA  15           2HB      ALA  15   3.635  20.827  -5.724
  107    HB3  ALA  15           3HB      ALA  15   4.771  20.214  -4.522
  108    H    ILE  16           H        ILE  16   6.892  18.972  -5.484
  109    HA   ILE  16           HA       ILE  16   8.825  20.194  -3.779
  110    HB   ILE  16           HB       ILE  16   8.524  17.384  -4.818
  111   HG12  ILE  16          2HG1      ILE  16   8.450  18.147  -1.938
  112   HG13  ILE  16          3HG1      ILE  16   7.073  18.593  -2.940
  113   HG21  ILE  16          1HG2      ILE  16  10.656  18.515  -3.019
  114   HG22  ILE  16          2HG2      ILE  16  10.293  16.794  -3.141
  115   HG23  ILE  16          3HG2      ILE  16  10.872  17.675  -4.554
  116   HD11  ILE  16          3HD1      ILE  16   8.155  15.815  -2.536
  117   HD12  ILE  16          1HD1      ILE  16   6.681  16.481  -1.834
  118   HD13  ILE  16          2HD1      ILE  16   6.799  16.245  -3.578
  119    H    LEU  17           H        LEU  17   8.897  18.850  -7.046
  120    HA   LEU  17           HA       LEU  17  11.709  19.140  -7.390
  121    HB2  LEU  17           2HB      LEU  17  10.282  17.578  -8.686
  122    HB3  LEU  17           3HB      LEU  17   9.560  18.967  -9.497
  123    HG   LEU  17           HG       LEU  17  12.458  18.944  -9.718
  124   HD11  LEU  17          1HD1      LEU  17  12.565  17.051 -11.287
  125   HD12  LEU  17          2HD1      LEU  17  10.919  16.606 -10.836
  126   HD13  LEU  17          3HD1      LEU  17  12.209  16.541  -9.636
  127   HD21  LEU  17          3HD2      LEU  17  12.019  19.641 -11.870
  128   HD22  LEU  17          1HD2      LEU  17  10.576  20.195 -11.019
  129   HD23  LEU  17          2HD2      LEU  17  10.520  18.716 -11.979
  130    H    GLY  18           H        GLY  18   8.934  21.203  -7.938
  131    HA2  GLY  18           2HA      GLY  18  10.430  23.159  -9.450
  132    HA3  GLY  18           3HA      GLY  18   8.771  23.314  -8.891
  133    H    LYS  19           H        LYS  19   9.550  22.651  -6.112
  134    HA   LYS  19           HA       LYS  19  10.213  25.335  -5.298
  135    HB2  LYS  19           2HB      LYS  19   9.408  22.820  -3.882
  136    HB3  LYS  19           3HB      LYS  19  10.105  24.148  -2.963
  137    HG2  LYS  19           2HG      LYS  19   8.317  25.552  -3.383
  138    HG3  LYS  19           3HG      LYS  19   7.805  24.641  -4.806
  139    HD2  LYS  19           2HD      LYS  19   6.533  23.254  -3.590
  140    HD3  LYS  19           3HD      LYS  19   7.775  23.064  -2.349
  141    HE2  LYS  19           2HE      LYS  19   6.206  25.605  -2.546
  142    HE3  LYS  19           3HE      LYS  19   5.515  24.195  -1.745
  143    HZ1  LYS  19           3HZ      LYS  19   7.068  26.023  -0.541
  144    HZ2  LYS  19           1HZ      LYS  19   8.210  24.836  -0.930
  145    HZ3  LYS  19           2HZ      LYS  19   6.861  24.437   0.009
  146    H    ALA  20           H        ALA  20  11.819  22.237  -5.478
  147    HA   ALA  20           HA       ALA  20  14.030  22.871  -3.821
  148    HB1  ALA  20           1HB      ALA  20  13.731  20.833  -6.022
  149    HB2  ALA  20           2HB      ALA  20  15.116  20.933  -4.933
  150    HB3  ALA  20           3HB      ALA  20  13.514  20.574  -4.291
  151    H    ALA  21           H        ALA  21  13.331  23.366  -7.220
  152    HA   ALA  21           HA       ALA  21  15.986  24.076  -7.980
  153    HB1  ALA  21           1HB      ALA  21  14.436  25.258  -9.864
  154    HB2  ALA  21           2HB      ALA  21  14.917  23.561  -9.886
  155    HB3  ALA  21           3HB      ALA  21  13.339  24.022  -9.247
  156    H    THR  22           H        THR  22  13.127  25.897  -6.982
  157    HA   THR  22           HA       THR  22  14.412  28.449  -7.365
  158    HB   THR  22           HB       THR  22  11.980  28.231  -7.652
  159    HG1  THR  22           HG1      THR  22  11.742  30.216  -6.918
  160   HG21  THR  22          3HG2      THR  22  10.498  27.802  -5.846
  161   HG22  THR  22          1HG2      THR  22  11.803  27.888  -4.663
  162   HG23  THR  22          2HG2      THR  22  11.723  26.535  -5.791
  163    H    ASP  23           H        ASP  23  14.113  26.136  -4.824
  164    HA   ASP  23           HA       ASP  23  14.628  27.935  -2.658
  165    HB2  ASP  23           2HB      ASP  23  13.522  25.967  -2.019
  166    HB3  ASP  23           3HB      ASP  23  14.613  24.943  -2.949
  167    H    VAL  24           H        VAL  24  16.586  25.826  -4.693
  168    HA   VAL  24           HA       VAL  24  19.005  26.199  -3.230
  169    HB   VAL  24           HB       VAL  24  18.599  25.294  -6.084
  170   HG11  VAL  24          1HG1      VAL  24  20.822  25.822  -6.104
  171   HG12  VAL  24          2HG1      VAL  24  21.012  25.569  -4.368
  172   HG13  VAL  24          3HG1      VAL  24  20.910  24.184  -5.456
  173   HG21  VAL  24          3HG2      VAL  24  19.411  23.335  -4.073
  174   HG22  VAL  24          1HG2      VAL  24  17.811  24.023  -3.792
  175   HG23  VAL  24          2HG2      VAL  24  18.174  23.229  -5.325
  176    H    VAL  25           H        VAL  25  17.485  27.816  -5.953
  177    HA   VAL  25           HA       VAL  25  19.734  29.390  -6.692
  178    HB   VAL  25           HB       VAL  25  16.796  29.898  -7.185
  179   HG11  VAL  25          1HG1      VAL  25  19.167  31.456  -7.771
  180   HG12  VAL  25          2HG1      VAL  25  18.274  31.036  -9.234
  181   HG13  VAL  25          3HG1      VAL  25  17.465  31.892  -7.921
  182   HG21  VAL  25          3HG2      VAL  25  18.436  29.028  -9.427
  183   HG22  VAL  25          1HG2      VAL  25  18.355  27.835  -8.131
  184   HG23  VAL  25          2HG2      VAL  25  16.871  28.433  -8.871
  185    H    ALA  26           H        ALA  26  17.038  29.860  -4.478
  186    HA   ALA  26           HA       ALA  26  17.725  32.601  -3.915
  187    HB1  ALA  26           1HB      ALA  26  15.551  32.526  -3.420
  188    HB2  ALA  26           2HB      ALA  26  15.564  30.771  -3.241
  189    HB3  ALA  26           3HB      ALA  26  16.046  31.799  -1.892
  190    H    ALA  27           H        ALA  27  18.328  29.456  -2.494
  191    HA   ALA  27           HA       ALA  27  19.212  30.255   0.039
  192    HB1  ALA  27           1HB      ALA  27  20.693  28.065  -0.331
  193    HB2  ALA  27           2HB      ALA  27  18.961  28.003   0.002
  194    HB3  ALA  27           3HB      ALA  27  19.546  27.853  -1.655
  195    H    TRP  28           H        TRP  28  20.656  30.618  -3.048
  196    HA   TRP  28           HA       TRP  28  23.378  30.625  -2.396
  197    HB2  TRP  28           2HB      TRP  28  21.751  31.347  -4.646
  198    HB3  TRP  28           3HB      TRP  28  22.951  32.608  -4.374
  199    HD1  TRP  28           HD1      TRP  28  22.747  28.813  -5.056
  200    HE1  TRP  28           HE1      TRP  28  24.952  28.077  -6.160
  201    HE3  TRP  28           HE3      TRP  28  25.324  33.216  -4.733
  202    HZ2  TRP  28           HZ2      TRP  28  27.454  29.213  -6.808
  203    HZ3  TRP  28           HZ3      TRP  28  27.618  33.308  -5.618
  204    HH2  TRP  28           HH2      TRP  28  28.659  31.346  -6.633
  205    H    LYS  29           H        LYS  29  20.880  32.944  -1.788
  206    HA   LYS  29           HA       LYS  29  22.595  35.184  -1.334
  207    HB2  LYS  29           2HB      LYS  29  20.657  36.332  -0.603
  208    HB3  LYS  29           3HB      LYS  29  20.123  35.271  -1.899
  209    HG2  LYS  29           2HG      LYS  29  19.642  33.641   0.130
  210    HG3  LYS  29           3HG      LYS  29  19.534  35.171   1.004
  211    HD2  LYS  29           2HD      LYS  29  18.073  34.815  -1.582
  212    HD3  LYS  29           3HD      LYS  29  17.402  34.152  -0.090
  213    HE2  LYS  29           2HE      LYS  29  16.588  36.159   0.401
  214    HE3  LYS  29           3HE      LYS  29  18.235  36.783   0.487
  215    HZ1  LYS  29           3HZ      LYS  29  17.057  36.509  -2.168
  216    HZ2  LYS  29           1HZ      LYS  29  18.094  37.700  -1.561
  217    HZ3  LYS  29           2HZ      LYS  29  16.446  37.743  -1.185
  218    H    SER  30           H        SER  30  21.314  32.589   0.634
  219    HA   SER  30           HA       SER  30  21.969  33.735   3.154
  220    HB2  SER  30           2HB      SER  30  20.835  31.254   2.172
  221    HB3  SER  30           3HB      SER  30  21.988  30.953   3.472
  222    HG   SER  30           HG       SER  30  19.796  32.757   3.570
  Start of MODEL    5
    1    H1   VAL   1           H        VAL   1   0.679   0.502  -0.480
    2    HA   VAL   1           HA       VAL   1   3.022  -0.619  -1.874
    3    HB   VAL   1           HB       VAL   1   1.772  -0.497  -3.990
    4   HG11  VAL   1          1HG1      VAL   1   0.110  -2.134  -2.114
    5   HG12  VAL   1          2HG1      VAL   1   0.671  -2.525  -3.741
    6   HG13  VAL   1          3HG1      VAL   1   1.806  -2.530  -2.390
    7   HG21  VAL   1          3HG2      VAL   1  -0.001   0.860  -4.043
    8   HG22  VAL   1          1HG2      VAL   1  -0.888  -0.447  -3.258
    9   HG23  VAL   1          2HG2      VAL   1  -0.170   0.839  -2.287
   10    H    LYS   2           H        LYS   2   3.412   0.790  -3.963
   11    HA   LYS   2           HA       LYS   2   3.958   3.451  -3.004
   12    HB2  LYS   2           2HB      LYS   2   5.313   3.711  -4.913
   13    HB3  LYS   2           3HB      LYS   2   5.499   2.023  -4.455
   14    HG2  LYS   2           2HG      LYS   2   5.183   1.737  -6.674
   15    HG3  LYS   2           3HG      LYS   2   3.490   1.745  -6.174
   16    HD2  LYS   2           2HD      LYS   2   3.364   3.283  -7.847
   17    HD3  LYS   2           3HD      LYS   2   3.810   4.364  -6.524
   18    HE2  LYS   2           2HE      LYS   2   6.122   4.301  -7.187
   19    HE3  LYS   2           3HE      LYS   2   5.780   3.077  -8.409
   20    HZ1  LYS   2           3HZ      LYS   2   5.922   5.663  -8.953
   21    HZ2  LYS   2           1HZ      LYS   2   4.269   5.555  -8.605
   22    HZ3  LYS   2           2HZ      LYS   2   4.941   4.597  -9.826
   23    H    GLY   3           H        GLY   3   1.493   1.933  -4.833
   24    HA2  GLY   3           2HA      GLY   3   0.675   4.112  -6.445
   25    HA3  GLY   3           3HA      GLY   3  -0.322   2.739  -5.987
   26    H    ARG   4           H        ARG   4  -0.120   3.162  -3.147
   27    HA   ARG   4           HA       ARG   4  -2.282   4.958  -2.808
   28    HB2  ARG   4           2HB      ARG   4  -0.538   3.359  -0.988
   29    HB3  ARG   4           3HB      ARG   4  -1.520   4.641  -0.292
   30    HG2  ARG   4           2HG      ARG   4  -3.405   3.464  -0.491
   31    HG3  ARG   4           3HG      ARG   4  -2.994   2.903  -2.113
   32    HD2  ARG   4           2HD      ARG   4  -2.078   0.985  -1.358
   33    HD3  ARG   4           3HD      ARG   4  -1.380   1.759   0.064
   34    HE   ARG   4           HE       ARG   4  -4.093   1.700   0.510
   35   HH11  ARG   4          1HH1      ARG   4  -1.586  -0.638  -0.100
   36   HH12  ARG   4          2HH1      ARG   4  -2.358  -1.896   0.808
   37   HH21  ARG   4          1HH2      ARG   4  -5.119   0.052   1.708
   38   HH22  ARG   4          2HH2      ARG   4  -4.368  -1.502   1.835
   39    H    ILE   5           H        ILE   5   1.187   5.212  -2.200
   40    HA   ILE   5           HA       ILE   5   0.927   7.892  -1.130
   41    HB   ILE   5           HB       ILE   5   2.636   6.323  -0.250
   42   HG12  ILE   5          2HG1      ILE   5   4.223   8.530  -1.456
   43   HG13  ILE   5          3HG1      ILE   5   2.810   8.984  -0.511
   44   HG21  ILE   5          1HG2      ILE   5   4.556   5.714  -1.509
   45   HG22  ILE   5          2HG2      ILE   5   3.150   5.325  -2.498
   46   HG23  ILE   5          3HG2      ILE   5   4.097   6.772  -2.843
   47   HD11  ILE   5          3HD1      ILE   5   3.742   8.341   1.441
   48   HD12  ILE   5          1HD1      ILE   5   4.652   7.022   0.704
   49   HD13  ILE   5          2HD1      ILE   5   5.226   8.683   0.551
   50    H    ASP   6           H        ASP   6   1.401   6.407  -4.178
   51    HA   ASP   6           HA       ASP   6   2.834   8.487  -5.473
   52    HB2  ASP   6           2HB      ASP   6   2.878   6.381  -6.542
   53    HB3  ASP   6           3HB      ASP   6   1.125   6.217  -6.471
   54    H    ALA   7           H        ALA   7  -0.582   7.840  -4.954
   55    HA   ALA   7           HA       ALA   7  -1.668   9.701  -6.734
   56    HB1  ALA   7           1HB      ALA   7  -2.641   7.949  -4.785
   57    HB2  ALA   7           2HB      ALA   7  -3.230   9.547  -4.325
   58    HB3  ALA   7           3HB      ALA   7  -3.579   8.907  -5.931
   59    HA   PRO   8           HA       PRO   8  -1.643  12.889  -3.095
   60    HB2  PRO   8           2HB      PRO   8  -0.134  12.274  -0.924
   61    HB3  PRO   8           3HB      PRO   8  -1.836  11.819  -1.071
   62    HG2  PRO   8           2HG      PRO   8   0.615  10.171  -1.561
   63    HG3  PRO   8           3HG      PRO   8  -0.884   9.725  -0.726
   64    HD2  PRO   8           2HD      PRO   8  -0.369   8.998  -3.283
   65    HD3  PRO   8           3HD      PRO   8  -2.012   9.329  -2.697
   66    H    ASP   9           H        ASP   9   1.269  11.030  -3.737
   67    HA   ASP   9           HA       ASP   9   3.033  13.281  -3.374
   68    HB2  ASP   9           2HB      ASP   9   3.711  10.903  -2.951
   69    HB3  ASP   9           3HB      ASP   9   3.634  10.626  -4.689
   70    H    PHE  10           H        PHE  10   1.070  12.076  -5.882
   71    HA   PHE  10           HA       PHE  10   2.511  12.757  -8.170
   72    HB2  PHE  10           2HB      PHE  10  -0.077  11.851  -7.592
   73    HB3  PHE  10           3HB      PHE  10  -0.303  13.355  -8.479
   74    HD1  PHE  10           HD2      PHE  10   1.405  13.545 -10.572
   75    HD2  PHE  10           HD1      PHE  10  -0.062   9.942  -8.845
   76    HE1  PHE  10           HE2      PHE  10   1.830  12.362 -12.687
   77    HE2  PHE  10           HE1      PHE  10   0.362   8.753 -10.957
   78    HZ   PHE  10           HZ       PHE  10   1.308   9.964 -12.882
   79    HA   PRO  11           HA       PRO  11   0.442  17.128  -7.918
   80    HB2  PRO  11           2HB      PRO  11  -0.689  17.810  -5.546
   81    HB3  PRO  11           3HB      PRO  11  -1.585  17.010  -6.843
   82    HG2  PRO  11           2HG      PRO  11  -0.358  15.830  -4.380
   83    HG3  PRO  11           3HG      PRO  11  -1.939  15.497  -5.112
   84    HD2  PRO  11           2HD      PRO  11   0.195  13.865  -5.450
   85    HD3  PRO  11           3HD      PRO  11  -1.047  14.083  -6.699
   86    H    SER  12           H        SER  12   2.018  15.763  -5.100
   87    HA   SER  12           HA       SER  12   3.245  18.260  -4.328
   88    HB2  SER  12           2HB      SER  12   2.707  15.866  -3.022
   89    HB3  SER  12           3HB      SER  12   4.461  15.865  -3.198
   90    HG   SER  12           HG       SER  12   3.335  17.002  -1.306
   91    H    SER  13           H        SER  13   3.924  15.720  -6.502
   92    HA   SER  13           HA       SER  13   6.711  15.655  -6.509
   93    HB2  SER  13           2HB      SER  13   6.275  14.125  -8.085
   94    HB3  SER  13           3HB      SER  13   4.596  14.661  -8.149
   95    HG   SER  13           HG       SER  13   5.155  15.205 -10.113
   96    HA   PRO  14           HA       PRO  14   6.539  19.195  -9.818
   97    HB2  PRO  14           2HB      PRO  14   4.224  20.606  -9.958
   98    HB3  PRO  14           3HB      PRO  14   4.533  19.168 -10.938
   99    HG2  PRO  14           2HG      PRO  14   2.964  19.430  -8.403
  100    HG3  PRO  14           3HG      PRO  14   2.572  18.517  -9.872
  101    HD2  PRO  14           2HD      PRO  14   3.591  17.343  -7.655
  102    HD3  PRO  14           3HD      PRO  14   3.942  16.756  -9.294
  103    H    ALA  15           H        ALA  15   4.912  19.471  -6.740
  104    HA   ALA  15           HA       ALA  15   5.547  22.258  -6.380
  105    HB1  ALA  15           1HB      ALA  15   4.854  20.640  -4.017
  106    HB2  ALA  15           2HB      ALA  15   4.199  22.180  -4.573
  107    HB3  ALA  15           3HB      ALA  15   3.653  20.673  -5.308
  108    H    ILE  16           H        ILE  16   6.812  19.160  -5.239
  109    HA   ILE  16           HA       ILE  16   8.756  20.307  -3.495
  110    HB   ILE  16           HB       ILE  16   8.449  17.545  -4.657
  111   HG12  ILE  16          2HG1      ILE  16   8.388  18.201  -1.746
  112   HG13  ILE  16          3HG1      ILE  16   6.999  18.653  -2.728
  113   HG21  ILE  16          1HG2      ILE  16  10.593  18.596  -2.823
  114   HG22  ILE  16          2HG2      ILE  16  10.229  16.882  -3.019
  115   HG23  ILE  16          3HG2      ILE  16  10.798  17.825  -4.396
  116   HD11  ILE  16          3HD1      ILE  16   6.462  16.559  -1.868
  117   HD12  ILE  16          1HD1      ILE  16   6.995  16.227  -3.515
  118   HD13  ILE  16          2HD1      ILE  16   8.080  15.922  -2.159
  119    H    LEU  17           H        LEU  17   8.808  19.109  -6.819
  120    HA   LEU  17           HA       LEU  17  11.618  19.417  -7.167
  121    HB2  LEU  17           2HB      LEU  17   9.299  18.730  -8.832
  122    HB3  LEU  17           3HB      LEU  17  10.612  19.534  -9.691
  123    HG   LEU  17           HG       LEU  17  11.903  17.565  -8.247
  124   HD11  LEU  17          1HD1      LEU  17   9.248  16.544  -9.232
  125   HD12  LEU  17          2HD1      LEU  17   9.905  16.449  -7.598
  126   HD13  LEU  17          3HD1      LEU  17  10.635  15.506  -8.898
  127   HD21  LEU  17          3HD2      LEU  17  11.989  16.421 -10.507
  128   HD22  LEU  17          1HD2      LEU  17  12.537  18.096 -10.455
  129   HD23  LEU  17          2HD2      LEU  17  10.937  17.711 -11.091
  130    H    GLY  18           H        GLY  18   8.838  21.499  -7.607
  131    HA2  GLY  18           2HA      GLY  18  10.323  23.521  -9.040
  132    HA3  GLY  18           3HA      GLY  18   8.668  23.650  -8.464
  133    H    LYS  19           H        LYS  19   9.468  22.864  -5.722
  134    HA   LYS  19           HA       LYS  19  10.130  25.510  -4.794
  135    HB2  LYS  19           2HB      LYS  19   9.344  22.932  -3.488
  136    HB3  LYS  19           3HB      LYS  19  10.048  24.216  -2.514
  137    HG2  LYS  19           2HG      LYS  19   8.258  25.646  -2.873
  138    HG3  LYS  19           3HG      LYS  19   7.720  24.769  -4.308
  139    HD2  LYS  19           2HD      LYS  19   6.614  23.192  -3.096
  140    HD3  LYS  19           3HD      LYS  19   7.747  23.280  -1.745
  141    HE2  LYS  19           2HE      LYS  19   6.188  25.723  -2.184
  142    HE3  LYS  19           3HE      LYS  19   5.222  24.314  -1.751
  143    HZ1  LYS  19           3HZ      LYS  19   5.808  24.663   0.341
  144    HZ2  LYS  19           1HZ      LYS  19   6.858  25.915  -0.097
  145    HZ3  LYS  19           2HZ      LYS  19   7.415  24.318  -0.061
  146    H    ALA  20           H        ALA  20  11.741  22.424  -5.112
  147    HA   ALA  20           HA       ALA  20  13.962  22.980  -3.448
  148    HB1  ALA  20           1HB      ALA  20  13.374  20.710  -4.114
  149    HB2  ALA  20           2HB      ALA  20  13.761  21.093  -5.792
  150    HB3  ALA  20           3HB      ALA  20  15.034  21.093  -4.572
  151    H    ALA  21           H        ALA  21  13.290  23.575  -6.851
  152    HA   ALA  21           HA       ALA  21  15.928  24.385  -7.545
  153    HB1  ALA  21           1HB      ALA  21  14.507  23.654  -9.298
  154    HB2  ALA  21           2HB      ALA  21  13.262  24.828  -8.868
  155    HB3  ALA  21           3HB      ALA  21  14.790  25.376  -9.557
  156    H    THR  22           H        THR  22  13.036  26.096  -6.465
  157    HA   THR  22           HA       THR  22  14.242  28.695  -6.766
  158    HB   THR  22           HB       THR  22  11.708  27.933  -5.302
  159    HG1  THR  22           HG1      THR  22  12.110  28.864  -7.969
  160   HG21  THR  22          3HG2      THR  22  13.083  30.485  -5.829
  161   HG22  THR  22          1HG2      THR  22  11.937  30.056  -4.560
  162   HG23  THR  22          2HG2      THR  22  11.353  30.473  -6.171
  163    H    ASP  23           H        ASP  23  14.034  26.283  -4.303
  164    HA   ASP  23           HA       ASP  23  14.570  28.024  -2.091
  165    HB2  ASP  23           2HB      ASP  23  13.444  25.966  -1.620
  166    HB3  ASP  23           3HB      ASP  23  14.703  25.024  -2.414
  167    H    VAL  24           H        VAL  24  16.501  25.979  -4.216
  168    HA   VAL  24           HA       VAL  24  18.943  26.305  -2.788
  169    HB   VAL  24           HB       VAL  24  18.489  25.527  -5.672
  170   HG11  VAL  24          1HG1      VAL  24  20.707  26.021  -5.741
  171   HG12  VAL  24          2HG1      VAL  24  20.928  25.783  -4.007
  172   HG13  VAL  24          3HG1      VAL  24  20.820  24.389  -5.083
  173   HG21  VAL  24          3HG2      VAL  24  19.342  23.483  -3.766
  174   HG22  VAL  24          1HG2      VAL  24  17.746  24.152  -3.425
  175   HG23  VAL  24          2HG2      VAL  24  18.081  23.429  -4.998
  176    H    VAL  25           H        VAL  25  17.378  28.033  -5.418
  177    HA   VAL  25           HA       VAL  25  19.617  29.652  -6.102
  178    HB   VAL  25           HB       VAL  25  16.674  30.148  -6.579
  179   HG11  VAL  25          1HG1      VAL  25  19.125  31.448  -7.759
  180   HG12  VAL  25          2HG1      VAL  25  17.488  31.644  -8.390
  181   HG13  VAL  25          3HG1      VAL  25  17.884  32.215  -6.768
  182   HG21  VAL  25          3HG2      VAL  25  16.768  28.755  -8.325
  183   HG22  VAL  25          1HG2      VAL  25  18.332  29.381  -8.847
  184   HG23  VAL  25          2HG2      VAL  25  18.251  28.136  -7.601
  185    H    ALA  26           H        ALA  26  16.878  30.040  -3.913
  186    HA   ALA  26           HA       ALA  26  17.578  32.749  -3.224
  187    HB1  ALA  26           1HB      ALA  26  15.771  31.232  -1.451
  188    HB2  ALA  26           2HB      ALA  26  15.589  32.838  -2.158
  189    HB3  ALA  26           3HB      ALA  26  15.254  31.405  -3.128
  190    H    ALA  27           H        ALA  27  18.268  29.559  -2.032
  191    HA   ALA  27           HA       ALA  27  19.211  30.449   0.542
  192    HB1  ALA  27           1HB      ALA  27  19.435  27.788  -0.856
  193    HB2  ALA  27           2HB      ALA  27  19.968  28.102   0.796
  194    HB3  ALA  27           3HB      ALA  27  18.260  28.246   0.378
  195    H    TRP  28           H        TRP  28  20.606  29.658  -2.582
  196    HA   TRP  28           HA       TRP  28  23.315  29.630  -1.722
  197    HB2  TRP  28           2HB      TRP  28  22.617  28.545  -3.802
  198    HB3  TRP  28           3HB      TRP  28  22.149  30.105  -4.473
  199    HD1  TRP  28           HD1      TRP  28  24.065  31.660  -5.420
  200    HE1  TRP  28           HE1      TRP  28  26.552  31.254  -5.945
  201    HE3  TRP  28           HE3      TRP  28  24.700  27.225  -2.958
  202    HZ2  TRP  28           HZ2      TRP  28  28.522  29.311  -5.388
  203    HZ3  TRP  28           HZ3      TRP  28  26.917  26.158  -3.003
  204    HH2  TRP  28           HH2      TRP  28  28.787  27.181  -4.194
  205    H    LYS  29           H        LYS  29  21.193  32.118  -3.055
  206    HA   LYS  29           HA       LYS  29  23.247  34.108  -3.208
  207    HB2  LYS  29           2HB      LYS  29  21.331  35.670  -3.586
  208    HB3  LYS  29           3HB      LYS  29  21.372  34.303  -4.692
  209    HG2  LYS  29           2HG      LYS  29  19.239  33.981  -4.174
  210    HG3  LYS  29           3HG      LYS  29  19.805  33.404  -2.604
  211    HD2  LYS  29           2HD      LYS  29  18.388  35.027  -1.876
  212    HD3  LYS  29           3HD      LYS  29  19.827  36.024  -2.106
  213    HE2  LYS  29           2HE      LYS  29  18.292  37.282  -3.238
  214    HE3  LYS  29           3HE      LYS  29  18.859  36.248  -4.548
  215    HZ1  LYS  29           3HZ      LYS  29  16.260  36.540  -3.640
  216    HZ2  LYS  29           1HZ      LYS  29  16.740  34.986  -3.173
  217    HZ3  LYS  29           2HZ      LYS  29  16.826  35.445  -4.799
  218    H    SER  30           H        SER  30  21.000  33.032  -0.786
  219    HA   SER  30           HA       SER  30  21.020  35.319   0.867
  220    HB2  SER  30           2HB      SER  30  19.340  33.940   1.558
  221    HB3  SER  30           3HB      SER  30  20.234  32.475   1.156
  222    HG   SER  30           HG       SER  30  20.899  32.373   3.141
  Start of MODEL    6
    1    H1   VAL   1           H        VAL   1   1.010  -0.707   0.765
    2    HA   VAL   1           HA       VAL   1   2.912  -0.475  -0.697
    3    HB   VAL   1           HB       VAL   1   1.888  -0.539  -2.962
    4   HG11  VAL   1          1HG1      VAL   1   0.397  -2.520  -2.481
    5   HG12  VAL   1          2HG1      VAL   1   2.026  -2.601  -1.807
    6   HG13  VAL   1          3HG1      VAL   1   0.660  -2.192  -0.769
    7   HG21  VAL   1          3HG2      VAL   1  -0.294  -0.020  -3.396
    8   HG22  VAL   1          1HG2      VAL   1  -0.826  -0.402  -1.759
    9   HG23  VAL   1          2HG2      VAL   1   0.017   1.113  -2.081
   10    H    LYS   2           H        LYS   2   3.354   0.752  -2.963
   11    HA   LYS   2           HA       LYS   2   3.856   3.480  -2.185
   12    HB2  LYS   2           2HB      LYS   2   5.265   3.612  -4.068
   13    HB3  LYS   2           3HB      LYS   2   5.447   1.963  -3.483
   14    HG2  LYS   2           2HG      LYS   2   5.198   1.514  -5.684
   15    HG3  LYS   2           3HG      LYS   2   3.491   1.544  -5.235
   16    HD2  LYS   2           2HD      LYS   2   3.404   2.957  -7.017
   17    HD3  LYS   2           3HD      LYS   2   3.807   4.134  -5.765
   18    HE2  LYS   2           2HE      LYS   2   6.126   4.068  -6.363
   19    HE3  LYS   2           3HE      LYS   2   5.852   2.724  -7.470
   20    HZ1  LYS   2           3HZ      LYS   2   4.635   5.409  -7.801
   21    HZ2  LYS   2           1HZ      LYS   2   4.606   4.131  -8.909
   22    HZ3  LYS   2           2HZ      LYS   2   6.062   4.920  -8.567
   23    H    GLY   3           H        GLY   3   1.455   1.813  -3.969
   24    HA2  GLY   3           2HA      GLY   3   0.671   3.862  -5.758
   25    HA3  GLY   3           3HA      GLY   3  -0.330   2.518  -5.231
   26    H    ARG   4           H        ARG   4  -0.214   3.148  -2.424
   27    HA   ARG   4           HA       ARG   4  -2.396   4.946  -2.280
   28    HB2  ARG   4           2HB      ARG   4  -0.619   3.989  -0.030
   29    HB3  ARG   4           3HB      ARG   4  -2.232   4.670   0.130
   30    HG2  ARG   4           2HG      ARG   4  -1.510   2.057  -1.177
   31    HG3  ARG   4           3HG      ARG   4  -2.321   2.276   0.374
   32    HD2  ARG   4           2HD      ARG   4  -4.018   3.653  -1.108
   33    HD3  ARG   4           3HD      ARG   4  -3.363   2.635  -2.390
   34    HE   ARG   4           HE       ARG   4  -5.118   1.830  -0.270
   35   HH11  ARG   4          1HH1      ARG   4  -2.672   0.759  -2.504
   36   HH12  ARG   4          2HH1      ARG   4  -3.198  -0.891  -2.492
   37   HH21  ARG   4          1HH2      ARG   4  -5.821  -0.340  -0.246
   38   HH22  ARG   4          2HH2      ARG   4  -4.990  -1.515  -1.208
   39    H    ILE   5           H        ILE   5   1.052   5.272  -1.592
   40    HA   ILE   5           HA       ILE   5   0.743   8.021  -0.728
   41    HB   ILE   5           HB       ILE   5   2.435   6.545   0.318
   42   HG12  ILE   5          2HG1      ILE   5   4.012   8.677  -1.049
   43   HG13  ILE   5          3HG1      ILE   5   2.608   9.163  -0.104
   44   HG21  ILE   5          1HG2      ILE   5   4.386   5.835  -0.832
   45   HG22  ILE   5          2HG2      ILE   5   3.008   5.368  -1.828
   46   HG23  ILE   5          3HG2      ILE   5   3.969   6.783  -2.260
   47   HD11  ILE   5          3HD1      ILE   5   4.340   9.320   1.410
   48   HD12  ILE   5          1HD1      ILE   5   3.664   7.730   1.762
   49   HD13  ILE   5          2HD1      ILE   5   5.139   7.869   0.805
   50    H    ASP   6           H        ASP   6   1.316   6.322  -3.645
   51    HA   ASP   6           HA       ASP   6   2.774   8.314  -5.046
   52    HB2  ASP   6           2HB      ASP   6   2.848   6.118  -5.938
   53    HB3  ASP   6           3HB      ASP   6   1.092   5.979  -5.944
   54    H    ALA   7           H        ALA   7  -0.652   7.678  -4.580
   55    HA   ALA   7           HA       ALA   7  -1.697   9.396  -6.522
   56    HB1  ALA   7           1HB      ALA   7  -3.572   9.549  -4.585
   57    HB2  ALA   7           2HB      ALA   7  -3.402   8.184  -5.690
   58    HB3  ALA   7           3HB      ALA   7  -2.698   8.104  -4.075
   59    HA   PRO   8           HA       PRO   8  -1.799  12.840  -3.126
   60    HB2  PRO   8           2HB      PRO   8  -0.351  12.397  -0.873
   61    HB3  PRO   8           3HB      PRO   8  -2.044  11.918  -1.036
   62    HG2  PRO   8           2HG      PRO   8   0.430  10.260  -1.333
   63    HG3  PRO   8           3HG      PRO   8  -1.090   9.863  -0.512
   64    HD2  PRO   8           2HD      PRO   8  -0.495   8.957  -2.993
   65    HD3  PRO   8           3HD      PRO   8  -2.157   9.315  -2.480
   66    H    ASP   9           H        ASP   9   1.143  10.964  -3.546
   67    HA   ASP   9           HA       ASP   9   2.881  13.250  -3.298
   68    HB2  ASP   9           2HB      ASP   9   3.581  10.934  -2.673
   69    HB3  ASP   9           3HB      ASP   9   3.518  10.498  -4.378
   70    H    PHE  10           H        PHE  10   1.001  11.850  -5.766
   71    HA   PHE  10           HA       PHE  10   2.504  12.374  -8.055
   72    HB2  PHE  10           2HB      PHE  10  -0.069  11.457  -7.504
   73    HB3  PHE  10           3HB      PHE  10  -0.323  12.921  -8.448
   74    HD1  PHE  10           HD2      PHE  10   1.803   9.856  -8.482
   75    HD2  PHE  10           HD1      PHE  10  -0.388  12.729 -10.731
   76    HE1  PHE  10           HE2      PHE  10   2.285   8.604 -10.544
   77    HE2  PHE  10           HE1      PHE  10   0.090  11.481 -12.797
   78    HZ   PHE  10           HZ       PHE  10   1.429   9.416 -12.705
   79    HA   PRO  11           HA       PRO  11   0.401  16.734  -8.183
   80    HB2  PRO  11           2HB      PRO  11  -0.804  17.578  -5.901
   81    HB3  PRO  11           3HB      PRO  11  -1.656  16.678  -7.161
   82    HG2  PRO  11           2HG      PRO  11  -0.495  15.690  -4.584
   83    HG3  PRO  11           3HG      PRO  11  -2.051  15.292  -5.336
   84    HD2  PRO  11           2HD      PRO  11   0.102  13.658  -5.491
   85    HD3  PRO  11           3HD      PRO  11  -1.104  13.774  -6.789
   86    H    SER  12           H        SER  12   1.894  15.595  -5.221
   87    HA   SER  12           HA       SER  12   3.086  18.151  -4.603
   88    HB2  SER  12           2HB      SER  12   2.397  16.301  -2.930
   89    HB3  SER  12           3HB      SER  12   3.915  15.527  -3.383
   90    HG   SER  12           HG       SER  12   5.022  17.087  -2.422
   91    H    SER  13           H        SER  13   3.841  15.469  -6.567
   92    HA   SER  13           HA       SER  13   6.627  15.413  -6.482
   93    HB2  SER  13           2HB      SER  13   4.637  14.165  -7.983
   94    HB3  SER  13           3HB      SER  13   5.603  15.030  -9.178
   95    HG   SER  13           HG       SER  13   7.429  13.961  -8.427
   96    HA   PRO  14           HA       PRO  14   6.559  18.714 -10.033
   97    HB2  PRO  14           2HB      PRO  14   4.245  20.097 -10.354
   98    HB3  PRO  14           3HB      PRO  14   4.595  18.596 -11.219
   99    HG2  PRO  14           2HG      PRO  14   2.934  19.026  -8.766
  100    HG3  PRO  14           3HG      PRO  14   2.599  18.010 -10.180
  101    HD2  PRO  14           2HD      PRO  14   3.542  17.001  -7.851
  102    HD3  PRO  14           3HD      PRO  14   3.953  16.302  -9.430
  103    H    ALA  15           H        ALA  15   4.848  19.182  -7.030
  104    HA   ALA  15           HA       ALA  15   5.443  21.997  -6.848
  105    HB1  ALA  15           1HB      ALA  15   3.864  20.064  -5.363
  106    HB2  ALA  15           2HB      ALA  15   4.753  21.165  -4.309
  107    HB3  ALA  15           3HB      ALA  15   3.655  21.807  -5.531
  108    H    ILE  16           H        ILE  16   6.677  19.004  -5.416
  109    HA   ILE  16           HA       ILE  16   8.597  20.329  -3.759
  110    HB   ILE  16           HB       ILE  16   7.648  18.051  -3.290
  111   HG12  ILE  16          2HG1      ILE  16   9.876  17.094  -2.557
  112   HG13  ILE  16          3HG1      ILE  16  10.642  18.436  -3.400
  113   HG21  ILE  16          1HG2      ILE  16   9.564  17.203  -5.459
  114   HG22  ILE  16          2HG2      ILE  16   8.650  16.127  -4.404
  115   HG23  ILE  16          3HG2      ILE  16   7.804  17.156  -5.559
  116   HD11  ILE  16          3HD1      ILE  16   9.370  18.351  -0.799
  117   HD12  ILE  16          1HD1      ILE  16  10.498  19.526  -1.473
  118   HD13  ILE  16          2HD1      ILE  16   8.772  19.671  -1.805
  119    H    LEU  17           H        LEU  17   8.613  18.903  -6.964
  120    HA   LEU  17           HA       LEU  17  11.458  19.019  -7.281
  121    HB2  LEU  17           2HB      LEU  17   9.840  17.483  -8.495
  122    HB3  LEU  17           3HB      LEU  17   9.416  18.880  -9.484
  123    HG   LEU  17           HG       LEU  17  12.223  18.669  -9.568
  124   HD11  LEU  17          1HD1      LEU  17  11.991  16.376  -8.745
  125   HD12  LEU  17          2HD1      LEU  17  12.563  16.416 -10.413
  126   HD13  LEU  17          3HD1      LEU  17  10.881  16.015 -10.068
  127   HD21  LEU  17          3HD2      LEU  17  11.666  17.970 -11.968
  128   HD22  LEU  17          1HD2      LEU  17  11.070  19.532 -11.408
  129   HD23  LEU  17          2HD2      LEU  17   9.977  18.150 -11.490
  130    H    GLY  18           H        GLY  18   8.757  21.136  -7.987
  131    HA2  GLY  18           2HA      GLY  18  10.349  22.957  -9.572
  132    HA3  GLY  18           3HA      GLY  18   8.680  23.190  -9.071
  133    H    LYS  19           H        LYS  19   9.377  22.659  -6.236
  134    HA   LYS  19           HA       LYS  19  10.084  25.368  -5.554
  135    HB2  LYS  19           2HB      LYS  19   9.287  22.946  -3.955
  136    HB3  LYS  19           3HB      LYS  19   9.840  24.421  -3.173
  137    HG2  LYS  19           2HG      LYS  19   7.537  24.335  -5.104
  138    HG3  LYS  19           3HG      LYS  19   7.358  24.168  -3.356
  139    HD2  LYS  19           2HD      LYS  19   8.787  26.394  -3.359
  140    HD3  LYS  19           3HD      LYS  19   8.100  26.550  -4.978
  141    HE2  LYS  19           2HE      LYS  19   5.927  26.685  -4.180
  142    HE3  LYS  19           3HE      LYS  19   6.334  25.910  -2.650
  143    HZ1  LYS  19           3HZ      LYS  19   6.901  27.853  -1.733
  144    HZ2  LYS  19           1HZ      LYS  19   6.022  28.559  -2.994
  145    HZ3  LYS  19           2HZ      LYS  19   7.702  28.406  -3.117
  146    H    ALA  20           H        ALA  20  11.626  22.237  -5.549
  147    HA   ALA  20           HA       ALA  20  13.810  22.902  -3.866
  148    HB1  ALA  20           1HB      ALA  20  13.186  20.702  -5.765
  149    HB2  ALA  20           2HB      ALA  20  14.862  20.920  -5.259
  150    HB3  ALA  20           3HB      ALA  20  13.607  20.636  -4.053
  151    H    ALA  21           H        ALA  21  13.205  23.244  -7.304
  152    HA   ALA  21           HA       ALA  21  15.892  23.865  -8.028
  153    HB1  ALA  21           1HB      ALA  21  15.063  23.608 -10.067
  154    HB2  ALA  21           2HB      ALA  21  13.450  23.433  -9.374
  155    HB3  ALA  21           3HB      ALA  21  14.035  25.026  -9.856
  156    H    THR  22           H        THR  22  13.048  25.789  -7.189
  157    HA   THR  22           HA       THR  22  14.393  28.294  -7.663
  158    HB   THR  22           HB       THR  22  11.964  28.108  -7.997
  159    HG1  THR  22           HG1      THR  22  12.599  29.857  -5.836
  160   HG21  THR  22          3HG2      THR  22  11.708  27.919  -5.001
  161   HG22  THR  22          1HG2      THR  22  11.635  26.510  -6.059
  162   HG23  THR  22          2HG2      THR  22  10.432  27.792  -6.212
  163    H    ASP  23           H        ASP  23  13.987  26.112  -5.022
  164    HA   ASP  23           HA       ASP  23  14.490  28.003  -2.933
  165    HB2  ASP  23           2HB      ASP  23  14.311  25.023  -3.112
  166    HB3  ASP  23           3HB      ASP  23  15.044  25.749  -1.685
  167    H    VAL  24           H        VAL  24  16.449  25.759  -4.816
  168    HA   VAL  24           HA       VAL  24  18.841  26.151  -3.314
  169    HB   VAL  24           HB       VAL  24  18.481  25.119  -6.131
  170   HG11  VAL  24          1HG1      VAL  24  20.861  25.197  -4.299
  171   HG12  VAL  24          2HG1      VAL  24  20.734  24.046  -5.631
  172   HG13  VAL  24          3HG1      VAL  24  20.731  25.779  -5.959
  173   HG21  VAL  24          3HG2      VAL  24  17.603  23.973  -3.812
  174   HG22  VAL  24          1HG2      VAL  24  18.010  23.096  -5.287
  175   HG23  VAL  24          2HG2      VAL  24  19.201  23.251  -3.996
  176    H    VAL  25           H        VAL  25  17.420  27.667  -6.147
  177    HA   VAL  25           HA       VAL  25  19.719  29.157  -6.905
  178    HB   VAL  25           HB       VAL  25  16.806  29.701  -7.494
  179   HG11  VAL  25          1HG1      VAL  25  19.259  31.136  -8.155
  180   HG12  VAL  25          2HG1      VAL  25  18.278  30.731  -9.565
  181   HG13  VAL  25          3HG1      VAL  25  17.579  31.663  -8.240
  182   HG21  VAL  25          3HG2      VAL  25  18.324  27.556  -8.296
  183   HG22  VAL  25          1HG2      VAL  25  16.892  28.170  -9.122
  184   HG23  VAL  25          2HG2      VAL  25  18.497  28.683  -9.641
  185    H    ALA  26           H        ALA  26  16.983  29.788  -4.783
  186    HA   ALA  26           HA       ALA  26  17.715  32.538  -4.334
  187    HB1  ALA  26           1HB      ALA  26  15.717  32.746  -3.323
  188    HB2  ALA  26           2HB      ALA  26  15.380  31.197  -4.098
  189    HB3  ALA  26           3HB      ALA  26  15.902  31.245  -2.414
  190    H    ALA  27           H        ALA  27  18.218  29.453  -2.752
  191    HA   ALA  27           HA       ALA  27  19.059  30.356  -0.238
  192    HB1  ALA  27           1HB      ALA  27  20.475  28.129  -0.407
  193    HB2  ALA  27           2HB      ALA  27  18.720  28.100  -0.226
  194    HB3  ALA  27           3HB      ALA  27  19.447  27.869  -1.816
  195    H    TRP  28           H        TRP  28  20.580  30.546  -3.302
  196    HA   TRP  28           HA       TRP  28  23.286  30.524  -2.590
  197    HB2  TRP  28           2HB      TRP  28  21.896  30.838  -4.928
  198    HB3  TRP  28           3HB      TRP  28  22.560  32.452  -4.689
  199    HD1  TRP  28           HD1      TRP  28  23.888  28.798  -4.706
  200    HE1  TRP  28           HE1      TRP  28  26.237  28.822  -5.759
  201    HE3  TRP  28           HE3      TRP  28  24.387  33.829  -5.466
  202    HZ2  TRP  28           HZ2      TRP  28  28.060  30.721  -6.776
  203    HZ3  TRP  28           HZ3      TRP  28  26.464  34.668  -6.483
  204    HH2  TRP  28           HH2      TRP  28  28.262  33.145  -7.124
  205    H    LYS  29           H        LYS  29  20.829  32.839  -1.982
  206    HA   LYS  29           HA       LYS  29  22.457  35.151  -1.728
  207    HB2  LYS  29           2HB      LYS  29  20.553  36.178  -0.679
  208    HB3  LYS  29           3HB      LYS  29  19.976  35.180  -2.007
  209    HG2  LYS  29           2HG      LYS  29  18.481  34.558  -0.426
  210    HG3  LYS  29           3HG      LYS  29  19.753  33.389  -0.063
  211    HD2  LYS  29           2HD      LYS  29  20.054  34.247   1.971
  212    HD3  LYS  29           3HD      LYS  29  20.213  35.880   1.320
  213    HE2  LYS  29           2HE      LYS  29  17.962  36.335   1.560
  214    HE3  LYS  29           3HE      LYS  29  17.508  34.632   1.524
  215    HZ1  LYS  29           3HZ      LYS  29  17.446  34.706   3.723
  216    HZ2  LYS  29           1HZ      LYS  29  18.072  36.277   3.758
  217    HZ3  LYS  29           2HZ      LYS  29  19.120  34.950   3.743
  218    H    SER  30           H        SER  30  21.564  32.553   0.445
  219    HA   SER  30           HA       SER  30  22.401  33.769   2.854
  220    HB2  SER  30           2HB      SER  30  21.148  31.928   3.360
  221    HB3  SER  30           3HB      SER  30  21.724  31.021   1.963
  222    HG   SER  30           HG       SER  30  22.512  30.157   3.929
  Start of MODEL    7
    1    H1   VAL   1           H        VAL   1   1.011  -0.885  -0.182
    2    HA   VAL   1           HA       VAL   1   3.187  -0.596  -1.467
    3    HB   VAL   1           HB       VAL   1   2.090  -0.474  -3.721
    4   HG11  VAL   1          1HG1      VAL   1   0.420  -2.485  -2.927
    5   HG12  VAL   1          2HG1      VAL   1   2.148  -2.662  -3.239
    6   HG13  VAL   1          3HG1      VAL   1   1.570  -2.411  -1.592
    7   HG21  VAL   1          3HG2      VAL   1   0.260   1.050  -3.043
    8   HG22  VAL   1          1HG2      VAL   1  -0.317  -0.397  -3.869
    9   HG23  VAL   1          2HG2      VAL   1  -0.456  -0.268  -2.116
   10    H    LYS   2           H        LYS   2   3.593   0.769  -3.653
   11    HA   LYS   2           HA       LYS   2   4.087   3.450  -2.720
   12    HB2  LYS   2           2HB      LYS   2   5.472   3.703  -4.609
   13    HB3  LYS   2           3HB      LYS   2   5.672   2.024  -4.125
   14    HG2  LYS   2           2HG      LYS   2   5.398   1.705  -6.346
   15    HG3  LYS   2           3HG      LYS   2   3.697   1.696  -5.875
   16    HD2  LYS   2           2HD      LYS   2   3.580   3.211  -7.570
   17    HD3  LYS   2           3HD      LYS   2   3.989   4.315  -6.254
   18    HE2  LYS   2           2HE      LYS   2   5.491   4.922  -7.910
   19    HE3  LYS   2           3HE      LYS   2   6.439   3.813  -6.920
   20    HZ1  LYS   2           3HZ      LYS   2   5.117   2.300  -8.851
   21    HZ2  LYS   2           1HZ      LYS   2   6.778   2.590  -8.715
   22    HZ3  LYS   2           2HZ      LYS   2   5.814   3.618  -9.651
   23    H    GLY   3           H        GLY   3   1.675   1.874  -4.572
   24    HA2  GLY   3           2HA      GLY   3   0.856   4.021  -6.226
   25    HA3  GLY   3           3HA      GLY   3  -0.130   2.641  -5.768
   26    H    ARG   4           H        ARG   4   0.015   3.103  -2.931
   27    HA   ARG   4           HA       ARG   4  -2.176   4.874  -2.654
   28    HB2  ARG   4           2HB      ARG   4  -0.360   3.765  -0.505
   29    HB3  ARG   4           3HB      ARG   4  -1.950   4.474  -0.252
   30    HG2  ARG   4           2HG      ARG   4  -1.384   1.965  -1.818
   31    HG3  ARG   4           3HG      ARG   4  -2.009   2.034  -0.169
   32    HD2  ARG   4           2HD      ARG   4  -3.888   3.480  -1.176
   33    HD3  ARG   4           3HD      ARG   4  -3.342   2.848  -2.729
   34    HE   ARG   4           HE       ARG   4  -3.729   0.701  -0.970
   35   HH11  ARG   4          1HH1      ARG   4  -5.567   3.119  -2.671
   36   HH12  ARG   4          2HH1      ARG   4  -6.992   2.140  -2.789
   37   HH21  ARG   4          1HH2      ARG   4  -5.598  -0.598  -1.119
   38   HH22  ARG   4          2HH2      ARG   4  -7.008   0.026  -1.905
   39    H    ILE   5           H        ILE   5   1.278   5.183  -1.988
   40    HA   ILE   5           HA       ILE   5   0.963   7.873  -0.959
   41    HB   ILE   5           HB       ILE   5   2.677   6.347  -0.024
   42   HG12  ILE   5          2HG1      ILE   5   4.444   8.397  -1.098
   43   HG13  ILE   5          3HG1      ILE   5   2.890   9.059  -0.606
   44   HG21  ILE   5          1HG2      ILE   5   4.178   6.758  -2.599
   45   HG22  ILE   5          2HG2      ILE   5   4.620   5.728  -1.239
   46   HG23  ILE   5          3HG2      ILE   5   3.234   5.311  -2.247
   47   HD11  ILE   5          3HD1      ILE   5   4.871   8.909   1.079
   48   HD12  ILE   5          1HD1      ILE   5   3.224   8.556   1.601
   49   HD13  ILE   5          2HD1      ILE   5   4.339   7.236   1.245
   50    H    ASP   6           H        ASP   6   1.511   6.355  -3.978
   51    HA   ASP   6           HA       ASP   6   2.939   8.437  -5.276
   52    HB2  ASP   6           2HB      ASP   6   2.989   6.262  -6.263
   53    HB3  ASP   6           3HB      ASP   6   1.231   6.180  -6.326
   54    H    ALA   7           H        ALA   7  -0.477   7.751  -4.808
   55    HA   ALA   7           HA       ALA   7  -1.556   9.574  -6.631
   56    HB1  ALA   7           1HB      ALA   7  -3.233   8.285  -5.849
   57    HB2  ALA   7           2HB      ALA   7  -2.521   8.147  -4.240
   58    HB3  ALA   7           3HB      ALA   7  -3.417   9.599  -4.686
   59    HA   PRO   8           HA       PRO   8  -1.638  12.809  -3.035
   60    HB2  PRO   8           2HB      PRO   8  -0.160  12.243  -0.829
   61    HB3  PRO   8           3HB      PRO   8  -1.852  11.763  -1.001
   62    HG2  PRO   8           2HG      PRO   8   0.629  10.142  -1.425
   63    HG3  PRO   8           3HG      PRO   8  -0.879   9.687  -0.611
   64    HD2  PRO   8           2HD      PRO   8  -0.309   8.934  -3.149
   65    HD3  PRO   8           3HD      PRO   8  -1.966   9.249  -2.596
   66    H    ASP   9           H        ASP   9   1.310  10.981  -3.601
   67    HA   ASP   9           HA       ASP   9   3.037  13.260  -3.238
   68    HB2  ASP   9           2HB      ASP   9   3.737  10.895  -2.772
   69    HB3  ASP   9           3HB      ASP   9   3.698  10.598  -4.508
   70    H    PHE  10           H        PHE  10   1.135  11.997  -5.763
   71    HA   PHE  10           HA       PHE  10   2.607  12.667  -8.034
   72    HB2  PHE  10           2HB      PHE  10   0.046  11.701  -7.507
   73    HB3  PHE  10           3HB      PHE  10  -0.228  13.217  -8.360
   74    HD1  PHE  10           HD1      PHE  10   2.214  10.407  -8.657
   75    HD2  PHE  10           HD2      PHE  10  -0.617  12.927 -10.593
   76    HE1  PHE  10           HE1      PHE  10   2.681   9.282 -10.795
   77    HE2  PHE  10           HE2      PHE  10  -0.156  11.806 -12.734
   78    HZ   PHE  10           HZ       PHE  10   1.494   9.980 -12.837
   79    HA   PRO  11           HA       PRO  11   0.475  17.012  -7.876
   80    HB2  PRO  11           2HB      PRO  11  -0.707  17.710  -5.534
   81    HB3  PRO  11           3HB      PRO  11  -1.569  16.881  -6.835
   82    HG2  PRO  11           2HG      PRO  11  -0.370  15.750  -4.336
   83    HG3  PRO  11           3HG      PRO  11  -1.933  15.386  -5.091
   84    HD2  PRO  11           2HD      PRO  11   0.229  13.779  -5.370
   85    HD3  PRO  11           3HD      PRO  11  -0.994  13.964  -6.643
   86    H    SER  12           H        SER  12   2.012  15.709  -5.006
   87    HA   SER  12           HA       SER  12   3.195  18.233  -4.251
   88    HB2  SER  12           2HB      SER  12   3.333  15.425  -3.200
   89    HB3  SER  12           3HB      SER  12   4.524  16.616  -2.678
   90    HG   SER  12           HG       SER  12   2.157  16.278  -1.682
   91    H    SER  13           H        SER  13   3.942  15.677  -6.380
   92    HA   SER  13           HA       SER  13   6.730  15.636  -6.332
   93    HB2  SER  13           2HB      SER  13   4.728  14.467  -7.882
   94    HB3  SER  13           3HB      SER  13   5.678  15.406  -9.034
   95    HG   SER  13           HG       SER  13   6.295  13.080  -8.253
   96    HA   PRO  14           HA       PRO  14   6.598  19.141  -9.678
   97    HB2  PRO  14           2HB      PRO  14   4.272  20.525  -9.889
   98    HB3  PRO  14           3HB      PRO  14   4.620  19.080 -10.846
   99    HG2  PRO  14           2HG      PRO  14   2.987  19.352  -8.352
  100    HG3  PRO  14           3HG      PRO  14   2.641  18.420  -9.820
  101    HD2  PRO  14           2HD      PRO  14   3.619  17.280  -7.567
  102    HD3  PRO  14           3HD      PRO  14   4.014  16.679  -9.190
  103    H    ALA  15           H        ALA  15   4.921  19.418  -6.633
  104    HA   ALA  15           HA       ALA  15   5.501  22.221  -6.290
  105    HB1  ALA  15           1HB      ALA  15   4.854  21.182  -3.797
  106    HB2  ALA  15           2HB      ALA  15   3.758  21.971  -4.932
  107    HB3  ALA  15           3HB      ALA  15   3.919  20.215  -4.938
  108    H    ILE  16           H        ILE  16   6.771  19.156  -5.053
  109    HA   ILE  16           HA       ILE  16   8.702  20.394  -3.343
  110    HB   ILE  16           HB       ILE  16   7.773  18.086  -3.000
  111   HG12  ILE  16          2HG1      ILE  16   9.982  17.110  -2.307
  112   HG13  ILE  16          3HG1      ILE  16  10.773  18.444  -3.140
  113   HG21  ILE  16          1HG2      ILE  16   7.907  17.329  -5.320
  114   HG22  ILE  16          2HG2      ILE  16   9.667  17.382  -5.237
  115   HG23  ILE  16          3HG2      ILE  16   8.771  16.237  -4.238
  116   HD11  ILE  16          3HD1      ILE  16  10.192  18.459  -0.531
  117   HD12  ILE  16          1HD1      ILE  16  10.282  19.920  -1.515
  118   HD13  ILE  16          2HD1      ILE  16   8.716  19.185  -1.167
  119    H    LEU  17           H        LEU  17   8.688  19.161  -6.628
  120    HA   LEU  17           HA       LEU  17  11.528  19.315  -6.971
  121    HB2  LEU  17           2HB      LEU  17   9.186  18.838  -8.757
  122    HB3  LEU  17           3HB      LEU  17  10.748  19.232  -9.472
  123    HG   LEU  17           HG       LEU  17  10.671  17.020  -7.494
  124   HD11  LEU  17          1HD1      LEU  17  10.045  16.214 -10.249
  125   HD12  LEU  17          2HD1      LEU  17   8.725  16.984  -9.370
  126   HD13  LEU  17          3HD1      LEU  17   9.498  15.542  -8.713
  127   HD21  LEU  17          3HD2      LEU  17  12.336  16.087  -9.018
  128   HD22  LEU  17          1HD2      LEU  17  12.764  17.727  -8.532
  129   HD23  LEU  17          2HD2      LEU  17  12.080  17.432 -10.130
  130    H    GLY  18           H        GLY  18   8.806  21.452  -7.518
  131    HA2  GLY  18           2HA      GLY  18  10.367  23.374  -9.011
  132    HA3  GLY  18           3HA      GLY  18   8.703  23.566  -8.477
  133    H    LYS  19           H        LYS  19   9.438  22.872  -5.687
  134    HA   LYS  19           HA       LYS  19  10.136  25.541  -4.855
  135    HB2  LYS  19           2HB      LYS  19   9.373  23.023  -3.394
  136    HB3  LYS  19           3HB      LYS  19   9.930  24.451  -2.531
  137    HG2  LYS  19           2HG      LYS  19   8.086  25.734  -3.278
  138    HG3  LYS  19           3HG      LYS  19   7.614  24.497  -4.446
  139    HD2  LYS  19           2HD      LYS  19   7.244  22.953  -2.488
  140    HD3  LYS  19           3HD      LYS  19   7.459  24.356  -1.440
  141    HE2  LYS  19           2HE      LYS  19   5.586  25.470  -2.540
  142    HE3  LYS  19           3HE      LYS  19   5.383  24.086  -3.613
  143    HZ1  LYS  19           3HZ      LYS  19   5.266  22.907  -1.224
  144    HZ2  LYS  19           1HZ      LYS  19   3.906  23.461  -2.063
  145    HZ3  LYS  19           2HZ      LYS  19   4.593  24.412  -0.845
  146    H    ALA  20           H        ALA  20  11.698  22.426  -5.053
  147    HA   ALA  20           HA       ALA  20  13.899  23.004  -3.360
  148    HB1  ALA  20           1HB      ALA  20  13.349  20.941  -5.451
  149    HB2  ALA  20           2HB      ALA  20  14.968  21.104  -4.770
  150    HB3  ALA  20           3HB      ALA  20  13.601  20.741  -3.717
  151    H    ALA  21           H        ALA  21  13.250  23.545  -6.764
  152    HA   ALA  21           HA       ALA  21  15.923  24.227  -7.482
  153    HB1  ALA  21           1HB      ALA  21  13.336  24.091  -8.788
  154    HB2  ALA  21           2HB      ALA  21  14.284  25.480  -9.321
  155    HB3  ALA  21           3HB      ALA  21  14.953  23.853  -9.452
  156    H    THR  22           H        THR  22  13.078  26.077  -6.497
  157    HA   THR  22           HA       THR  22  14.402  28.615  -6.837
  158    HB   THR  22           HB       THR  22  11.970  28.433  -7.153
  159    HG1  THR  22           HG1      THR  22  11.926  30.444  -6.518
  160   HG21  THR  22          3HG2      THR  22  10.462  28.001  -5.373
  161   HG22  THR  22          1HG2      THR  22  11.751  28.066  -4.171
  162   HG23  THR  22          2HG2      THR  22  11.674  26.722  -5.310
  163    H    ASP  23           H        ASP  23  14.042  26.279  -4.326
  164    HA   ASP  23           HA       ASP  23  14.557  28.045  -2.134
  165    HB2  ASP  23           2HB      ASP  23  13.373  25.995  -1.699
  166    HB3  ASP  23           3HB      ASP  23  14.684  25.036  -2.381
  167    H    VAL  24           H        VAL  24  16.509  25.930  -4.169
  168    HA   VAL  24           HA       VAL  24  18.916  26.249  -2.675
  169    HB   VAL  24           HB       VAL  24  18.529  25.392  -5.547
  170   HG11  VAL  24          1HG1      VAL  24  20.928  25.510  -3.768
  171   HG12  VAL  24          2HG1      VAL  24  20.808  24.262  -5.010
  172   HG13  VAL  24          3HG1      VAL  24  20.767  25.966  -5.464
  173   HG21  VAL  24          3HG2      VAL  24  17.948  23.379  -4.794
  174   HG22  VAL  24          1HG2      VAL  24  19.311  23.337  -3.675
  175   HG23  VAL  24          2HG2      VAL  24  17.796  24.099  -3.191
  176    H    VAL  25           H        VAL  25  17.462  27.916  -5.409
  177    HA   VAL  25           HA       VAL  25  19.744  29.477  -6.075
  178    HB   VAL  25           HB       VAL  25  16.824  29.998  -6.649
  179   HG11  VAL  25          1HG1      VAL  25  17.681  31.459  -8.451
  180   HG12  VAL  25          2HG1      VAL  25  18.087  32.046  -6.837
  181   HG13  VAL  25          3HG1      VAL  25  19.311  31.239  -7.817
  182   HG21  VAL  25          3HG2      VAL  25  17.066  28.837  -8.638
  183   HG22  VAL  25          1HG2      VAL  25  18.824  28.979  -8.625
  184   HG23  VAL  25          2HG2      VAL  25  18.021  27.863  -7.521
  185    H    ALA  26           H        ALA  26  16.988  29.949  -3.936
  186    HA   ALA  26           HA       ALA  26  17.681  32.679  -3.329
  187    HB1  ALA  26           1HB      ALA  26  15.405  32.336  -3.158
  188    HB2  ALA  26           2HB      ALA  26  15.593  30.768  -2.371
  189    HB3  ALA  26           3HB      ALA  26  15.914  32.250  -1.471
  190    H    ALA  27           H        ALA  27  18.276  29.520  -1.964
  191    HA   ALA  27           HA       ALA  27  19.272  30.536   0.542
  192    HB1  ALA  27           1HB      ALA  27  19.878  28.206   0.998
  193    HB2  ALA  27           2HB      ALA  27  18.205  28.353   0.458
  194    HB3  ALA  27           3HB      ALA  27  19.444  27.774  -0.657
  195    H    TRP  28           H        TRP  28  20.625  29.423  -2.510
  196    HA   TRP  28           HA       TRP  28  23.329  29.352  -1.662
  197    HB2  TRP  28           2HB      TRP  28  22.577  28.164  -3.664
  198    HB3  TRP  28           3HB      TRP  28  22.169  29.694  -4.436
  199    HD1  TRP  28           HD1      TRP  28  25.166  27.514  -3.507
  200    HE1  TRP  28           HE1      TRP  28  27.233  28.366  -4.782
  201    HE3  TRP  28           HE3      TRP  28  23.190  31.791  -5.490
  202    HZ2  TRP  28           HZ2      TRP  28  27.933  30.561  -6.413
  203    HZ3  TRP  28           HZ3      TRP  28  24.625  33.212  -6.897
  204    HH2  TRP  28           HH2      TRP  28  26.947  32.608  -7.347
  205    H    LYS  29           H        LYS  29  21.318  31.843  -3.152
  206    HA   LYS  29           HA       LYS  29  23.443  33.721  -3.477
  207    HB2  LYS  29           2HB      LYS  29  21.638  35.340  -3.940
  208    HB3  LYS  29           3HB      LYS  29  21.463  33.860  -4.874
  209    HG2  LYS  29           2HG      LYS  29  19.312  34.177  -4.185
  210    HG3  LYS  29           3HG      LYS  29  19.915  33.155  -2.878
  211    HD2  LYS  29           2HD      LYS  29  19.409  34.740  -1.405
  212    HD3  LYS  29           3HD      LYS  29  20.504  35.856  -2.225
  213    HE2  LYS  29           2HE      LYS  29  18.655  36.389  -3.810
  214    HE3  LYS  29           3HE      LYS  29  17.584  35.398  -2.821
  215    HZ1  LYS  29           3HZ      LYS  29  19.007  37.313  -1.257
  216    HZ2  LYS  29           1HZ      LYS  29  17.340  37.041  -1.368
  217    HZ3  LYS  29           2HZ      LYS  29  18.107  38.060  -2.479
  218    H    SER  30           H        SER  30  21.219  32.927  -0.918
  219    HA   SER  30           HA       SER  30  21.556  35.319   0.588
  220    HB2  SER  30           2HB      SER  30  19.612  34.092   1.102
  221    HB3  SER  30           3HB      SER  30  20.501  32.574   1.239
  222    HG   SER  30           HG       SER  30  21.053  33.062   3.230
  Start of MODEL    8
    1    H1   VAL   1           H        VAL   1   1.197  -1.049  -0.174
    2    HA   VAL   1           HA       VAL   1   3.154  -0.905  -1.946
    3    HB   VAL   1           HB       VAL   1   1.457  -0.454  -3.775
    4   HG11  VAL   1          1HG1      VAL   1   0.610  -2.610  -3.653
    5   HG12  VAL   1          2HG1      VAL   1   2.046  -2.701  -2.632
    6   HG13  VAL   1          3HG1      VAL   1   0.448  -2.556  -1.898
    7   HG21  VAL   1          3HG2      VAL   1  -0.755  -0.025  -3.312
    8   HG22  VAL   1          1HG2      VAL   1  -0.652  -0.682  -1.678
    9   HG23  VAL   1          2HG2      VAL   1   0.037   0.902  -2.037
   10    H    LYS   2           H        LYS   2   3.622   0.540  -3.805
   11    HA   LYS   2           HA       LYS   2   4.089   3.218  -2.852
   12    HB2  LYS   2           2HB      LYS   2   5.499   3.488  -4.719
   13    HB3  LYS   2           3HB      LYS   2   5.701   1.807  -4.241
   14    HG2  LYS   2           2HG      LYS   2   5.460   1.498  -6.467
   15    HG3  LYS   2           3HG      LYS   2   3.753   1.478  -6.021
   16    HD2  LYS   2           2HD      LYS   2   3.651   3.001  -7.709
   17    HD3  LYS   2           3HD      LYS   2   4.037   4.101  -6.382
   18    HE2  LYS   2           2HE      LYS   2   6.518   3.374  -7.122
   19    HE3  LYS   2           3HE      LYS   2   5.687   3.221  -8.669
   20    HZ1  LYS   2           3HZ      LYS   2   5.037   5.641  -7.267
   21    HZ2  LYS   2           1HZ      LYS   2   5.527   5.420  -8.871
   22    HZ3  LYS   2           2HZ      LYS   2   6.683   5.519  -7.641
   23    H    GLY   3           H        GLY   3   1.711   1.640  -4.745
   24    HA2  GLY   3           2HA      GLY   3   0.905   3.791  -6.400
   25    HA3  GLY   3           3HA      GLY   3  -0.081   2.404  -5.963
   26    H    ARG   4           H        ARG   4   0.023   2.853  -3.122
   27    HA   ARG   4           HA       ARG   4  -2.181   4.611  -2.867
   28    HB2  ARG   4           2HB      ARG   4  -0.417   3.181  -0.898
   29    HB3  ARG   4           3HB      ARG   4  -1.645   4.315  -0.352
   30    HG2  ARG   4           2HG      ARG   4  -2.163   1.879  -2.044
   31    HG3  ARG   4           3HG      ARG   4  -2.419   1.990  -0.302
   32    HD2  ARG   4           2HD      ARG   4  -3.896   4.038  -0.918
   33    HD3  ARG   4           3HD      ARG   4  -3.912   3.318  -2.527
   34    HE   ARG   4           HE       ARG   4  -5.339   1.711  -1.749
   35   HH11  ARG   4          1HH1      ARG   4  -3.818   3.282   0.960
   36   HH12  ARG   4          2HH1      ARG   4  -4.801   2.483   2.142
   37   HH21  ARG   4          1HH2      ARG   4  -6.640   0.653  -0.202
   38   HH22  ARG   4          2HH2      ARG   4  -6.405   0.988   1.480
   39    H    ILE   5           H        ILE   5   1.262   4.934  -2.151
   40    HA   ILE   5           HA       ILE   5   0.918   7.618  -1.113
   41    HB   ILE   5           HB       ILE   5   2.626   6.095  -0.162
   42   HG12  ILE   5          2HG1      ILE   5   4.298   8.245  -1.297
   43   HG13  ILE   5          3HG1      ILE   5   2.787   8.782  -0.571
   44   HG21  ILE   5          1HG2      ILE   5   4.121   6.515  -2.743
   45   HG22  ILE   5          2HG2      ILE   5   4.617   5.537  -1.363
   46   HG23  ILE   5          3HG2      ILE   5   3.235   5.044  -2.341
   47   HD11  ILE   5          3HD1      ILE   5   3.378   7.864   1.532
   48   HD12  ILE   5          1HD1      ILE   5   4.764   7.019   0.843
   49   HD13  ILE   5          2HD1      ILE   5   4.768   8.779   0.949
   50    H    ASP   6           H        ASP   6   1.516   6.117  -4.132
   51    HA   ASP   6           HA       ASP   6   2.952   8.213  -5.399
   52    HB2  ASP   6           2HB      ASP   6   3.061   6.089  -6.438
   53    HB3  ASP   6           3HB      ASP   6   1.308   5.912  -6.440
   54    H    ALA   7           H        ALA   7  -0.467   7.507  -4.983
   55    HA   ALA   7           HA       ALA   7  -1.529   9.333  -6.812
   56    HB1  ALA   7           1HB      ALA   7  -2.529   7.586  -4.863
   57    HB2  ALA   7           2HB      ALA   7  -3.174   9.179  -4.465
   58    HB3  ALA   7           3HB      ALA   7  -3.444   8.494  -6.067
   59    HA   PRO   8           HA       PRO   8  -1.679  12.550  -3.202
   60    HB2  PRO   8           2HB      PRO   8  -0.229  11.981  -0.978
   61    HB3  PRO   8           3HB      PRO   8  -1.916  11.493  -1.176
   62    HG2  PRO   8           2HG      PRO   8   0.579   9.887  -1.574
   63    HG3  PRO   8           3HG      PRO   8  -0.938   9.420  -0.783
   64    HD2  PRO   8           2HD      PRO   8  -0.328   8.682  -3.316
   65    HD3  PRO   8           3HD      PRO   8  -1.995   8.987  -2.785
   66    H    ASP   9           H        ASP   9   1.286  10.740  -3.735
   67    HA   ASP   9           HA       ASP   9   2.996  13.026  -3.336
   68    HB2  ASP   9           2HB      ASP   9   3.852  10.817  -2.806
   69    HB3  ASP   9           3HB      ASP   9   3.559  10.274  -4.456
   70    H    PHE  10           H        PHE  10   1.137  11.765  -5.894
   71    HA   PHE  10           HA       PHE  10   2.637  12.455  -8.141
   72    HB2  PHE  10           2HB      PHE  10   0.046  11.509  -7.636
   73    HB3  PHE  10           3HB      PHE  10  -0.175  12.998  -8.549
   74    HD1  PHE  10           HD2      PHE  10   1.261  13.240 -10.698
   75    HD2  PHE  10           HD1      PHE  10   0.473   9.538  -8.752
   76    HE1  PHE  10           HE2      PHE  10   1.775  12.040 -12.783
   77    HE2  PHE  10           HE1      PHE  10   0.987   8.331 -10.834
   78    HZ   PHE  10           HZ       PHE  10   1.638   9.582 -12.853
   79    HA   PRO  11           HA       PRO  11   0.481  16.788  -7.992
   80    HB2  PRO  11           2HB      PRO  11  -0.737  17.468  -5.663
   81    HB3  PRO  11           3HB      PRO  11  -1.577  16.641  -6.981
   82    HG2  PRO  11           2HG      PRO  11  -0.407  15.504  -4.471
   83    HG3  PRO  11           3HG      PRO  11  -1.957  15.136  -5.250
   84    HD2  PRO  11           2HD      PRO  11   0.216  13.541  -5.505
   85    HD3  PRO  11           3HD      PRO  11  -0.990  13.726  -6.795
   86    H    SER  12           H        SER  12   1.992  15.474  -5.115
   87    HA   SER  12           HA       SER  12   3.148  18.001  -4.326
   88    HB2  SER  12           2HB      SER  12   4.000  15.307  -3.284
   89    HB3  SER  12           3HB      SER  12   4.019  16.864  -2.457
   90    HG   SER  12           HG       SER  12   1.906  16.713  -2.078
   91    H    SER  13           H        SER  13   3.942  15.456  -6.455
   92    HA   SER  13           HA       SER  13   6.729  15.441  -6.374
   93    HB2  SER  13           2HB      SER  13   6.372  13.892  -7.950
   94    HB3  SER  13           3HB      SER  13   4.686  14.395  -8.070
   95    HG   SER  13           HG       SER  13   5.229  15.037  -9.992
   96    HA   PRO  14           HA       PRO  14   6.597  18.953  -9.715
   97    HB2  PRO  14           2HB      PRO  14   4.263  20.321  -9.937
   98    HB3  PRO  14           3HB      PRO  14   4.627  18.882 -10.896
   99    HG2  PRO  14           2HG      PRO  14   2.976  19.135  -8.412
  100    HG3  PRO  14           3HG      PRO  14   2.646  18.204  -9.885
  101    HD2  PRO  14           2HD      PRO  14   3.617  17.064  -7.629
  102    HD3  PRO  14           3HD      PRO  14   4.028  16.472  -9.251
  103    H    ALA  15           H        ALA  15   4.892  19.211  -6.682
  104    HA   ALA  15           HA       ALA  15   5.456  22.016  -6.327
  105    HB1  ALA  15           1HB      ALA  15   3.513  21.429  -5.237
  106    HB2  ALA  15           2HB      ALA  15   4.168  19.892  -4.671
  107    HB3  ALA  15           3HB      ALA  15   4.681  21.401  -3.916
  108    H    ILE  16           H        ILE  16   6.730  18.954  -5.088
  109    HA   ILE  16           HA       ILE  16   8.638  20.195  -3.355
  110    HB   ILE  16           HB       ILE  16   7.721  17.881  -3.030
  111   HG12  ILE  16          2HG1      ILE  16   9.975  16.903  -2.385
  112   HG13  ILE  16          3HG1      ILE  16  10.706  18.325  -3.120
  113   HG21  ILE  16          1HG2      ILE  16   7.876  17.136  -5.352
  114   HG22  ILE  16          2HG2      ILE  16   9.635  17.198  -5.257
  115   HG23  ILE  16          3HG2      ILE  16   8.739  16.043  -4.270
  116   HD11  ILE  16          3HD1      ILE  16   8.719  19.259  -1.368
  117   HD12  ILE  16          1HD1      ILE  16   9.614  18.007  -0.509
  118   HD13  ILE  16          2HD1      ILE  16  10.469  19.386  -1.200
  119    H    LEU  17           H        LEU  17   8.662  18.979  -6.646
  120    HA   LEU  17           HA       LEU  17  11.504  19.152  -6.961
  121    HB2  LEU  17           2HB      LEU  17  10.393  17.600  -8.344
  122    HB3  LEU  17           3HB      LEU  17   9.213  18.799  -8.871
  123    HG   LEU  17           HG       LEU  17  11.969  19.469  -9.589
  124   HD11  LEU  17          1HD1      LEU  17  10.860  16.812 -10.231
  125   HD12  LEU  17          2HD1      LEU  17  12.535  17.356 -10.141
  126   HD13  LEU  17          3HD1      LEU  17  11.569  17.709 -11.573
  127   HD21  LEU  17          3HD2      LEU  17  10.271  20.765 -10.543
  128   HD22  LEU  17          1HD2      LEU  17   9.289  19.353 -10.936
  129   HD23  LEU  17          2HD2      LEU  17  10.770  19.676 -11.839
  130    H    GLY  18           H        GLY  18   8.774  21.273  -7.524
  131    HA2  GLY  18           2HA      GLY  18  10.335  23.212  -8.994
  132    HA3  GLY  18           3HA      GLY  18   8.666  23.391  -8.474
  133    H    LYS  19           H        LYS  19   9.383  22.689  -5.681
  134    HA   LYS  19           HA       LYS  19  10.053  25.358  -4.830
  135    HB2  LYS  19           2HB      LYS  19   9.282  22.826  -3.401
  136    HB3  LYS  19           3HB      LYS  19   9.852  24.232  -2.511
  137    HG2  LYS  19           2HG      LYS  19   7.502  24.252  -4.392
  138    HG3  LYS  19           3HG      LYS  19   7.385  24.052  -2.642
  139    HD2  LYS  19           2HD      LYS  19   8.936  26.289  -2.850
  140    HD3  LYS  19           3HD      LYS  19   7.862  26.464  -4.240
  141    HE2  LYS  19           2HE      LYS  19   6.271  27.196  -2.875
  142    HE3  LYS  19           3HE      LYS  19   6.261  25.622  -2.082
  143    HZ1  LYS  19           3HZ      LYS  19   7.091  28.081  -1.037
  144    HZ2  LYS  19           1HZ      LYS  19   8.449  27.075  -1.119
  145    HZ3  LYS  19           2HZ      LYS  19   7.074  26.571  -0.273
  146    H    ALA  20           H        ALA  20  11.640  22.253  -5.018
  147    HA   ALA  20           HA       ALA  20  13.821  22.831  -3.308
  148    HB1  ALA  20           1HB      ALA  20  14.879  20.993  -4.940
  149    HB2  ALA  20           2HB      ALA  20  13.747  20.595  -3.646
  150    HB3  ALA  20           3HB      ALA  20  13.170  20.753  -5.306
  151    H    ALA  21           H        ALA  21  13.248  23.337  -6.745
  152    HA   ALA  21           HA       ALA  21  15.911  24.105  -7.388
  153    HB1  ALA  21           1HB      ALA  21  15.047  24.770  -9.508
  154    HB2  ALA  21           2HB      ALA  21  14.203  23.298  -9.027
  155    HB3  ALA  21           3HB      ALA  21  13.404  24.862  -8.874
  156    H    THR  22           H        THR  22  13.008  25.872  -6.436
  157    HA   THR  22           HA       THR  22  14.248  28.450  -6.773
  158    HB   THR  22           HB       THR  22  11.655  27.716  -5.399
  159    HG1  THR  22           HG1      THR  22  12.325  28.447  -8.053
  160   HG21  THR  22          3HG2      THR  22  11.378  30.284  -6.234
  161   HG22  THR  22          1HG2      THR  22  13.082  30.260  -5.785
  162   HG23  THR  22          2HG2      THR  22  11.852  29.818  -4.601
  163    H    ASP  23           H        ASP  23  13.948  26.108  -4.252
  164    HA   ASP  23           HA       ASP  23  14.439  27.902  -2.073
  165    HB2  ASP  23           2HB      ASP  23  13.298  25.907  -1.508
  166    HB3  ASP  23           3HB      ASP  23  14.477  24.902  -2.346
  167    H    VAL  24           H        VAL  24  16.409  25.784  -4.089
  168    HA   VAL  24           HA       VAL  24  18.813  26.126  -2.603
  169    HB   VAL  24           HB       VAL  24  18.432  25.279  -5.478
  170   HG11  VAL  24          1HG1      VAL  24  20.682  26.012  -5.214
  171   HG12  VAL  24          2HG1      VAL  24  20.837  25.179  -3.666
  172   HG13  VAL  24          3HG1      VAL  24  20.699  24.249  -5.159
  173   HG21  VAL  24          3HG2      VAL  24  17.971  23.209  -4.759
  174   HG22  VAL  24          1HG2      VAL  24  19.214  23.271  -3.510
  175   HG23  VAL  24          2HG2      VAL  24  17.623  23.969  -3.206
  176    H    VAL  25           H        VAL  25  17.339  27.800  -5.319
  177    HA   VAL  25           HA       VAL  25  19.609  29.379  -5.986
  178    HB   VAL  25           HB       VAL  25  16.684  29.896  -6.543
  179   HG11  VAL  25          1HG1      VAL  25  17.802  31.954  -6.813
  180   HG12  VAL  25          2HG1      VAL  25  19.195  31.187  -7.577
  181   HG13  VAL  25          3HG1      VAL  25  17.656  31.278  -8.435
  182   HG21  VAL  25          3HG2      VAL  25  18.275  27.847  -7.484
  183   HG22  VAL  25          1HG2      VAL  25  16.800  28.450  -8.241
  184   HG23  VAL  25          2HG2      VAL  25  18.371  29.059  -8.761
  185    H    ALA  26           H        ALA  26  16.855  29.822  -3.837
  186    HA   ALA  26           HA       ALA  26  17.534  32.552  -3.215
  187    HB1  ALA  26           1HB      ALA  26  15.271  32.246  -3.008
  188    HB2  ALA  26           2HB      ALA  26  15.440  30.629  -2.324
  189    HB3  ALA  26           3HB      ALA  26  15.780  32.047  -1.331
  190    H    ALA  27           H        ALA  27  18.152  29.388  -1.872
  191    HA   ALA  27           HA       ALA  27  19.145  30.393   0.640
  192    HB1  ALA  27           1HB      ALA  27  19.765  28.065   1.080
  193    HB2  ALA  27           2HB      ALA  27  18.092  28.202   0.536
  194    HB3  ALA  27           3HB      ALA  27  19.339  27.641  -0.578
  195    H    TRP  28           H        TRP  28  20.501  29.307  -2.421
  196    HA   TRP  28           HA       TRP  28  23.207  29.252  -1.578
  197    HB2  TRP  28           2HB      TRP  28  22.381  28.093  -3.605
  198    HB3  TRP  28           3HB      TRP  28  22.103  29.656  -4.366
  199    HD1  TRP  28           HD1      TRP  28  24.960  27.347  -3.245
  200    HE1  TRP  28           HE1      TRP  28  27.104  28.043  -4.487
  201    HE3  TRP  28           HE3      TRP  28  23.235  31.583  -5.529
  202    HZ2  TRP  28           HZ2      TRP  28  27.952  30.114  -6.207
  203    HZ3  TRP  28           HZ3      TRP  28  24.776  32.864  -6.956
  204    HH2  TRP  28           HH2      TRP  28  27.086  32.144  -7.286
  205    H    LYS  29           H        LYS  29  21.176  31.737  -3.050
  206    HA   LYS  29           HA       LYS  29  23.287  33.632  -3.366
  207    HB2  LYS  29           2HB      LYS  29  21.469  35.241  -3.816
  208    HB3  LYS  29           3HB      LYS  29  21.303  33.766  -4.759
  209    HG2  LYS  29           2HG      LYS  29  19.151  34.063  -4.064
  210    HG3  LYS  29           3HG      LYS  29  19.764  33.037  -2.764
  211    HD2  LYS  29           2HD      LYS  29  19.201  34.608  -1.296
  212    HD3  LYS  29           3HD      LYS  29  20.351  35.709  -2.059
  213    HE2  LYS  29           2HE      LYS  29  18.714  36.667  -3.415
  214    HE3  LYS  29           3HE      LYS  29  17.608  35.311  -3.199
  215    HZ1  LYS  29           3HZ      LYS  29  16.860  36.113  -1.238
  216    HZ2  LYS  29           1HZ      LYS  29  17.328  37.592  -1.912
  217    HZ3  LYS  29           2HZ      LYS  29  18.340  36.808  -0.808
  218    H    SER  30           H        SER  30  21.073  32.807  -0.808
  219    HA   SER  30           HA       SER  30  21.270  35.166   0.717
  220    HB2  SER  30           2HB      SER  30  19.564  33.900   1.549
  221    HB3  SER  30           3HB      SER  30  20.381  32.378   1.195
  222    HG   SER  30           HG       SER  30  20.733  34.103   3.402
  Start of MODEL    9
    1    H1   VAL   1           H        VAL   1   1.561  -0.873   0.640
    2    HA   VAL   1           HA       VAL   1   3.117  -0.632  -1.082
    3    HB   VAL   1           HB       VAL   1   1.924  -0.562  -3.255
    4   HG11  VAL   1          1HG1      VAL   1   2.021  -2.567  -1.580
    5   HG12  VAL   1          2HG1      VAL   1   0.283  -2.289  -1.459
    6   HG13  VAL   1          3HG1      VAL   1   1.011  -2.660  -3.022
    7   HG21  VAL   1          3HG2      VAL   1  -0.630  -0.543  -3.058
    8   HG22  VAL   1          1HG2      VAL   1  -0.373   0.230  -1.493
    9   HG23  VAL   1          2HG2      VAL   1   0.209   1.006  -2.967
   10    H    LYS   2           H        LYS   2   3.521   0.718  -3.224
   11    HA   LYS   2           HA       LYS   2   4.008   3.414  -2.333
   12    HB2  LYS   2           2HB      LYS   2   5.390   3.643  -4.229
   13    HB3  LYS   2           3HB      LYS   2   5.602   1.975  -3.710
   14    HG2  LYS   2           2HG      LYS   2   5.332   1.606  -5.922
   15    HG3  LYS   2           3HG      LYS   2   3.630   1.598  -5.454
   16    HD2  LYS   2           2HD      LYS   2   3.281   3.770  -6.259
   17    HD3  LYS   2           3HD      LYS   2   5.009   4.128  -6.297
   18    HE2  LYS   2           2HE      LYS   2   4.406   1.854  -7.958
   19    HE3  LYS   2           3HE      LYS   2   3.403   3.232  -8.409
   20    HZ1  LYS   2           3HZ      LYS   2   6.354   3.351  -8.116
   21    HZ2  LYS   2           1HZ      LYS   2   5.342   4.564  -8.721
   22    HZ3  LYS   2           2HZ      LYS   2   5.556   3.130  -9.591
   23    H    GLY   3           H        GLY   3   1.605   1.802  -4.167
   24    HA2  GLY   3           2HA      GLY   3   0.781   3.903  -5.867
   25    HA3  GLY   3           3HA      GLY   3  -0.213   2.546  -5.357
   26    H    ARG   4           H        ARG   4   0.003   3.129  -2.527
   27    HA   ARG   4           HA       ARG   4  -2.191   4.912  -2.293
   28    HB2  ARG   4           2HB      ARG   4  -0.532   3.289  -0.467
   29    HB3  ARG   4           3HB      ARG   4  -1.267   4.716   0.253
   30    HG2  ARG   4           2HG      ARG   4  -2.740   2.891   0.610
   31    HG3  ARG   4           3HG      ARG   4  -3.469   3.922  -0.623
   32    HD2  ARG   4           2HD      ARG   4  -1.721   1.787  -1.641
   33    HD3  ARG   4           3HD      ARG   4  -3.188   1.234  -0.836
   34    HE   ARG   4           HE       ARG   4  -3.002   2.577  -3.371
   35   HH11  ARG   4          1HH1      ARG   4  -5.050   1.867  -0.647
   36   HH12  ARG   4          2HH1      ARG   4  -6.524   2.086  -1.532
   37   HH21  ARG   4          1HH2      ARG   4  -4.934   2.867  -4.547
   38   HH22  ARG   4          2HH2      ARG   4  -6.456   2.653  -3.750
   39    H    ILE   5           H        ILE   5   1.273   5.225  -1.690
   40    HA   ILE   5           HA       ILE   5   0.987   7.951  -0.748
   41    HB   ILE   5           HB       ILE   5   2.706   6.457   0.218
   42   HG12  ILE   5          2HG1      ILE   5   4.503   8.415  -0.938
   43   HG13  ILE   5          3HG1      ILE   5   2.952   9.143  -0.533
   44   HG21  ILE   5          1HG2      ILE   5   3.249   5.261  -1.876
   45   HG22  ILE   5          2HG2      ILE   5   4.074   6.707  -2.456
   46   HG23  ILE   5          3HG2      ILE   5   4.679   5.858  -1.034
   47   HD11  ILE   5          3HD1      ILE   5   4.587   9.315   1.283
   48   HD12  ILE   5          1HD1      ILE   5   3.160   8.391   1.750
   49   HD13  ILE   5          2HD1      ILE   5   4.664   7.555   1.363
   50    H    ASP   6           H        ASP   6   1.492   6.324  -3.720
   51    HA   ASP   6           HA       ASP   6   2.905   8.357  -5.108
   52    HB2  ASP   6           2HB      ASP   6   1.540   5.839  -5.787
   53    HB3  ASP   6           3HB      ASP   6   1.532   7.043  -7.073
   54    H    ALA   7           H        ALA   7  -0.506   7.694  -4.571
   55    HA   ALA   7           HA       ALA   7  -1.607   9.452  -6.444
   56    HB1  ALA   7           1HB      ALA   7  -2.568   7.784  -4.419
   57    HB2  ALA   7           2HB      ALA   7  -3.174   9.394  -4.031
   58    HB3  ALA   7           3HB      ALA   7  -3.514   8.681  -5.607
   59    HA   PRO   8           HA       PRO   8  -1.636  12.815  -2.966
   60    HB2  PRO   8           2HB      PRO   8  -0.131  12.326  -0.761
   61    HB3  PRO   8           3HB      PRO   8  -1.826  11.844  -0.893
   62    HG2  PRO   8           2HG      PRO   8   0.646  10.203  -1.291
   63    HG3  PRO   8           3HG      PRO   8  -0.852   9.781  -0.441
   64    HD2  PRO   8           2HD      PRO   8  -0.315   8.936  -2.957
   65    HD3  PRO   8           3HD      PRO   8  -1.965   9.275  -2.395
   66    H    ASP   9           H        ASP   9   1.300  10.962  -3.505
   67    HA   ASP   9           HA       ASP   9   3.036  13.248  -3.245
   68    HB2  ASP   9           2HB      ASP   9   3.814  10.978  -2.670
   69    HB3  ASP   9           3HB      ASP   9   3.608  10.490  -4.350
   70    H    PHE  10           H        PHE  10   1.099  11.900  -5.699
   71    HA   PHE  10           HA       PHE  10   2.543  12.486  -8.011
   72    HB2  PHE  10           2HB      PHE  10  -0.040  11.581  -7.399
   73    HB3  PHE  10           3HB      PHE  10  -0.275  13.034  -8.365
   74    HD1  PHE  10           HD2      PHE  10   1.356  13.148 -10.486
   75    HD2  PHE  10           HD1      PHE  10   0.092   9.592  -8.518
   76    HE1  PHE  10           HE2      PHE  10   1.806  11.859 -12.533
   77    HE2  PHE  10           HE1      PHE  10   0.541   8.297 -10.561
   78    HZ   PHE  10           HZ       PHE  10   1.398   9.430 -12.573
   79    HA   PRO  11           HA       PRO  11   0.420  16.838  -7.981
   80    HB2  PRO  11           2HB      PRO  11  -0.730  17.621  -5.650
   81    HB3  PRO  11           3HB      PRO  11  -1.610  16.748  -6.909
   82    HG2  PRO  11           2HG      PRO  11  -0.380  15.704  -4.387
   83    HG3  PRO  11           3HG      PRO  11  -1.953  15.317  -5.109
   84    HD2  PRO  11           2HD      PRO  11   0.202  13.697  -5.358
   85    HD3  PRO  11           3HD      PRO  11  -1.037  13.839  -6.621
   86    H    SER  12           H        SER  12   1.992  15.635  -5.086
   87    HA   SER  12           HA       SER  12   3.189  18.181  -4.437
   88    HB2  SER  12           2HB      SER  12   2.674  15.843  -3.018
   89    HB3  SER  12           3HB      SER  12   4.430  15.868  -3.177
   90    HG   SER  12           HG       SER  12   3.351  17.048  -1.335
   91    H    SER  13           H        SER  13   3.905  15.549  -6.482
   92    HA   SER  13           HA       SER  13   6.692  15.503  -6.469
   93    HB2  SER  13           2HB      SER  13   4.691  14.254  -7.925
   94    HB3  SER  13           3HB      SER  13   5.558  15.189  -9.143
   95    HG   SER  13           HG       SER  13   6.501  13.132  -7.473
   96    HA   PRO  14           HA       PRO  14   6.525  18.890  -9.934
   97    HB2  PRO  14           2HB      PRO  14   4.200  20.271 -10.165
   98    HB3  PRO  14           3HB      PRO  14   4.533  18.793 -11.075
   99    HG2  PRO  14           2HG      PRO  14   2.932  19.156  -8.572
  100    HG3  PRO  14           3HG      PRO  14   2.566  18.173 -10.002
  101    HD2  PRO  14           2HD      PRO  14   3.569  17.111  -7.723
  102    HD3  PRO  14           3HD      PRO  14   3.944  16.453  -9.328
  103    H    ALA  15           H        ALA  15   4.904  19.268  -6.874
  104    HA   ALA  15           HA       ALA  15   5.483  22.084  -6.637
  105    HB1  ALA  15           1HB      ALA  15   4.626  21.800  -4.321
  106    HB2  ALA  15           2HB      ALA  15   3.501  21.259  -5.568
  107    HB3  ALA  15           3HB      ALA  15   4.433  20.078  -4.648
  108    H    ILE  16           H        ILE  16   6.772  19.063  -5.315
  109    HA   ILE  16           HA       ILE  16   8.728  20.355  -3.676
  110    HB   ILE  16           HB       ILE  16   7.817  18.063  -3.237
  111   HG12  ILE  16          2HG1      ILE  16  10.126  17.080  -2.696
  112   HG13  ILE  16          3HG1      ILE  16  10.787  18.538  -3.426
  113   HG21  ILE  16          1HG2      ILE  16   9.647  17.276  -5.501
  114   HG22  ILE  16          2HG2      ILE  16   8.766  16.173  -4.446
  115   HG23  ILE  16          3HG2      ILE  16   7.884  17.238  -5.540
  116   HD11  ILE  16          3HD1      ILE  16  10.183  19.843  -1.689
  117   HD12  ILE  16          1HD1      ILE  16   8.722  18.915  -1.352
  118   HD13  ILE  16          2HD1      ILE  16  10.293  18.311  -0.823
  119    H    LEU  17           H        LEU  17   8.675  19.005  -6.917
  120    HA   LEU  17           HA       LEU  17  11.508  19.165  -7.306
  121    HB2  LEU  17           2HB      LEU  17   9.636  17.758  -8.533
  122    HB3  LEU  17           3HB      LEU  17   9.612  19.162  -9.598
  123    HG   LEU  17           HG       LEU  17  11.023  17.365 -10.475
  124   HD11  LEU  17          1HD1      LEU  17  12.907  19.526  -9.643
  125   HD12  LEU  17          2HD1      LEU  17  11.524  19.912 -10.667
  126   HD13  LEU  17          3HD1      LEU  17  12.721  18.736 -11.209
  127   HD21  LEU  17          3HD2      LEU  17  12.621  16.300  -9.306
  128   HD22  LEU  17          1HD2      LEU  17  11.731  16.890  -7.903
  129   HD23  LEU  17          2HD2      LEU  17  13.145  17.770  -8.483
  130    H    GLY  18           H        GLY  18   8.767  21.268  -7.886
  131    HA2  GLY  18           2HA      GLY  18  10.294  23.146  -9.468
  132    HA3  GLY  18           3HA      GLY  18   8.638  23.348  -8.913
  133    H    LYS  19           H        LYS  19   9.425  22.752  -6.114
  134    HA   LYS  19           HA       LYS  19  10.120  25.451  -5.383
  135    HB2  LYS  19           2HB      LYS  19   9.387  22.978  -3.836
  136    HB3  LYS  19           3HB      LYS  19   9.975  24.421  -3.019
  137    HG2  LYS  19           2HG      LYS  19   8.118  25.691  -3.699
  138    HG3  LYS  19           3HG      LYS  19   7.635  24.489  -4.898
  139    HD2  LYS  19           2HD      LYS  19   6.281  23.598  -3.374
  140    HD3  LYS  19           3HD      LYS  19   7.706  23.141  -2.437
  141    HE2  LYS  19           2HE      LYS  19   7.648  25.392  -1.376
  142    HE3  LYS  19           3HE      LYS  19   6.135  25.706  -2.223
  143    HZ1  LYS  19           3HZ      LYS  19   6.160  24.758   0.203
  144    HZ2  LYS  19           1HZ      LYS  19   6.333  23.278  -0.598
  145    HZ3  LYS  19           2HZ      LYS  19   4.991  24.259  -0.912
  146    H    ALA  20           H        ALA  20  11.697  22.335  -5.486
  147    HA   ALA  20           HA       ALA  20  13.922  22.978  -3.858
  148    HB1  ALA  20           1HB      ALA  20  14.036  20.762  -4.085
  149    HB2  ALA  20           2HB      ALA  20  13.105  20.782  -5.583
  150    HB3  ALA  20           3HB      ALA  20  14.844  21.076  -5.621
  151    H    ALA  21           H        ALA  21  13.260  23.347  -7.296
  152    HA   ALA  21           HA       ALA  21  15.906  24.078  -8.039
  153    HB1  ALA  21           1HB      ALA  21  13.808  23.308  -9.465
  154    HB2  ALA  21           2HB      ALA  21  13.596  25.052  -9.627
  155    HB3  ALA  21           3HB      ALA  21  15.098  24.293 -10.156
  156    H    THR  22           H        THR  22  13.033  25.893  -7.085
  157    HA   THR  22           HA       THR  22  14.272  28.451  -7.558
  158    HB   THR  22           HB       THR  22  11.707  27.766  -6.108
  159    HG1  THR  22           HG1      THR  22  12.024  28.884  -8.703
  160   HG21  THR  22          3HG2      THR  22  12.848  30.409  -7.008
  161   HG22  THR  22          1HG2      THR  22  12.468  29.914  -5.360
  162   HG23  THR  22          2HG2      THR  22  11.169  30.175  -6.524
  163    H    ASP  23           H        ASP  23  14.031  26.213  -4.938
  164    HA   ASP  23           HA       ASP  23  14.581  28.092  -2.846
  165    HB2  ASP  23           2HB      ASP  23  13.435  26.085  -2.234
  166    HB3  ASP  23           3HB      ASP  23  14.676  25.077  -2.972
  167    H    VAL  24           H        VAL  24  16.496  25.889  -4.823
  168    HA   VAL  24           HA       VAL  24  18.938  26.282  -3.415
  169    HB   VAL  24           HB       VAL  24  18.482  25.331  -6.247
  170   HG11  VAL  24          1HG1      VAL  24  20.905  25.849  -4.705
  171   HG12  VAL  24          2HG1      VAL  24  20.826  24.215  -5.369
  172   HG13  VAL  24          3HG1      VAL  24  20.693  25.611  -6.440
  173   HG21  VAL  24          3HG2      VAL  24  17.728  24.106  -3.912
  174   HG22  VAL  24          1HG2      VAL  24  18.042  23.289  -5.444
  175   HG23  VAL  24          2HG2      VAL  24  19.312  23.396  -4.225
  176    H    VAL  25           H        VAL  25  17.388  27.870  -6.137
  177    HA   VAL  25           HA       VAL  25  19.640  29.410  -6.938
  178    HB   VAL  25           HB       VAL  25  16.699  29.936  -7.395
  179   HG11  VAL  25          1HG1      VAL  25  19.183  31.201  -8.506
  180   HG12  VAL  25          2HG1      VAL  25  17.656  31.224  -9.392
  181   HG13  VAL  25          3HG1      VAL  25  17.765  31.978  -7.800
  182   HG21  VAL  25          3HG2      VAL  25  16.739  28.454  -9.070
  183   HG22  VAL  25          1HG2      VAL  25  18.312  29.011  -9.639
  184   HG23  VAL  25          2HG2      VAL  25  18.214  27.838  -8.326
  185    H    ALA  26           H        ALA  26  16.984  29.939  -4.690
  186    HA   ALA  26           HA       ALA  26  17.702  32.683  -4.184
  187    HB1  ALA  26           1HB      ALA  26  15.852  30.943  -2.565
  188    HB2  ALA  26           2HB      ALA  26  15.903  32.706  -2.621
  189    HB3  ALA  26           3HB      ALA  26  15.366  31.794  -4.032
  190    H    ALA  27           H        ALA  27  18.304  29.557  -2.722
  191    HA   ALA  27           HA       ALA  27  19.234  30.390  -0.217
  192    HB1  ALA  27           1HB      ALA  27  20.099  27.995  -1.833
  193    HB2  ALA  27           2HB      ALA  27  20.362  28.225  -0.104
  194    HB3  ALA  27           3HB      ALA  27  18.723  28.061  -0.733
  195    H    TRP  28           H        TRP  28  20.631  30.694  -3.331
  196    HA   TRP  28           HA       TRP  28  23.363  30.691  -2.723
  197    HB2  TRP  28           2HB      TRP  28  21.819  31.135  -4.988
  198    HB3  TRP  28           3HB      TRP  28  22.638  32.673  -4.733
  199    HD1  TRP  28           HD1      TRP  28  24.882  32.825  -5.933
  200    HE1  TRP  28           HE1      TRP  28  26.679  31.159  -6.721
  201    HE3  TRP  28           HE3      TRP  28  22.801  28.496  -4.181
  202    HZ2  TRP  28           HZ2      TRP  28  27.152  28.378  -6.613
  203    HZ3  TRP  28           HZ3      TRP  28  23.990  26.377  -4.565
  204    HH2  TRP  28           HH2      TRP  28  26.120  26.321  -5.757
  205    H    LYS  29           H        LYS  29  20.891  33.038  -2.112
  206    HA   LYS  29           HA       LYS  29  22.630  35.271  -1.720
  207    HB2  LYS  29           2HB      LYS  29  20.712  36.446  -0.978
  208    HB3  LYS  29           3HB      LYS  29  20.150  35.368  -2.250
  209    HG2  LYS  29           2HG      LYS  29  19.688  33.775  -0.187
  210    HG3  LYS  29           3HG      LYS  29  19.604  35.320   0.663
  211    HD2  LYS  29           2HD      LYS  29  18.136  35.168  -1.892
  212    HD3  LYS  29           3HD      LYS  29  17.502  34.175  -0.577
  213    HE2  LYS  29           2HE      LYS  29  18.222  37.004   0.000
  214    HE3  LYS  29           3HE      LYS  29  16.746  36.685  -0.910
  215    HZ1  LYS  29           3HZ      LYS  29  16.810  36.751   1.725
  216    HZ2  LYS  29           1HZ      LYS  29  17.163  35.111   1.506
  217    HZ3  LYS  29           2HZ      LYS  29  15.737  35.761   0.870
  218    H    SER  30           H        SER  30  21.359  32.718   0.307
  219    HA   SER  30           HA       SER  30  21.896  33.823   2.824
  220    HB2  SER  30           2HB      SER  30  20.541  31.847   2.677
  221    HB3  SER  30           3HB      SER  30  21.839  30.946   1.892
  222    HG   SER  30           HG       SER  30  21.613  31.763   4.579
  Start of MODEL   10
    1    H1   VAL   1           H        VAL   1   1.643  -0.987   0.550
    2    HA   VAL   1           HA       VAL   1   2.965  -0.740  -1.418
    3    HB   VAL   1           HB       VAL   1   1.310  -0.418  -3.261
    4   HG11  VAL   1          1HG1      VAL   1   1.621  -2.513  -1.579
    5   HG12  VAL   1          2HG1      VAL   1  -0.110  -2.211  -1.412
    6   HG13  VAL   1          3HG1      VAL   1   0.581  -2.532  -3.003
    7   HG21  VAL   1          3HG2      VAL   1  -1.005  -0.410  -1.498
    8   HG22  VAL   1          1HG2      VAL   1  -0.063   1.078  -1.396
    9   HG23  VAL   1          2HG2      VAL   1  -0.688   0.535  -2.953
   10    H    LYS   2           H        LYS   2   3.423   0.619  -3.355
   11    HA   LYS   2           HA       LYS   2   3.976   3.318  -2.514
   12    HB2  LYS   2           2HB      LYS   2   5.352   3.482  -4.419
   13    HB3  LYS   2           3HB      LYS   2   5.523   1.816  -3.882
   14    HG2  LYS   2           2HG      LYS   2   5.227   1.430  -6.089
   15    HG3  LYS   2           3HG      LYS   2   3.530   1.470  -5.607
   16    HD2  LYS   2           2HD      LYS   2   3.429   2.930  -7.349
   17    HD3  LYS   2           3HD      LYS   2   3.870   4.068  -6.074
   18    HE2  LYS   2           2HE      LYS   2   6.082   4.190  -6.776
   19    HE3  LYS   2           3HE      LYS   2   5.988   2.666  -7.658
   20    HZ1  LYS   2           3HZ      LYS   2   4.171   4.142  -8.950
   21    HZ2  LYS   2           1HZ      LYS   2   5.790   4.010  -9.423
   22    HZ3  LYS   2           2HZ      LYS   2   5.282   5.339  -8.510
   23    H    GLY   3           H        GLY   3   1.521   1.731  -4.297
   24    HA2  GLY   3           2HA      GLY   3   0.732   3.838  -6.016
   25    HA3  GLY   3           3HA      GLY   3  -0.278   2.493  -5.505
   26    H    ARG   4           H        ARG   4  -0.103   3.045  -2.687
   27    HA   ARG   4           HA       ARG   4  -2.257   4.867  -2.453
   28    HB2  ARG   4           2HB      ARG   4  -0.468   3.533  -0.429
   29    HB3  ARG   4           3HB      ARG   4  -1.750   4.639   0.044
   30    HG2  ARG   4           2HG      ARG   4  -2.206   2.173  -1.616
   31    HG3  ARG   4           3HG      ARG   4  -2.348   2.218   0.143
   32    HD2  ARG   4           2HD      ARG   4  -3.825   4.319  -1.288
   33    HD3  ARG   4           3HD      ARG   4  -4.393   2.676  -1.579
   34    HE   ARG   4           HE       ARG   4  -4.006   3.295   1.202
   35   HH11  ARG   4          1HH1      ARG   4  -6.218   3.419  -1.484
   36   HH12  ARG   4          2HH1      ARG   4  -7.633   3.466  -0.484
   37   HH21  ARG   4          1HH2      ARG   4  -5.861   3.357   2.528
   38   HH22  ARG   4          2HH2      ARG   4  -7.429   3.432   1.797
   39    H    ILE   5           H        ILE   5   1.207   5.129  -1.821
   40    HA   ILE   5           HA       ILE   5   0.952   7.857  -0.878
   41    HB   ILE   5           HB       ILE   5   3.430   7.801  -0.742
   42   HG12  ILE   5          2HG1      ILE   5   3.251   4.872  -1.414
   43   HG13  ILE   5          3HG1      ILE   5   3.570   6.078  -2.656
   44   HG21  ILE   5          1HG2      ILE   5   1.546   6.428   0.820
   45   HG22  ILE   5          2HG2      ILE   5   2.952   5.372   0.702
   46   HG23  ILE   5          3HG2      ILE   5   3.133   7.016   1.313
   47   HD11  ILE   5          3HD1      ILE   5   5.461   4.797  -1.185
   48   HD12  ILE   5          1HD1      ILE   5   5.692   6.333  -2.019
   49   HD13  ILE   5          2HD1      ILE   5   5.283   6.314  -0.303
   50    H    ASP   6           H        ASP   6   1.449   6.232  -3.850
   51    HA   ASP   6           HA       ASP   6   2.905   8.245  -5.224
   52    HB2  ASP   6           2HB      ASP   6   2.907   6.031  -6.132
   53    HB3  ASP   6           3HB      ASP   6   1.147   5.990  -6.196
   54    H    ALA   7           H        ALA   7  -0.518   7.636  -4.705
   55    HA   ALA   7           HA       ALA   7  -1.581   9.411  -6.584
   56    HB1  ALA   7           1HB      ALA   7  -2.551   8.109  -4.118
   57    HB2  ALA   7           2HB      ALA   7  -3.437   9.538  -4.653
   58    HB3  ALA   7           3HB      ALA   7  -3.258   8.156  -5.733
   59    HA   PRO   8           HA       PRO   8  -1.575  12.772  -3.105
   60    HB2  PRO   8           2HB      PRO   8  -0.086  12.259  -0.894
   61    HB3  PRO   8           3HB      PRO   8  -1.787  11.802  -1.033
   62    HG2  PRO   8           2HG      PRO   8   0.662  10.126  -1.422
   63    HG3  PRO   8           3HG      PRO   8  -0.846   9.725  -0.579
   64    HD2  PRO   8           2HD      PRO   8  -0.312   8.873  -3.093
   65    HD3  PRO   8           3HD      PRO   8  -1.959   9.237  -2.537
   66    H    ASP   9           H        ASP   9   1.338  10.875  -3.625
   67    HA   ASP   9           HA       ASP   9   3.105  13.137  -3.362
   68    HB2  ASP   9           2HB      ASP   9   3.507  10.282  -4.246
   69    HB3  ASP   9           3HB      ASP   9   4.803  11.474  -4.298
   70    H    PHE  10           H        PHE  10   1.160  11.814  -5.823
   71    HA   PHE  10           HA       PHE  10   2.622  12.375  -8.130
   72    HB2  PHE  10           2HB      PHE  10   0.030  11.502  -7.532
   73    HB3  PHE  10           3HB      PHE  10  -0.192  12.968  -8.482
   74    HD1  PHE  10           HD1      PHE  10   1.568  13.061 -10.558
   75    HD2  PHE  10           HD2      PHE  10   0.006   9.554  -8.722
   76    HE1  PHE  10           HE1      PHE  10   2.001  11.793 -12.621
   77    HE2  PHE  10           HE2      PHE  10   0.438   8.279 -10.781
   78    HZ   PHE  10           HZ       PHE  10   1.437   9.398 -12.734
   79    HA   PRO  11           HA       PRO  11   0.572  16.761  -8.117
   80    HB2  PRO  11           2HB      PRO  11  -0.584  17.565  -5.796
   81    HB3  PRO  11           3HB      PRO  11  -1.468  16.705  -7.062
   82    HG2  PRO  11           2HG      PRO  11  -0.276  15.645  -4.529
   83    HG3  PRO  11           3HG      PRO  11  -1.849  15.282  -5.262
   84    HD2  PRO  11           2HD      PRO  11   0.281  13.627  -5.493
   85    HD3  PRO  11           3HD      PRO  11  -0.945  13.787  -6.766
   86    H    SER  12           H        SER  12   2.137  15.515  -5.246
   87    HA   SER  12           HA       SER  12   3.352  18.047  -4.565
   88    HB2  SER  12           2HB      SER  12   2.818  15.692  -3.173
   89    HB3  SER  12           3HB      SER  12   4.575  15.716  -3.324
   90    HG   SER  12           HG       SER  12   2.913  17.736  -2.226
   91    H    SER  13           H        SER  13   4.053  15.401  -6.611
   92    HA   SER  13           HA       SER  13   6.840  15.354  -6.604
   93    HB2  SER  13           2HB      SER  13   5.945  13.619  -7.839
   94    HB3  SER  13           3HB      SER  13   4.739  14.649  -8.609
   95    HG   SER  13           HG       SER  13   7.294  14.048  -9.396
   96    HA   PRO  14           HA       PRO  14   6.660  18.726 -10.084
   97    HB2  PRO  14           2HB      PRO  14   4.340  20.119 -10.296
   98    HB3  PRO  14           3HB      PRO  14   4.657  18.636 -11.205
   99    HG2  PRO  14           2HG      PRO  14   3.082  19.015  -8.687
  100    HG3  PRO  14           3HG      PRO  14   2.696  18.030 -10.111
  101    HD2  PRO  14           2HD      PRO  14   3.717  16.969  -7.838
  102    HD3  PRO  14           3HD      PRO  14   4.072  16.304  -9.445
  103    H    ALA  15           H        ALA  15   5.027  19.145  -7.026
  104    HA   ALA  15           HA       ALA  15   5.651  21.949  -6.801
  105    HB1  ALA  15           1HB      ALA  15   5.010  20.633  -4.300
  106    HB2  ALA  15           2HB      ALA  15   4.163  21.930  -5.145
  107    HB3  ALA  15           3HB      ALA  15   3.848  20.248  -5.571
  108    H    ILE  16           H        ILE  16   6.925  18.915  -5.509
  109    HA   ILE  16           HA       ILE  16   8.861  20.152  -3.819
  110    HB   ILE  16           HB       ILE  16   8.568  17.337  -4.847
  111   HG12  ILE  16          2HG1      ILE  16   8.397  18.368  -2.017
  112   HG13  ILE  16          3HG1      ILE  16   7.000  18.321  -3.087
  113   HG21  ILE  16          1HG2      ILE  16  10.704  18.483  -3.062
  114   HG22  ILE  16          2HG2      ILE  16  10.347  16.761  -3.176
  115   HG23  ILE  16          3HG2      ILE  16  10.915  17.638  -4.596
  116   HD11  ILE  16          3HD1      ILE  16   8.207  16.216  -1.541
  117   HD12  ILE  16          1HD1      ILE  16   6.648  16.260  -2.364
  118   HD13  ILE  16          2HD1      ILE  16   8.098  15.775  -3.245
  119    H    LEU  17           H        LEU  17   8.925  18.796  -7.081
  120    HA   LEU  17           HA       LEU  17  11.734  19.098  -7.439
  121    HB2  LEU  17           2HB      LEU  17  10.352  17.516  -8.727
  122    HB3  LEU  17           3HB      LEU  17   9.554  18.879  -9.510
  123    HG   LEU  17           HG       LEU  17  12.497  18.772  -9.761
  124   HD11  LEU  17          1HD1      LEU  17  12.577  17.044 -11.341
  125   HD12  LEU  17          2HD1      LEU  17  10.820  16.942 -11.450
  126   HD13  LEU  17          3HD1      LEU  17  11.647  16.382  -9.996
  127   HD21  LEU  17          3HD2      LEU  17  10.827  20.433 -10.796
  128   HD22  LEU  17          1HD2      LEU  17  10.447  19.127 -11.918
  129   HD23  LEU  17          2HD2      LEU  17  12.090  19.762 -11.829
  130    H    GLY  18           H        GLY  18   8.948  21.145  -7.984
  131    HA2  GLY  18           2HA      GLY  18  10.428  23.102  -9.510
  132    HA3  GLY  18           3HA      GLY  18   8.771  23.252  -8.944
  133    H    LYS  19           H        LYS  19   9.568  22.602  -6.166
  134    HA   LYS  19           HA       LYS  19  10.218  25.292  -5.364
  135    HB2  LYS  19           2HB      LYS  19   9.494  22.770  -3.902
  136    HB3  LYS  19           3HB      LYS  19  10.104  24.168  -3.026
  137    HG2  LYS  19           2HG      LYS  19   8.265  25.510  -3.744
  138    HG3  LYS  19           3HG      LYS  19   7.711  24.249  -4.848
  139    HD2  LYS  19           2HD      LYS  19   6.306  23.856  -3.090
  140    HD3  LYS  19           3HD      LYS  19   7.658  22.827  -2.614
  141    HE2  LYS  19           2HE      LYS  19   7.555  25.683  -1.733
  142    HE3  LYS  19           3HE      LYS  19   6.606  24.462  -0.886
  143    HZ1  LYS  19           3HZ      LYS  19   8.609  24.539   0.263
  144    HZ2  LYS  19           1HZ      LYS  19   9.542  24.657  -1.143
  145    HZ3  LYS  19           2HZ      LYS  19   8.796  23.192  -0.744
  146    H    ALA  20           H        ALA  20  11.842  22.201  -5.531
  147    HA   ALA  20           HA       ALA  20  14.056  22.845  -3.891
  148    HB1  ALA  20           1HB      ALA  20  13.271  20.672  -5.658
  149    HB2  ALA  20           2HB      ALA  20  15.005  20.993  -5.695
  150    HB3  ALA  20           3HB      ALA  20  14.208  20.636  -4.163
  151    H    ALA  21           H        ALA  21  13.388  23.278  -7.319
  152    HA   ALA  21           HA       ALA  21  16.025  24.062  -8.046
  153    HB1  ALA  21           1HB      ALA  21  15.213  24.008 -10.119
  154    HB2  ALA  21           2HB      ALA  21  13.696  23.457  -9.409
  155    HB3  ALA  21           3HB      ALA  21  13.945  25.172  -9.735
  156    H    THR  22           H        THR  22  13.125  25.813  -7.055
  157    HA   THR  22           HA       THR  22  14.324  28.399  -7.474
  158    HB   THR  22           HB       THR  22  11.769  27.641  -6.045
  159    HG1  THR  22           HG1      THR  22  12.440  28.209  -8.703
  160   HG21  THR  22          3HG2      THR  22  11.180  30.024  -6.313
  161   HG22  THR  22          1HG2      THR  22  12.803  30.339  -6.927
  162   HG23  THR  22          2HG2      THR  22  12.579  29.794  -5.264
  163    H    ASP  23           H        ASP  23  14.117  26.104  -4.901
  164    HA   ASP  23           HA       ASP  23  14.639  27.947  -2.771
  165    HB2  ASP  23           2HB      ASP  23  14.519  24.973  -3.043
  166    HB3  ASP  23           3HB      ASP  23  15.318  25.659  -1.630
  167    H    VAL  24           H        VAL  24  16.587  25.814  -4.792
  168    HA   VAL  24           HA       VAL  24  19.022  26.215  -3.376
  169    HB   VAL  24           HB       VAL  24  18.580  25.315  -6.226
  170   HG11  VAL  24          1HG1      VAL  24  20.870  24.317  -5.939
  171   HG12  VAL  24          2HG1      VAL  24  20.825  26.078  -6.042
  172   HG13  VAL  24          3HG1      VAL  24  21.031  25.290  -4.477
  173   HG21  VAL  24          3HG2      VAL  24  17.886  24.033  -3.881
  174   HG22  VAL  24          1HG2      VAL  24  18.125  23.271  -5.453
  175   HG23  VAL  24          2HG2      VAL  24  19.450  23.328  -4.291
  176    H    VAL  25           H        VAL  25  17.452  27.831  -6.070
  177    HA   VAL  25           HA       VAL  25  19.680  29.422  -6.836
  178    HB   VAL  25           HB       VAL  25  16.733  29.910  -7.289
  179   HG11  VAL  25          1HG1      VAL  25  19.175  31.169  -8.527
  180   HG12  VAL  25          2HG1      VAL  25  17.542  31.327  -9.176
  181   HG13  VAL  25          3HG1      VAL  25  17.922  31.967  -7.577
  182   HG21  VAL  25          3HG2      VAL  25  16.800  28.471  -9.002
  183   HG22  VAL  25          1HG2      VAL  25  18.376  29.050  -9.541
  184   HG23  VAL  25          2HG2      VAL  25  18.270  27.850  -8.253
  185    H    ALA  26           H        ALA  26  17.014  29.863  -4.582
  186    HA   ALA  26           HA       ALA  26  17.685  32.609  -4.021
  187    HB1  ALA  26           1HB      ALA  26  15.710  32.703  -2.963
  188    HB2  ALA  26           2HB      ALA  26  15.407  31.150  -3.743
  189    HB3  ALA  26           3HB      ALA  26  15.996  31.203  -2.082
  190    H    ALA  27           H        ALA  27  18.340  29.466  -2.620
  191    HA   ALA  27           HA       ALA  27  19.254  30.265  -0.098
  192    HB1  ALA  27           1HB      ALA  27  18.871  27.977  -0.369
  193    HB2  ALA  27           2HB      ALA  27  19.864  27.889  -1.825
  194    HB3  ALA  27           3HB      ALA  27  20.626  28.109  -0.250
  195    H    TRP  28           H        TRP  28  20.647  30.654  -3.205
  196    HA   TRP  28           HA       TRP  28  23.378  30.687  -2.594
  197    HB2  TRP  28           2HB      TRP  28  21.874  31.083  -4.860
  198    HB3  TRP  28           3HB      TRP  28  22.541  32.687  -4.571
  199    HD1  TRP  28           HD1      TRP  28  23.501  29.224  -5.743
  200    HE1  TRP  28           HE1      TRP  28  25.952  29.241  -6.529
  201    HE3  TRP  28           HE3      TRP  28  24.857  33.862  -4.072
  202    HZ2  TRP  28           HZ2      TRP  28  28.167  30.989  -6.450
  203    HZ3  TRP  28           HZ3      TRP  28  27.161  34.631  -4.468
  204    HH2  TRP  28           HH2      TRP  28  28.780  33.223  -5.632
  205    H    LYS  29           H        LYS  29  20.866  32.979  -1.942
  206    HA   LYS  29           HA       LYS  29  22.564  35.234  -1.505
  207    HB2  LYS  29           2HB      LYS  29  20.626  36.359  -0.739
  208    HB3  LYS  29           3HB      LYS  29  20.083  35.297  -2.031
  209    HG2  LYS  29           2HG      LYS  29  19.652  33.654  -0.001
  210    HG3  LYS  29           3HG      LYS  29  19.541  35.180   0.881
  211    HD2  LYS  29           2HD      LYS  29  18.042  34.812  -1.683
  212    HD3  LYS  29           3HD      LYS  29  17.401  34.147  -0.178
  213    HE2  LYS  29           2HE      LYS  29  18.211  36.776   0.398
  214    HE3  LYS  29           3HE      LYS  29  17.354  36.851  -1.141
  215    HZ1  LYS  29           3HZ      LYS  29  16.275  36.612   1.427
  216    HZ2  LYS  29           1HZ      LYS  29  15.918  35.184   0.591
  217    HZ3  LYS  29           2HZ      LYS  29  15.452  36.678  -0.050
  218    H    SER  30           H        SER  30  21.342  32.619   0.473
  219    HA   SER  30           HA       SER  30  22.007  33.756   2.990
  220    HB2  SER  30           2HB      SER  30  20.460  31.720   2.391
  221    HB3  SER  30           3HB      SER  30  21.950  30.791   2.550
  222    HG   SER  30           HG       SER  30  20.363  31.781   4.477
  Start of MODEL   11
    1    H1   VAL   1           H        VAL   1   1.020  -1.007  -0.158
    2    HA   VAL   1           HA       VAL   1   3.174  -0.736  -1.475
    3    HB   VAL   1           HB       VAL   1   2.052  -0.603  -3.716
    4   HG11  VAL   1          1HG1      VAL   1   1.300  -2.510  -1.563
    5   HG12  VAL   1          2HG1      VAL   1   0.472  -2.633  -3.116
    6   HG13  VAL   1          3HG1      VAL   1   2.228  -2.778  -3.038
    7   HG21  VAL   1          3HG2      VAL   1  -0.386  -0.552  -3.794
    8   HG22  VAL   1          1HG2      VAL   1  -0.445  -0.308  -2.048
    9   HG23  VAL   1          2HG2      VAL   1   0.251   0.934  -3.089
   10    H    LYS   2           H        LYS   2   3.588   0.624  -3.653
   11    HA   LYS   2           HA       LYS   2   4.102   3.303  -2.728
   12    HB2  LYS   2           2HB      LYS   2   5.486   3.542  -4.619
   13    HB3  LYS   2           3HB      LYS   2   5.676   1.862  -4.131
   14    HG2  LYS   2           2HG      LYS   2   5.398   1.539  -6.350
   15    HG3  LYS   2           3HG      LYS   2   3.697   1.543  -5.878
   16    HD2  LYS   2           2HD      LYS   2   3.588   3.055  -7.576
   17    HD3  LYS   2           3HD      LYS   2   4.007   4.159  -6.264
   18    HE2  LYS   2           2HE      LYS   2   6.284   4.205  -6.910
   19    HE3  LYS   2           3HE      LYS   2   6.077   2.836  -8.001
   20    HZ1  LYS   2           3HZ      LYS   2   4.605   4.248  -9.358
   21    HZ2  LYS   2           1HZ      LYS   2   6.184   4.850  -9.267
   22    HZ3  LYS   2           2HZ      LYS   2   4.954   5.562  -8.350
   23    H    GLY   3           H        GLY   3   1.677   1.740  -4.574
   24    HA2  GLY   3           2HA      GLY   3   0.872   3.888  -6.232
   25    HA3  GLY   3           3HA      GLY   3  -0.124   2.517  -5.769
   26    H    ARG   4           H        ARG   4   0.028   2.985  -2.934
   27    HA   ARG   4           HA       ARG   4  -2.150   4.772  -2.660
   28    HB2  ARG   4           2HB      ARG   4  -0.340   3.494  -0.607
   29    HB3  ARG   4           3HB      ARG   4  -1.760   4.447  -0.196
   30    HG2  ARG   4           2HG      ARG   4  -1.827   1.967  -1.899
   31    HG3  ARG   4           3HG      ARG   4  -2.126   1.992  -0.160
   32    HD2  ARG   4           2HD      ARG   4  -3.691   3.957  -1.652
   33    HD3  ARG   4           3HD      ARG   4  -4.026   2.289  -2.114
   34    HE   ARG   4           HE       ARG   4  -4.011   2.726   0.728
   35   HH11  ARG   4          1HH1      ARG   4  -5.927   2.821  -2.177
   36   HH12  ARG   4          2HH1      ARG   4  -7.435   2.635  -1.344
   37   HH21  ARG   4          1HH2      ARG   4  -5.989   2.480   1.836
   38   HH22  ARG   4          2HH2      ARG   4  -7.469   2.442   0.939
   39    H    ILE   5           H        ILE   5   1.307   5.058  -1.998
   40    HA   ILE   5           HA       ILE   5   1.011   7.753  -0.975
   41    HB   ILE   5           HB       ILE   5   3.490   7.723  -0.827
   42   HG12  ILE   5          2HG1      ILE   5   3.351   4.812  -1.583
   43   HG13  ILE   5          3HG1      ILE   5   3.659   6.057  -2.789
   44   HG21  ILE   5          1HG2      ILE   5   1.643   6.441   0.750
   45   HG22  ILE   5          2HG2      ILE   5   2.872   5.203   0.497
   46   HG23  ILE   5          3HG2      ILE   5   3.322   6.764   1.184
   47   HD11  ILE   5          3HD1      ILE   5   5.803   5.749  -2.292
   48   HD12  ILE   5          1HD1      ILE   5   5.464   6.674  -0.829
   49   HD13  ILE   5          2HD1      ILE   5   5.428   4.911  -0.786
   50    H    ASP   6           H        ASP   6   1.546   6.224  -3.992
   51    HA   ASP   6           HA       ASP   6   2.985   8.296  -5.295
   52    HB2  ASP   6           2HB      ASP   6   3.036   6.130  -6.288
   53    HB3  ASP   6           3HB      ASP   6   1.278   6.031  -6.326
   54    H    ALA   7           H        ALA   7  -0.433   7.629  -4.816
   55    HA   ALA   7           HA       ALA   7  -1.508   9.447  -6.648
   56    HB1  ALA   7           1HB      ALA   7  -3.177   8.153  -5.848
   57    HB2  ALA   7           2HB      ALA   7  -2.476   8.053  -4.233
   58    HB3  ALA   7           3HB      ALA   7  -3.372   9.493  -4.718
   59    HA   PRO   8           HA       PRO   8  -1.564  12.702  -3.069
   60    HB2  PRO   8           2HB      PRO   8  -0.081  12.141  -0.865
   61    HB3  PRO   8           3HB      PRO   8  -1.776  11.667  -1.028
   62    HG2  PRO   8           2HG      PRO   8   0.696  10.033  -1.453
   63    HG3  PRO   8           3HG      PRO   8  -0.811   9.589  -0.631
   64    HD2  PRO   8           2HD      PRO   8  -0.252   8.820  -3.166
   65    HD3  PRO   8           3HD      PRO   8  -1.906   9.146  -2.610
   66    H    ASP   9           H        ASP   9   1.376  10.857  -3.628
   67    HA   ASP   9           HA       ASP   9   3.112  13.132  -3.286
   68    HB2  ASP   9           2HB      ASP   9   3.556  10.310  -4.253
   69    HB3  ASP   9           3HB      ASP   9   4.836  11.519  -4.261
   70    H    PHE  10           H        PHE  10   1.199  11.860  -5.797
   71    HA   PHE  10           HA       PHE  10   2.667  12.507  -8.077
   72    HB2  PHE  10           2HB      PHE  10   0.109  11.551  -7.542
   73    HB3  PHE  10           3HB      PHE  10  -0.171  13.070  -8.386
   74    HD1  PHE  10           HD1      PHE  10   2.244  10.239  -8.708
   75    HD2  PHE  10           HD2      PHE  10  -0.555  12.810 -10.623
   76    HE1  PHE  10           HE1      PHE  10   2.692   9.122 -10.854
   77    HE2  PHE  10           HE2      PHE  10  -0.112  11.697 -12.772
   78    HZ   PHE  10           HZ       PHE  10   1.513   9.849 -12.889
   79    HA   PRO  11           HA       PRO  11   0.562  16.866  -7.946
   80    HB2  PRO  11           2HB      PRO  11  -0.617  17.586  -5.609
   81    HB3  PRO  11           3HB      PRO  11  -1.483  16.753  -6.905
   82    HG2  PRO  11           2HG      PRO  11  -0.292  15.631  -4.398
   83    HG3  PRO  11           3HG      PRO  11  -1.857  15.272  -5.152
   84    HD2  PRO  11           2HD      PRO  11   0.296  13.651  -5.418
   85    HD3  PRO  11           3HD      PRO  11  -0.925  13.834  -6.694
   86    H    SER  12           H        SER  12   2.126  15.553  -5.104
   87    HA   SER  12           HA       SER  12   3.306  18.078  -4.339
   88    HB2  SER  12           2HB      SER  12   4.247  15.430  -3.290
   89    HB3  SER  12           3HB      SER  12   4.123  16.979  -2.456
   90    HG   SER  12           HG       SER  12   2.042  15.197  -3.163
   91    H    SER  13           H        SER  13   4.052  15.504  -6.460
   92    HA   SER  13           HA       SER  13   6.839  15.491  -6.437
   93    HB2  SER  13           2HB      SER  13   5.973  13.783  -7.729
   94    HB3  SER  13           3HB      SER  13   4.758  14.821  -8.475
   95    HG   SER  13           HG       SER  13   7.226  14.190  -9.353
   96    HA   PRO  14           HA       PRO  14   6.637  18.964  -9.816
   97    HB2  PRO  14           2HB      PRO  14   4.300  20.334 -10.000
   98    HB3  PRO  14           3HB      PRO  14   4.641  18.883 -10.951
   99    HG2  PRO  14           2HG      PRO  14   3.047  19.166  -8.433
  100    HG3  PRO  14           3HG      PRO  14   2.682  18.220  -9.887
  101    HD2  PRO  14           2HD      PRO  14   3.703  17.104  -7.641
  102    HD3  PRO  14           3HD      PRO  14   4.076  16.492  -9.266
  103    H    ALA  15           H        ALA  15   4.981  19.270  -6.756
  104    HA   ALA  15           HA       ALA  15   5.568  22.074  -6.444
  105    HB1  ALA  15           1HB      ALA  15   4.228  19.982  -4.819
  106    HB2  ALA  15           2HB      ALA  15   4.872  21.394  -3.980
  107    HB3  ALA  15           3HB      ALA  15   3.679  21.599  -5.263
  108    H    ILE  16           H        ILE  16   6.873  19.019  -5.235
  109    HA   ILE  16           HA       ILE  16   8.784  20.228  -3.497
  110    HB   ILE  16           HB       ILE  16   8.532  17.441  -4.610
  111   HG12  ILE  16          2HG1      ILE  16   6.892  18.157  -2.901
  112   HG13  ILE  16          3HG1      ILE  16   7.938  16.868  -2.317
  113   HG21  ILE  16          1HG2      ILE  16  10.643  18.560  -2.779
  114   HG22  ILE  16          2HG2      ILE  16  10.308  16.838  -2.946
  115   HG23  ILE  16          3HG2      ILE  16  10.874  17.764  -4.336
  116   HD11  ILE  16          3HD1      ILE  16   9.131  19.357  -1.657
  117   HD12  ILE  16          1HD1      ILE  16   7.440  19.390  -1.159
  118   HD13  ILE  16          2HD1      ILE  16   8.505  18.107  -0.583
  119    H    LEU  17           H        LEU  17   8.883  18.972  -6.798
  120    HA   LEU  17           HA       LEU  17  11.690  19.319  -7.130
  121    HB2  LEU  17           2HB      LEU  17  10.176  17.795  -8.459
  122    HB3  LEU  17           3HB      LEU  17   9.619  19.234  -9.310
  123    HG   LEU  17           HG       LEU  17  12.539  18.810  -9.282
  124   HD11  LEU  17          1HD1      LEU  17  10.675  16.755 -10.213
  125   HD12  LEU  17          2HD1      LEU  17  12.399  16.652  -9.859
  126   HD13  LEU  17          3HD1      LEU  17  11.854  17.270 -11.418
  127   HD21  LEU  17          3HD2      LEU  17  11.148  20.604 -10.495
  128   HD22  LEU  17          1HD2      LEU  17  10.747  19.316 -11.631
  129   HD23  LEU  17          2HD2      LEU  17  12.430  19.789 -11.392
  130    H    GLY  18           H        GLY  18   8.881  21.347  -7.630
  131    HA2  GLY  18           2HA      GLY  18  10.345  23.367  -9.087
  132    HA3  GLY  18           3HA      GLY  18   8.683  23.479  -8.527
  133    H    LYS  19           H        LYS  19   9.473  22.756  -5.765
  134    HA   LYS  19           HA       LYS  19  10.084  25.429  -4.880
  135    HB2  LYS  19           2HB      LYS  19   9.393  22.855  -3.492
  136    HB3  LYS  19           3HB      LYS  19   9.967  24.242  -2.577
  137    HG2  LYS  19           2HG      LYS  19   8.090  25.514  -3.086
  138    HG3  LYS  19           3HG      LYS  19   7.659  24.499  -4.464
  139    HD2  LYS  19           2HD      LYS  19   6.536  23.030  -3.183
  140    HD3  LYS  19           3HD      LYS  19   7.739  23.089  -1.892
  141    HE2  LYS  19           2HE      LYS  19   6.167  25.545  -2.216
  142    HE3  LYS  19           3HE      LYS  19   5.227  24.133  -1.738
  143    HZ1  LYS  19           3HZ      LYS  19   7.233  25.612  -0.251
  144    HZ2  LYS  19           1HZ      LYS  19   7.299  23.929  -0.086
  145    HZ3  LYS  19           2HZ      LYS  19   5.880  24.762   0.304
  146    H    ALA  20           H        ALA  20  11.748  22.364  -5.129
  147    HA   ALA  20           HA       ALA  20  13.945  22.987  -3.457
  148    HB1  ALA  20           1HB      ALA  20  13.443  20.956  -5.590
  149    HB2  ALA  20           2HB      ALA  20  15.069  21.167  -4.938
  150    HB3  ALA  20           3HB      ALA  20  13.740  20.725  -3.867
  151    H    ALA  21           H        ALA  21  13.291  23.512  -6.875
  152    HA   ALA  21           HA       ALA  21  15.921  24.351  -7.563
  153    HB1  ALA  21           1HB      ALA  21  13.557  23.803  -8.940
  154    HB2  ALA  21           2HB      ALA  21  13.899  25.504  -9.259
  155    HB3  ALA  21           3HB      ALA  21  15.110  24.276  -9.629
  156    H    THR  22           H        THR  22  12.994  26.034  -6.537
  157    HA   THR  22           HA       THR  22  14.162  28.647  -6.874
  158    HB   THR  22           HB       THR  22  11.621  27.852  -5.438
  159    HG1  THR  22           HG1      THR  22  11.721  29.075  -7.975
  160   HG21  THR  22          3HG2      THR  22  11.168  30.360  -6.200
  161   HG22  THR  22          1HG2      THR  22  12.920  30.458  -6.031
  162   HG23  THR  22          2HG2      THR  22  11.927  29.976  -4.655
  163    H    ASP  23           H        ASP  23  13.971  26.275  -4.370
  164    HA   ASP  23           HA       ASP  23  14.459  28.062  -2.185
  165    HB2  ASP  23           2HB      ASP  23  13.348  25.924  -1.803
  166    HB3  ASP  23           3HB      ASP  23  14.764  25.059  -2.392
  167    H    VAL  24           H        VAL  24  16.442  26.012  -4.257
  168    HA   VAL  24           HA       VAL  24  18.865  26.404  -2.815
  169    HB   VAL  24           HB       VAL  24  18.450  25.570  -5.690
  170   HG11  VAL  24          1HG1      VAL  24  20.894  25.402  -3.931
  171   HG12  VAL  24          2HG1      VAL  24  20.735  24.660  -5.524
  172   HG13  VAL  24          3HG1      VAL  24  20.694  26.416  -5.360
  173   HG21  VAL  24          3HG2      VAL  24  17.732  24.221  -3.404
  174   HG22  VAL  24          1HG2      VAL  24  18.044  23.490  -4.978
  175   HG23  VAL  24          2HG2      VAL  24  19.326  23.560  -3.768
  176    H    VAL  25           H        VAL  25  17.297  28.060  -5.489
  177    HA   VAL  25           HA       VAL  25  19.512  29.703  -6.185
  178    HB   VAL  25           HB       VAL  25  16.565  30.148  -6.683
  179   HG11  VAL  25          1HG1      VAL  25  17.776  31.440  -8.688
  180   HG12  VAL  25          2HG1      VAL  25  17.342  32.221  -7.166
  181   HG13  VAL  25          3HG1      VAL  25  18.993  31.661  -7.431
  182   HG21  VAL  25          3HG2      VAL  25  16.688  28.737  -8.414
  183   HG22  VAL  25          1HG2      VAL  25  18.254  29.367  -8.926
  184   HG23  VAL  25          2HG2      VAL  25  18.168  28.140  -7.663
  185    H    ALA  26           H        ALA  26  16.790  30.056  -3.980
  186    HA   ALA  26           HA       ALA  26  17.409  32.799  -3.348
  187    HB1  ALA  26           1HB      ALA  26  15.733  31.697  -1.361
  188    HB2  ALA  26           2HB      ALA  26  15.290  32.764  -2.695
  189    HB3  ALA  26           3HB      ALA  26  15.228  31.014  -2.907
  190    H    ALA  27           H        ALA  27  18.135  29.642  -2.044
  191    HA   ALA  27           HA       ALA  27  19.152  30.653   0.457
  192    HB1  ALA  27           1HB      ALA  27  19.625  27.912  -0.686
  193    HB2  ALA  27           2HB      ALA  27  19.640  28.408   1.006
  194    HB3  ALA  27           3HB      ALA  27  18.120  28.369   0.112
  195    H    TRP  28           H        TRP  28  20.474  29.627  -2.639
  196    HA   TRP  28           HA       TRP  28  23.197  29.635  -1.850
  197    HB2  TRP  28           2HB      TRP  28  22.550  28.435  -3.835
  198    HB3  TRP  28           3HB      TRP  28  21.895  29.898  -4.565
  199    HD1  TRP  28           HD1      TRP  28  23.508  31.316  -6.007
  200    HE1  TRP  28           HE1      TRP  28  26.016  31.191  -6.575
  201    HE3  TRP  28           HE3      TRP  28  24.913  27.691  -2.687
  202    HZ2  TRP  28           HZ2      TRP  28  28.288  29.746  -5.729
  203    HZ3  TRP  28           HZ3      TRP  28  27.272  26.994  -2.630
  204    HH2  TRP  28           HH2      TRP  28  28.923  28.001  -4.121
  205    H    LYS  29           H        LYS  29  21.073  32.078  -3.260
  206    HA   LYS  29           HA       LYS  29  23.129  34.030  -3.602
  207    HB2  LYS  29           2HB      LYS  29  21.261  35.595  -4.003
  208    HB3  LYS  29           3HB      LYS  29  21.115  34.123  -4.955
  209    HG2  LYS  29           2HG      LYS  29  18.970  34.358  -4.215
  210    HG3  LYS  29           3HG      LYS  29  19.635  33.339  -2.937
  211    HD2  LYS  29           2HD      LYS  29  19.103  34.885  -1.432
  212    HD3  LYS  29           3HD      LYS  29  20.151  36.045  -2.252
  213    HE2  LYS  29           2HE      LYS  29  18.395  36.893  -3.543
  214    HE3  LYS  29           3HE      LYS  29  17.372  35.491  -3.234
  215    HZ1  LYS  29           3HZ      LYS  29  18.183  37.421  -1.133
  216    HZ2  LYS  29           1HZ      LYS  29  17.026  36.194  -1.007
  217    HZ3  LYS  29           2HZ      LYS  29  16.733  37.534  -1.997
  218    H    SER  30           H        SER  30  20.988  33.127  -1.008
  219    HA   SER  30           HA       SER  30  21.094  35.459   0.538
  220    HB2  SER  30           2HB      SER  30  19.966  34.252   2.101
  221    HB3  SER  30           3HB      SER  30  19.826  33.077   0.794
  222    HG   SER  30           HG       SER  30  21.488  33.056   3.047
  Start of MODEL   12
    1    H1   VAL   1           H        VAL   1   1.412  -1.163  -0.200
    2    HA   VAL   1           HA       VAL   1   3.169  -0.780  -1.876
    3    HB   VAL   1           HB       VAL   1   1.720  -0.430  -3.913
    4   HG11  VAL   1          1HG1      VAL   1   0.850  -2.590  -3.826
    5   HG12  VAL   1          2HG1      VAL   1   2.182  -2.634  -2.669
    6   HG13  VAL   1          3HG1      VAL   1   0.519  -2.491  -2.097
    7   HG21  VAL   1          3HG2      VAL   1  -0.365   0.345  -3.761
    8   HG22  VAL   1          1HG2      VAL   1  -0.766  -0.790  -2.472
    9   HG23  VAL   1          2HG2      VAL   1   0.000   0.751  -2.084
   10    H    LYS   2           H        LYS   2   3.621   0.681  -3.825
   11    HA   LYS   2           HA       LYS   2   4.063   3.344  -2.817
   12    HB2  LYS   2           2HB      LYS   2   5.498   3.654  -4.655
   13    HB3  LYS   2           3HB      LYS   2   5.695   1.962  -4.219
   14    HG2  LYS   2           2HG      LYS   2   5.484   1.716  -6.457
   15    HG3  LYS   2           3HG      LYS   2   3.772   1.674  -6.029
   16    HD2  LYS   2           2HD      LYS   2   3.413   3.859  -6.752
   17    HD3  LYS   2           3HD      LYS   2   5.128   4.268  -6.674
   18    HE2  LYS   2           2HE      LYS   2   5.504   2.647  -8.548
   19    HE3  LYS   2           3HE      LYS   2   3.753   2.496  -8.687
   20    HZ1  LYS   2           3HZ      LYS   2   5.215   5.068  -8.920
   21    HZ2  LYS   2           1HZ      LYS   2   3.576   4.793  -9.239
   22    HZ3  LYS   2           2HZ      LYS   2   4.758   4.119 -10.243
   23    H    GLY   3           H        GLY   3   1.713   1.789  -4.759
   24    HA2  GLY   3           2HA      GLY   3   0.913   3.947  -6.399
   25    HA3  GLY   3           3HA      GLY   3  -0.081   2.564  -5.966
   26    H    ARG   4           H        ARG   4   0.027   3.013  -3.122
   27    HA   ARG   4           HA       ARG   4  -2.173   4.778  -2.869
   28    HB2  ARG   4           2HB      ARG   4  -0.394   3.428  -0.843
   29    HB3  ARG   4           3HB      ARG   4  -1.739   4.461  -0.378
   30    HG2  ARG   4           2HG      ARG   4  -2.026   2.035  -2.132
   31    HG3  ARG   4           3HG      ARG   4  -2.238   2.018  -0.380
   32    HD2  ARG   4           2HD      ARG   4  -3.748   4.099  -1.807
   33    HD3  ARG   4           3HD      ARG   4  -4.233   2.443  -2.168
   34    HE   ARG   4           HE       ARG   4  -4.765   3.877   0.215
   35   HH11  ARG   4          1HH1      ARG   4  -3.959   0.701  -0.962
   36   HH12  ARG   4          2HH1      ARG   4  -4.719  -0.124   0.359
   37   HH21  ARG   4          1HH2      ARG   4  -5.769   2.803   1.959
   38   HH22  ARG   4          2HH2      ARG   4  -5.749   1.073   2.019
   39    H    ILE   5           H        ILE   5   1.271   5.088  -2.147
   40    HA   ILE   5           HA       ILE   5   0.935   7.775  -1.113
   41    HB   ILE   5           HB       ILE   5   2.633   6.246  -0.154
   42   HG12  ILE   5          2HG1      ILE   5   4.148   8.512  -1.392
   43   HG13  ILE   5          3HG1      ILE   5   2.782   8.869  -0.341
   44   HG21  ILE   5          1HG2      ILE   5   4.149   6.659  -2.723
   45   HG22  ILE   5          2HG2      ILE   5   4.619   5.666  -1.345
   46   HG23  ILE   5          3HG2      ILE   5   3.241   5.196  -2.340
   47   HD11  ILE   5          3HD1      ILE   5   5.185   7.227   0.420
   48   HD12  ILE   5          1HD1      ILE   5   4.908   8.912   0.856
   49   HD13  ILE   5          2HD1      ILE   5   3.836   7.654   1.471
   50    H    ASP   6           H        ASP   6   1.537   6.268  -4.128
   51    HA   ASP   6           HA       ASP   6   2.985   8.356  -5.392
   52    HB2  ASP   6           2HB      ASP   6   3.085   6.224  -6.423
   53    HB3  ASP   6           3HB      ASP   6   1.331   6.065  -6.442
   54    H    ALA   7           H        ALA   7  -0.437   7.665  -4.984
   55    HA   ALA   7           HA       ALA   7  -1.487   9.492  -6.821
   56    HB1  ALA   7           1HB      ALA   7  -2.487   7.797  -4.779
   57    HB2  ALA   7           2HB      ALA   7  -3.192   9.398  -4.552
   58    HB3  ALA   7           3HB      ALA   7  -3.368   8.568  -6.098
   59    HA   PRO   8           HA       PRO   8  -1.635  12.716  -3.216
   60    HB2  PRO   8           2HB      PRO   8  -0.195  12.144  -0.987
   61    HB3  PRO   8           3HB      PRO   8  -1.883  11.663  -1.189
   62    HG2  PRO   8           2HG      PRO   8   0.607  10.047  -1.576
   63    HG3  PRO   8           3HG      PRO   8  -0.915   9.587  -0.790
   64    HD2  PRO   8           2HD      PRO   8  -0.300   8.842  -3.319
   65    HD3  PRO   8           3HD      PRO   8  -1.967   9.154  -2.794
   66    H    ASP   9           H        ASP   9   1.324  10.893  -3.737
   67    HA   ASP   9           HA       ASP   9   3.042  13.173  -3.337
   68    HB2  ASP   9           2HB      ASP   9   3.747  10.818  -2.860
   69    HB3  ASP   9           3HB      ASP   9   3.718  10.507  -4.593
   70    H    PHE  10           H        PHE  10   1.186  11.914  -5.898
   71    HA   PHE  10           HA       PHE  10   2.696  12.592  -8.142
   72    HB2  PHE  10           2HB      PHE  10   0.131  11.618  -7.665
   73    HB3  PHE  10           3HB      PHE  10  -0.136  13.139  -8.510
   74    HD1  PHE  10           HD1      PHE  10   2.191  10.228  -8.763
   75    HD2  PHE  10           HD2      PHE  10  -0.359  12.977 -10.778
   76    HE1  PHE  10           HE1      PHE  10   2.693   9.120 -10.903
   77    HE2  PHE  10           HE2      PHE  10   0.138  11.873 -12.920
   78    HZ   PHE  10           HZ       PHE  10   1.665   9.942 -12.984
   79    HA   PRO  11           HA       PRO  11   0.557  16.935  -8.009
   80    HB2  PRO  11           2HB      PRO  11  -0.665  17.625  -5.686
   81    HB3  PRO  11           3HB      PRO  11  -1.504  16.799  -7.004
   82    HG2  PRO  11           2HG      PRO  11  -0.347  15.662  -4.488
   83    HG3  PRO  11           3HG      PRO  11  -1.896  15.299  -5.271
   84    HD2  PRO  11           2HD      PRO  11   0.271  13.695  -5.516
   85    HD3  PRO  11           3HD      PRO  11  -0.930  13.882  -6.810
   86    H    SER  12           H        SER  12   2.055  15.621  -5.124
   87    HA   SER  12           HA       SER  12   3.218  18.145  -4.338
   88    HB2  SER  12           2HB      SER  12   2.680  16.647  -2.554
   89    HB3  SER  12           3HB      SER  12   3.549  15.318  -3.321
   90    HG   SER  12           HG       SER  12   4.690  17.700  -2.277
   91    H    SER  13           H        SER  13   4.008  15.592  -6.458
   92    HA   SER  13           HA       SER  13   6.795  15.566  -6.368
   93    HB2  SER  13           2HB      SER  13   6.436  14.015  -7.942
   94    HB3  SER  13           3HB      SER  13   4.753  14.524  -8.068
   95    HG   SER  13           HG       SER  13   5.309  15.153  -9.992
   96    HA   PRO  14           HA       PRO  14   6.688  19.071  -9.718
   97    HB2  PRO  14           2HB      PRO  14   4.360  20.448  -9.950
   98    HB3  PRO  14           3HB      PRO  14   4.722  19.005 -10.905
   99    HG2  PRO  14           2HG      PRO  14   3.064  19.270  -8.426
  100    HG3  PRO  14           3HG      PRO  14   2.735  18.338  -9.898
  101    HD2  PRO  14           2HD      PRO  14   3.694  17.199  -7.637
  102    HD3  PRO  14           3HD      PRO  14   4.107  16.601  -9.256
  103    H    ALA  15           H        ALA  15   4.975  19.343  -6.691
  104    HA   ALA  15           HA       ALA  15   5.549  22.146  -6.339
  105    HB1  ALA  15           1HB      ALA  15   4.518  20.111  -4.367
  106    HB2  ALA  15           2HB      ALA  15   4.564  21.857  -4.123
  107    HB3  ALA  15           3HB      ALA  15   3.531  21.169  -5.376
  108    H    ILE  16           H        ILE  16   6.806  19.082  -5.090
  109    HA   ILE  16           HA       ILE  16   8.714  20.319  -3.354
  110    HB   ILE  16           HB       ILE  16   7.786  18.009  -3.026
  111   HG12  ILE  16          2HG1      ILE  16  10.063  17.020  -2.407
  112   HG13  ILE  16          3HG1      ILE  16  10.765  18.482  -3.092
  113   HG21  ILE  16          1HG2      ILE  16   7.945  17.258  -5.346
  114   HG22  ILE  16          2HG2      ILE  16   9.704  17.313  -5.246
  115   HG23  ILE  16          3HG2      ILE  16   8.801  16.165  -4.259
  116   HD11  ILE  16          3HD1      ILE  16   9.576  18.048  -0.511
  117   HD12  ILE  16          1HD1      ILE  16  10.537  19.406  -1.096
  118   HD13  ILE  16          2HD1      ILE  16   8.792  19.383  -1.354
  119    H    LEU  17           H        LEU  17   8.743  19.095  -6.642
  120    HA   LEU  17           HA       LEU  17  11.587  19.256  -6.949
  121    HB2  LEU  17           2HB      LEU  17   9.310  18.927  -8.881
  122    HB3  LEU  17           3HB      LEU  17  10.985  19.055  -9.413
  123    HG   LEU  17           HG       LEU  17  10.138  16.944  -7.457
  124   HD11  LEU  17          1HD1      LEU  17   9.380  15.529  -9.073
  125   HD12  LEU  17          2HD1      LEU  17  10.312  16.307 -10.352
  126   HD13  LEU  17          3HD1      LEU  17   8.834  17.062  -9.754
  127   HD21  LEU  17          3HD2      LEU  17  12.102  16.045  -9.226
  128   HD22  LEU  17          1HD2      LEU  17  12.317  16.520  -7.541
  129   HD23  LEU  17          2HD2      LEU  17  12.556  17.703  -8.827
  130    H    GLY  18           H        GLY  18   8.867  21.387  -7.524
  131    HA2  GLY  18           2HA      GLY  18  10.441  23.316  -8.994
  132    HA3  GLY  18           3HA      GLY  18   8.771  23.503  -8.480
  133    H    LYS  19           H        LYS  19   9.476  22.804  -5.683
  134    HA   LYS  19           HA       LYS  19  10.154  25.473  -4.835
  135    HB2  LYS  19           2HB      LYS  19   9.280  22.959  -3.464
  136    HB3  LYS  19           3HB      LYS  19   9.990  24.256  -2.513
  137    HG2  LYS  19           2HG      LYS  19   8.231  25.683  -2.888
  138    HG3  LYS  19           3HG      LYS  19   7.761  24.882  -4.389
  139    HD2  LYS  19           2HD      LYS  19   6.458  23.384  -3.326
  140    HD3  LYS  19           3HD      LYS  19   7.590  23.201  -1.984
  141    HE2  LYS  19           2HE      LYS  19   5.530  24.170  -1.179
  142    HE3  LYS  19           3HE      LYS  19   6.822  25.366  -1.083
  143    HZ1  LYS  19           3HZ      LYS  19   4.980  25.244  -3.394
  144    HZ2  LYS  19           1HZ      LYS  19   5.978  26.522  -2.912
  145    HZ3  LYS  19           2HZ      LYS  19   4.607  26.132  -2.003
  146    H    ALA  20           H        ALA  20  11.730  22.360  -5.012
  147    HA   ALA  20           HA       ALA  20  13.907  22.935  -3.297
  148    HB1  ALA  20           1HB      ALA  20  14.985  21.001  -4.329
  149    HB2  ALA  20           2HB      ALA  20  13.305  20.653  -3.919
  150    HB3  ALA  20           3HB      ALA  20  13.753  20.984  -5.592
  151    H    ALA  21           H        ALA  21  13.345  23.438  -6.735
  152    HA   ALA  21           HA       ALA  21  16.013  24.191  -7.373
  153    HB1  ALA  21           1HB      ALA  21  13.836  25.291  -9.025
  154    HB2  ALA  21           2HB      ALA  21  15.273  24.382  -9.494
  155    HB3  ALA  21           3HB      ALA  21  13.863  23.535  -8.857
  156    H    THR  22           H        THR  22  13.116  25.975  -6.433
  157    HA   THR  22           HA       THR  22  14.372  28.546  -6.769
  158    HB   THR  22           HB       THR  22  11.788  27.887  -5.342
  159    HG1  THR  22           HG1      THR  22  12.196  28.732  -8.035
  160   HG21  THR  22          3HG2      THR  22  13.108  30.426  -6.214
  161   HG22  THR  22          1HG2      THR  22  12.287  30.055  -4.699
  162   HG23  THR  22          2HG2      THR  22  11.348  30.324  -6.167
  163    H    ASP  23           H        ASP  23  14.051  26.209  -4.247
  164    HA   ASP  23           HA       ASP  23  14.542  28.003  -2.068
  165    HB2  ASP  23           2HB      ASP  23  14.409  25.030  -2.390
  166    HB3  ASP  23           3HB      ASP  23  15.128  25.704  -0.930
  167    H    VAL  24           H        VAL  24  16.509  25.876  -4.075
  168    HA   VAL  24           HA       VAL  24  18.910  26.209  -2.580
  169    HB   VAL  24           HB       VAL  24  18.535  25.355  -5.454
  170   HG11  VAL  24          1HG1      VAL  24  20.793  26.120  -5.116
  171   HG12  VAL  24          2HG1      VAL  24  20.933  25.171  -3.635
  172   HG13  VAL  24          3HG1      VAL  24  20.790  24.358  -5.194
  173   HG21  VAL  24          3HG2      VAL  24  17.818  24.055  -3.089
  174   HG22  VAL  24          1HG2      VAL  24  17.941  23.349  -4.700
  175   HG23  VAL  24          2HG2      VAL  24  19.321  23.290  -3.604
  176    H    VAL  25           H        VAL  25  17.453  27.882  -5.306
  177    HA   VAL  25           HA       VAL  25  19.733  29.449  -5.968
  178    HB   VAL  25           HB       VAL  25  16.812  29.977  -6.538
  179   HG11  VAL  25          1HG1      VAL  25  17.749  31.379  -8.401
  180   HG12  VAL  25          2HG1      VAL  25  17.999  32.026  -6.778
  181   HG13  VAL  25          3HG1      VAL  25  19.326  31.230  -7.626
  182   HG21  VAL  25          3HG2      VAL  25  16.929  28.526  -8.233
  183   HG22  VAL  25          1HG2      VAL  25  18.506  29.129  -8.745
  184   HG23  VAL  25          2HG2      VAL  25  18.397  27.919  -7.467
  185    H    ALA  26           H        ALA  26  16.972  29.910  -3.832
  186    HA   ALA  26           HA       ALA  26  17.661  32.639  -3.214
  187    HB1  ALA  26           1HB      ALA  26  15.797  30.993  -1.555
  188    HB2  ALA  26           2HB      ALA  26  15.729  32.712  -1.947
  189    HB3  ALA  26           3HB      ALA  26  15.323  31.511  -3.173
  190    H    ALA  27           H        ALA  27  18.259  29.476  -1.861
  191    HA   ALA  27           HA       ALA  27  19.247  30.483   0.653
  192    HB1  ALA  27           1HB      ALA  27  19.285  27.743  -0.596
  193    HB2  ALA  27           2HB      ALA  27  19.955  28.102   0.996
  194    HB3  ALA  27           3HB      ALA  27  18.233  28.330   0.692
  195    H    TRP  28           H        TRP  28  20.611  29.382  -2.400
  196    HA   TRP  28           HA       TRP  28  23.313  29.318  -1.546
  197    HB2  TRP  28           2HB      TRP  28  22.657  28.119  -3.536
  198    HB3  TRP  28           3HB      TRP  28  22.097  29.604  -4.299
  199    HD1  TRP  28           HD1      TRP  28  25.452  28.175  -2.954
  200    HE1  TRP  28           HE1      TRP  28  27.334  28.997  -4.505
  201    HE3  TRP  28           HE3      TRP  28  22.686  31.094  -6.110
  202    HZ2  TRP  28           HZ2      TRP  28  27.610  30.663  -6.768
  203    HZ3  TRP  28           HZ3      TRP  28  23.835  32.268  -7.941
  204    HH2  TRP  28           HH2      TRP  28  26.246  32.056  -8.261
  205    H    LYS  29           H        LYS  29  21.298  31.808  -3.032
  206    HA   LYS  29           HA       LYS  29  23.419  33.693  -3.344
  207    HB2  LYS  29           2HB      LYS  29  21.610  35.309  -3.806
  208    HB3  LYS  29           3HB      LYS  29  21.441  33.832  -4.746
  209    HG2  LYS  29           2HG      LYS  29  19.288  34.140  -4.060
  210    HG3  LYS  29           3HG      LYS  29  19.891  33.115  -2.755
  211    HD2  LYS  29           2HD      LYS  29  19.554  34.715  -1.239
  212    HD3  LYS  29           3HD      LYS  29  20.396  35.914  -2.224
  213    HE2  LYS  29           2HE      LYS  29  18.447  36.541  -3.338
  214    HE3  LYS  29           3HE      LYS  29  17.604  35.058  -2.896
  215    HZ1  LYS  29           3HZ      LYS  29  17.758  37.537  -1.491
  216    HZ2  LYS  29           1HZ      LYS  29  18.217  36.238  -0.508
  217    HZ3  LYS  29           2HZ      LYS  29  16.702  36.235  -1.261
  218    H    SER  30           H        SER  30  21.192  32.884  -0.793
  219    HA   SER  30           HA       SER  30  21.485  35.266   0.723
  220    HB2  SER  30           2HB      SER  30  19.631  33.565   0.972
  221    HB3  SER  30           3HB      SER  30  20.793  32.526   1.796
  222    HG   SER  30           HG       SER  30  19.896  35.094   2.595
  Start of MODEL   13
    1    H1   VAL   1           H        VAL   1   1.650  -1.584  -2.385
    2    HA   VAL   1           HA       VAL   1   0.860   0.032  -0.962
    3    HB   VAL   1           HB       VAL   1   3.658  -0.046   0.161
    4   HG11  VAL   1          1HG1      VAL   1   0.959   0.688   1.210
    5   HG12  VAL   1          2HG1      VAL   1   2.192   0.071   2.312
    6   HG13  VAL   1          3HG1      VAL   1   2.496   1.536   1.376
    7   HG21  VAL   1          3HG2      VAL   1   2.468  -1.913   1.609
    8   HG22  VAL   1          1HG2      VAL   1   1.526  -2.117   0.132
    9   HG23  VAL   1          2HG2      VAL   1   3.280  -2.299   0.092
   10    H    LYS   2           H        LYS   2   3.261   0.804  -3.126
   11    HA   LYS   2           HA       LYS   2   3.760   3.508  -2.265
   12    HB2  LYS   2           2HB      LYS   2   5.161   3.702  -4.151
   13    HB3  LYS   2           3HB      LYS   2   5.355   2.040  -3.608
   14    HG2  LYS   2           2HG      LYS   2   5.102   1.644  -5.819
   15    HG3  LYS   2           3HG      LYS   2   3.396   1.655  -5.365
   16    HD2  LYS   2           2HD      LYS   2   3.071   3.818  -6.202
   17    HD3  LYS   2           3HD      LYS   2   4.802   4.163  -6.229
   18    HE2  LYS   2           2HE      LYS   2   3.583   2.015  -7.938
   19    HE3  LYS   2           3HE      LYS   2   3.645   3.697  -8.463
   20    HZ1  LYS   2           3HZ      LYS   2   6.182   3.112  -7.582
   21    HZ2  LYS   2           1HZ      LYS   2   5.680   3.266  -9.190
   22    HZ3  LYS   2           2HZ      LYS   2   5.708   1.743  -8.456
   23    H    GLY   3           H        GLY   3   1.362   1.890  -4.099
   24    HA2  GLY   3           2HA      GLY   3   0.568   3.974  -5.834
   25    HA3  GLY   3           3HA      GLY   3  -0.440   2.632  -5.315
   26    H    ARG   4           H        ARG   4  -0.244   3.251  -2.491
   27    HA   ARG   4           HA       ARG   4  -2.427   5.052  -2.299
   28    HB2  ARG   4           2HB      ARG   4  -0.654   4.189  -0.018
   29    HB3  ARG   4           3HB      ARG   4  -2.344   4.669   0.049
   30    HG2  ARG   4           2HG      ARG   4  -1.244   2.164  -1.206
   31    HG3  ARG   4           3HG      ARG   4  -2.144   2.280   0.307
   32    HD2  ARG   4           2HD      ARG   4  -3.853   1.703  -1.080
   33    HD3  ARG   4           3HD      ARG   4  -3.916   3.454  -1.278
   34    HE   ARG   4           HE       ARG   4  -2.183   2.527  -3.214
   35   HH11  ARG   4          1HH1      ARG   4  -5.526   2.065  -2.359
   36   HH12  ARG   4          2HH1      ARG   4  -6.035   1.758  -3.986
   37   HH21  ARG   4          1HH2      ARG   4  -2.841   2.124  -5.360
   38   HH22  ARG   4          2HH2      ARG   4  -4.507   1.790  -5.693
   39    H    ILE   5           H        ILE   5   1.034   5.347  -1.670
   40    HA   ILE   5           HA       ILE   5   0.760   8.087  -0.765
   41    HB   ILE   5           HB       ILE   5   3.235   8.050  -0.619
   42   HG12  ILE   5          2HG1      ILE   5   3.051   5.122  -1.317
   43   HG13  ILE   5          3HG1      ILE   5   3.446   6.350  -2.515
   44   HG21  ILE   5          1HG2      ILE   5   2.090   5.613   0.715
   45   HG22  ILE   5          2HG2      ILE   5   3.334   6.709   1.315
   46   HG23  ILE   5          3HG2      ILE   5   1.659   7.252   1.204
   47   HD11  ILE   5          3HD1      ILE   5   5.264   4.999  -1.059
   48   HD12  ILE   5          1HD1      ILE   5   5.536   6.600  -1.749
   49   HD13  ILE   5          2HD1      ILE   5   5.051   6.437  -0.060
   50    H    ASP   6           H        ASP   6   1.279   6.419  -3.712
   51    HA   ASP   6           HA       ASP   6   2.719   8.423  -5.113
   52    HB2  ASP   6           2HB      ASP   6   1.342   5.906  -5.772
   53    HB3  ASP   6           3HB      ASP   6   1.354   7.093  -7.073
   54    H    ALA   7           H        ALA   7  -0.701   7.791  -4.598
   55    HA   ALA   7           HA       ALA   7  -1.773   9.533  -6.503
   56    HB1  ALA   7           1HB      ALA   7  -3.537   9.646  -4.377
   57    HB2  ALA   7           2HB      ALA   7  -3.552   8.468  -5.689
   58    HB3  ALA   7           3HB      ALA   7  -2.730   8.091  -4.176
   59    HA   PRO   8           HA       PRO   8  -1.808  12.942  -3.070
   60    HB2  PRO   8           2HB      PRO   8  -0.325  12.470  -0.845
   61    HB3  PRO   8           3HB      PRO   8  -2.023  11.998  -0.986
   62    HG2  PRO   8           2HG      PRO   8   0.441  10.335  -1.340
   63    HG3  PRO   8           3HG      PRO   8  -1.068   9.935  -0.499
   64    HD2  PRO   8           2HD      PRO   8  -0.516   9.053  -2.999
   65    HD3  PRO   8           3HD      PRO   8  -2.168   9.411  -2.456
   66    H    ASP   9           H        ASP   9   1.120  11.060  -3.558
   67    HA   ASP   9           HA       ASP   9   2.870  13.337  -3.313
   68    HB2  ASP   9           2HB      ASP   9   3.581  11.023  -2.720
   69    HB3  ASP   9           3HB      ASP   9   3.471  10.589  -4.424
   70    H    PHE  10           H        PHE  10   0.945  11.971  -5.766
   71    HA   PHE  10           HA       PHE  10   2.413  12.516  -8.073
   72    HB2  PHE  10           2HB      PHE  10  -0.173  11.627  -7.477
   73    HB3  PHE  10           3HB      PHE  10  -0.405  13.079  -8.445
   74    HD1  PHE  10           HD2      PHE  10   1.622   9.950  -8.425
   75    HD2  PHE  10           HD1      PHE  10  -0.433  12.877 -10.732
   76    HE1  PHE  10           HE2      PHE  10   2.078   8.655 -10.466
   77    HE2  PHE  10           HE1      PHE  10   0.019  11.587 -12.778
   78    HZ   PHE  10           HZ       PHE  10   1.276   9.473 -12.647
   79    HA   PRO  11           HA       PRO  11   0.322  16.884  -8.118
   80    HB2  PRO  11           2HB      PRO  11  -0.843  17.705  -5.808
   81    HB3  PRO  11           3HB      PRO  11  -1.719  16.822  -7.064
   82    HG2  PRO  11           2HG      PRO  11  -0.519  15.803  -4.518
   83    HG3  PRO  11           3HG      PRO  11  -2.089  15.417  -5.248
   84    HD2  PRO  11           2HD      PRO  11   0.057  13.779  -5.456
   85    HD3  PRO  11           3HD      PRO  11  -1.170  13.913  -6.733
   86    H    SER  12           H        SER  12   1.859  15.707  -5.193
   87    HA   SER  12           HA       SER  12   3.069  18.253  -4.567
   88    HB2  SER  12           2HB      SER  12   2.823  15.637  -3.287
   89    HB3  SER  12           3HB      SER  12   4.427  16.342  -3.093
   90    HG   SER  12           HG       SER  12   1.996  17.152  -2.060
   91    H    SER  13           H        SER  13   3.783  15.590  -6.572
   92    HA   SER  13           HA       SER  13   6.570  15.525  -6.533
   93    HB2  SER  13           2HB      SER  13   4.578  14.263  -7.983
   94    HB3  SER  13           3HB      SER  13   5.448  15.182  -9.210
   95    HG   SER  13           HG       SER  13   6.934  13.729  -7.341
   96    HA   PRO  14           HA       PRO  14   6.456  18.864 -10.046
   97    HB2  PRO  14           2HB      PRO  14   4.142  20.259 -10.314
   98    HB3  PRO  14           3HB      PRO  14   4.473  18.766 -11.201
   99    HG2  PRO  14           2HG      PRO  14   2.853  19.174  -8.717
  100    HG3  PRO  14           3HG      PRO  14   2.492  18.175 -10.136
  101    HD2  PRO  14           2HD      PRO  14   3.469  17.137  -7.834
  102    HD3  PRO  14           3HD      PRO  14   3.852  16.454  -9.428
  103    H    ALA  15           H        ALA  15   4.795  19.304  -7.010
  104    HA   ALA  15           HA       ALA  15   5.403  22.116  -6.806
  105    HB1  ALA  15           1HB      ALA  15   3.454  21.575  -5.680
  106    HB2  ALA  15           2HB      ALA  15   4.137  20.099  -4.995
  107    HB3  ALA  15           3HB      ALA  15   4.636  21.673  -4.374
  108    H    ILE  16           H        ILE  16   6.649  19.103  -5.428
  109    HA   ILE  16           HA       ILE  16   8.600  20.404  -3.787
  110    HB   ILE  16           HB       ILE  16   7.651  18.124  -3.329
  111   HG12  ILE  16          2HG1      ILE  16   9.926  17.143  -2.692
  112   HG13  ILE  16          3HG1      ILE  16  10.633  18.559  -3.462
  113   HG21  ILE  16          1HG2      ILE  16   9.529  17.294  -5.537
  114   HG22  ILE  16          2HG2      ILE  16   8.629  16.208  -4.479
  115   HG23  ILE  16          3HG2      ILE  16   7.768  17.253  -5.609
  116   HD11  ILE  16          3HD1      ILE  16   9.693  20.014  -1.878
  117   HD12  ILE  16          1HD1      ILE  16   8.597  18.773  -1.271
  118   HD13  ILE  16          2HD1      ILE  16  10.328  18.651  -0.957
  119    H    LEU  17           H        LEU  17   8.560  19.013  -7.008
  120    HA   LEU  17           HA       LEU  17  11.400  19.124  -7.369
  121    HB2  LEU  17           2HB      LEU  17  10.131  17.523  -8.622
  122    HB3  LEU  17           3HB      LEU  17   9.115  18.791  -9.303
  123    HG   LEU  17           HG       LEU  17  11.140  19.658 -10.493
  124   HD11  LEU  17          1HD1      LEU  17  12.675  17.291 -10.532
  125   HD12  LEU  17          2HD1      LEU  17  12.425  17.725  -8.841
  126   HD13  LEU  17          3HD1      LEU  17  13.145  18.889  -9.952
  127   HD21  LEU  17          3HD2      LEU  17   9.704  18.467 -11.864
  128   HD22  LEU  17          1HD2      LEU  17   9.977  16.950 -11.006
  129   HD23  LEU  17          2HD2      LEU  17  11.227  17.600 -12.067
  130    H    GLY  18           H        GLY  18   8.695  21.257  -8.008
  131    HA2  GLY  18           2HA      GLY  18  10.267  23.090  -9.598
  132    HA3  GLY  18           3HA      GLY  18   8.608  23.323  -9.068
  133    H    LYS  19           H        LYS  19   9.348  22.759  -6.251
  134    HA   LYS  19           HA       LYS  19  10.074  25.457  -5.551
  135    HB2  LYS  19           2HB      LYS  19   9.277  23.021  -3.978
  136    HB3  LYS  19           3HB      LYS  19   9.878  24.465  -3.174
  137    HG2  LYS  19           2HG      LYS  19   8.064  25.772  -4.017
  138    HG3  LYS  19           3HG      LYS  19   7.521  24.444  -5.045
  139    HD2  LYS  19           2HD      LYS  19   6.193  23.792  -3.383
  140    HD3  LYS  19           3HD      LYS  19   7.640  23.391  -2.454
  141    HE2  LYS  19           2HE      LYS  19   6.645  24.840  -1.000
  142    HE3  LYS  19           3HE      LYS  19   7.597  25.984  -1.946
  143    HZ1  LYS  19           3HZ      LYS  19   5.599  26.349  -3.332
  144    HZ2  LYS  19           1HZ      LYS  19   5.389  26.822  -1.721
  145    HZ3  LYS  19           2HZ      LYS  19   4.711  25.374  -2.272
  146    H    ALA  20           H        ALA  20  11.607  22.322  -5.605
  147    HA   ALA  20           HA       ALA  20  13.820  22.961  -3.950
  148    HB1  ALA  20           1HB      ALA  20  14.867  20.986  -5.261
  149    HB2  ALA  20           2HB      ALA  20  13.491  20.685  -4.199
  150    HB3  ALA  20           3HB      ALA  20  13.250  20.805  -5.942
  151    H    ALA  21           H        ALA  21  13.161  23.343  -7.373
  152    HA   ALA  21           HA       ALA  21  15.837  23.964  -8.134
  153    HB1  ALA  21           1HB      ALA  21  13.659  23.282  -9.531
  154    HB2  ALA  21           2HB      ALA  21  13.605  25.031  -9.751
  155    HB3  ALA  21           3HB      ALA  21  15.035  24.124 -10.244
  156    H    THR  22           H        THR  22  13.013  25.887  -7.228
  157    HA   THR  22           HA       THR  22  14.359  28.393  -7.696
  158    HB   THR  22           HB       THR  22  11.925  28.219  -7.993
  159    HG1  THR  22           HG1      THR  22  11.517  30.182  -7.064
  160   HG21  THR  22          3HG2      THR  22  11.717  27.997  -4.995
  161   HG22  THR  22          1HG2      THR  22  11.621  26.601  -6.068
  162   HG23  THR  22          2HG2      THR  22  10.421  27.888  -6.186
  163    H    ASP  23           H        ASP  23  13.988  26.184  -5.073
  164    HA   ASP  23           HA       ASP  23  14.531  28.050  -2.971
  165    HB2  ASP  23           2HB      ASP  23  14.353  25.069  -3.178
  166    HB3  ASP  23           3HB      ASP  23  15.091  25.788  -1.750
  167    H    VAL  24           H        VAL  24  16.452  25.820  -4.911
  168    HA   VAL  24           HA       VAL  24  18.869  26.189  -3.443
  169    HB   VAL  24           HB       VAL  24  18.461  25.191  -6.266
  170   HG11  VAL  24          1HG1      VAL  24  20.699  25.687  -6.271
  171   HG12  VAL  24          2HG1      VAL  24  20.869  25.445  -4.531
  172   HG13  VAL  24          3HG1      VAL  24  20.737  24.053  -5.607
  173   HG21  VAL  24          3HG2      VAL  24  17.946  23.183  -5.429
  174   HG22  VAL  24          1HG2      VAL  24  19.220  23.270  -4.212
  175   HG23  VAL  24          2HG2      VAL  24  17.655  24.024  -3.906
  176    H    VAL  25           H        VAL  25  17.407  27.743  -6.234
  177    HA   VAL  25           HA       VAL  25  19.698  29.234  -7.013
  178    HB   VAL  25           HB       VAL  25  16.777  29.794  -7.547
  179   HG11  VAL  25          1HG1      VAL  25  19.279  31.135  -8.377
  180   HG12  VAL  25          2HG1      VAL  25  18.049  30.905  -9.621
  181   HG13  VAL  25          3HG1      VAL  25  17.660  31.794  -8.148
  182   HG21  VAL  25          3HG2      VAL  25  18.276  27.654  -8.400
  183   HG22  VAL  25          1HG2      VAL  25  16.830  28.280  -9.191
  184   HG23  VAL  25          2HG2      VAL  25  18.426  28.797  -9.735
  185    H    ALA  26           H        ALA  26  16.999  29.849  -4.839
  186    HA   ALA  26           HA       ALA  26  17.748  32.591  -4.370
  187    HB1  ALA  26           1HB      ALA  26  16.020  31.638  -2.328
  188    HB2  ALA  26           2HB      ALA  26  15.648  32.717  -3.673
  189    HB3  ALA  26           3HB      ALA  26  15.475  30.973  -3.868
  190    H    ALA  27           H        ALA  27  18.265  29.486  -2.832
  191    HA   ALA  27           HA       ALA  27  19.150  30.356  -0.323
  192    HB1  ALA  27           1HB      ALA  27  18.609  28.025  -0.813
  193    HB2  ALA  27           2HB      ALA  27  20.022  27.914  -1.863
  194    HB3  ALA  27           3HB      ALA  27  20.229  28.177  -0.131
  195    H    TRP  28           H        TRP  28  20.622  30.577  -3.408
  196    HA   TRP  28           HA       TRP  28  23.339  30.537  -2.741
  197    HB2  TRP  28           2HB      TRP  28  22.552  30.491  -5.057
  198    HB3  TRP  28           3HB      TRP  28  21.933  32.132  -4.894
  199    HD1  TRP  28           HD1      TRP  28  23.581  34.074  -5.381
  200    HE1  TRP  28           HE1      TRP  28  26.072  34.213  -6.013
  201    HE3  TRP  28           HE3      TRP  28  24.892  29.197  -4.589
  202    HZ2  TRP  28           HZ2      TRP  28  28.298  32.484  -6.156
  203    HZ3  TRP  28           HZ3      TRP  28  27.222  28.521  -4.997
  204    HH2  TRP  28           HH2      TRP  28  28.889  30.131  -5.765
  205    H    LYS  29           H        LYS  29  20.901  32.854  -2.065
  206    HA   LYS  29           HA       LYS  29  22.541  35.157  -1.812
  207    HB2  LYS  29           2HB      LYS  29  20.659  36.178  -0.719
  208    HB3  LYS  29           3HB      LYS  29  20.057  35.197  -2.050
  209    HG2  LYS  29           2HG      LYS  29  18.585  34.563  -0.452
  210    HG3  LYS  29           3HG      LYS  29  19.859  33.385  -0.123
  211    HD2  LYS  29           2HD      LYS  29  20.170  34.207   1.922
  212    HD3  LYS  29           3HD      LYS  29  20.374  35.841   1.286
  213    HE2  LYS  29           2HE      LYS  29  18.520  36.155   2.584
  214    HE3  LYS  29           3HE      LYS  29  17.749  35.707   1.063
  215    HZ1  LYS  29           3HZ      LYS  29  18.420  33.619   3.024
  216    HZ2  LYS  29           1HZ      LYS  29  17.205  33.632   1.846
  217    HZ3  LYS  29           2HZ      LYS  29  17.032  34.559   3.250
  218    H    SER  30           H        SER  30  21.674  32.537   0.346
  219    HA   SER  30           HA       SER  30  22.661  33.769   2.722
  220    HB2  SER  30           2HB      SER  30  21.027  31.717   2.380
  221    HB3  SER  30           3HB      SER  30  22.529  30.794   2.445
  222    HG   SER  30           HG       SER  30  21.468  31.135   4.510
  Start of MODEL   14
    1    H1   VAL   1           H        VAL   1   0.297   0.809  -0.171
    2    HA   VAL   1           HA       VAL   1   2.736  -0.389  -1.307
    3    HB   VAL   1           HB       VAL   1   1.601  -0.259  -3.554
    4   HG11  VAL   1          1HG1      VAL   1  -0.080  -2.246  -2.640
    5   HG12  VAL   1          2HG1      VAL   1   1.609  -2.447  -3.112
    6   HG13  VAL   1          3HG1      VAL   1   1.190  -2.188  -1.418
    7   HG21  VAL   1          3HG2      VAL   1  -0.862  -0.266  -3.564
    8   HG22  VAL   1          1HG2      VAL   1  -0.854   0.088  -1.836
    9   HG23  VAL   1          2HG2      VAL   1  -0.200   1.261  -2.980
   10    H    LYS   2           H        LYS   2   3.165   0.919  -3.516
   11    HA   LYS   2           HA       LYS   2   3.728   3.607  -2.644
   12    HB2  LYS   2           2HB      LYS   2   5.111   3.784  -4.543
   13    HB3  LYS   2           3HB      LYS   2   5.273   2.112  -4.023
   14    HG2  LYS   2           2HG      LYS   2   4.982   1.750  -6.235
   15    HG3  LYS   2           3HG      LYS   2   3.283   1.793  -5.758
   16    HD2  LYS   2           2HD      LYS   2   3.196   3.272  -7.486
   17    HD3  LYS   2           3HD      LYS   2   3.637   4.395  -6.197
   18    HE2  LYS   2           2HE      LYS   2   5.453   4.947  -7.348
   19    HE3  LYS   2           3HE      LYS   2   6.040   3.295  -7.166
   20    HZ1  LYS   2           3HZ      LYS   2   4.977   4.607  -9.482
   21    HZ2  LYS   2           1HZ      LYS   2   4.240   3.112  -9.189
   22    HZ3  LYS   2           2HZ      LYS   2   5.919   3.206  -9.373
   23    H    GLY   3           H        GLY   3   1.271   2.050  -4.452
   24    HA2  GLY   3           2HA      GLY   3   0.498   4.179  -6.151
   25    HA3  GLY   3           3HA      GLY   3  -0.520   2.833  -5.658
   26    H    ARG   4           H        ARG   4  -0.353   3.353  -2.834
   27    HA   ARG   4           HA       ARG   4  -2.500   5.182  -2.588
   28    HB2  ARG   4           2HB      ARG   4  -0.722   4.198  -0.355
   29    HB3  ARG   4           3HB      ARG   4  -2.382   4.764  -0.230
   30    HG2  ARG   4           2HG      ARG   4  -3.076   2.819  -1.624
   31    HG3  ARG   4           3HG      ARG   4  -1.416   2.228  -1.527
   32    HD2  ARG   4           2HD      ARG   4  -1.684   2.380   1.001
   33    HD3  ARG   4           3HD      ARG   4  -3.409   2.576   0.695
   34    HE   ARG   4           HE       ARG   4  -2.605   0.320  -0.695
   35   HH11  ARG   4          1HH1      ARG   4  -2.744   1.392   2.615
   36   HH12  ARG   4          2HH1      ARG   4  -2.961  -0.202   3.259
   37   HH21  ARG   4          1HH2      ARG   4  -2.891  -1.783   0.141
   38   HH22  ARG   4          2HH2      ARG   4  -3.043  -2.007   1.851
   39    H    ILE   5           H        ILE   5   0.964   5.424  -1.941
   40    HA   ILE   5           HA       ILE   5   0.716   8.143  -0.972
   41    HB   ILE   5           HB       ILE   5   2.393   6.677   0.034
   42   HG12  ILE   5          2HG1      ILE   5   3.885   8.775  -1.526
   43   HG13  ILE   5          3HG1      ILE   5   2.710   9.215  -0.292
   44   HG21  ILE   5          1HG2      ILE   5   4.436   6.113  -1.314
   45   HG22  ILE   5          2HG2      ILE   5   2.973   5.241  -1.767
   46   HG23  ILE   5          3HG2      ILE   5   3.533   6.593  -2.750
   47   HD11  ILE   5          3HD1      ILE   5   4.082   8.661   1.389
   48   HD12  ILE   5          1HD1      ILE   5   4.718   7.248   0.546
   49   HD13  ILE   5          2HD1      ILE   5   5.339   8.855   0.167
   50    H    ASP   6           H        ASP   6   1.218   6.545  -3.958
   51    HA   ASP   6           HA       ASP   6   2.687   8.565  -5.307
   52    HB2  ASP   6           2HB      ASP   6   2.725   6.417  -6.294
   53    HB3  ASP   6           3HB      ASP   6   0.969   6.277  -6.251
   54    H    ALA   7           H        ALA   7  -0.740   7.968  -4.805
   55    HA   ALA   7           HA       ALA   7  -1.788   9.769  -6.669
   56    HB1  ALA   7           1HB      ALA   7  -3.596   8.737  -5.886
   57    HB2  ALA   7           2HB      ALA   7  -2.766   8.262  -4.403
   58    HB3  ALA   7           3HB      ALA   7  -3.537   9.844  -4.514
   59    HA   PRO   8           HA       PRO   8  -1.779  13.092  -3.153
   60    HB2  PRO   8           2HB      PRO   8  -0.300  12.547  -0.942
   61    HB3  PRO   8           3HB      PRO   8  -2.004  12.101  -1.092
   62    HG2  PRO   8           2HG      PRO   8   0.438  10.416  -1.491
   63    HG3  PRO   8           3HG      PRO   8  -1.074  10.014  -0.657
   64    HD2  PRO   8           2HD      PRO   8  -0.536   9.187  -3.179
   65    HD3  PRO   8           3HD      PRO   8  -2.182   9.552  -2.625
   66    H    ASP   9           H        ASP   9   1.125  11.186  -3.689
   67    HA   ASP   9           HA       ASP   9   2.902  13.437  -3.393
   68    HB2  ASP   9           2HB      ASP   9   3.295  10.589  -4.304
   69    HB3  ASP   9           3HB      ASP   9   4.597  11.775  -4.338
   70    H    PHE  10           H        PHE  10   0.960  12.149  -5.874
   71    HA   PHE  10           HA       PHE  10   2.435  12.725  -8.169
   72    HB2  PHE  10           2HB      PHE  10  -0.166  11.861  -7.589
   73    HB3  PHE  10           3HB      PHE  10  -0.372  13.332  -8.535
   74    HD1  PHE  10           HD1      PHE  10   0.962  13.489 -10.734
   75    HD2  PHE  10           HD2      PHE  10   0.247   9.848  -8.649
   76    HE1  PHE  10           HE1      PHE  10   1.401  12.225 -12.799
   77    HE2  PHE  10           HE2      PHE  10   0.687   8.578 -10.710
   78    HZ   PHE  10           HZ       PHE  10   1.265   9.766 -12.788
   79    HA   PRO  11           HA       PRO  11   0.398  17.119  -8.114
   80    HB2  PRO  11           2HB      PRO  11  -0.746  17.905  -5.781
   81    HB3  PRO  11           3HB      PRO  11  -1.638  17.061  -7.052
   82    HG2  PRO  11           2HG      PRO  11  -0.441  15.971  -4.534
   83    HG3  PRO  11           3HG      PRO  11  -2.018  15.622  -5.265
   84    HD2  PRO  11           2HD      PRO  11   0.105  13.961  -5.519
   85    HD3  PRO  11           3HD      PRO  11  -1.126  14.138  -6.786
   86    H    SER  12           H        SER  12   1.944  15.854  -5.234
   87    HA   SER  12           HA       SER  12   3.185  18.372  -4.554
   88    HB2  SER  12           2HB      SER  12   3.010  15.677  -3.366
   89    HB3  SER  12           3HB      SER  12   4.535  16.515  -3.081
   90    HG   SER  12           HG       SER  12   1.967  17.613  -2.573
   91    H    SER  13           H        SER  13   3.866  15.720  -6.599
   92    HA   SER  13           HA       SER  13   6.643  15.616  -6.586
   93    HB2  SER  13           2HB      SER  13   4.586  14.499  -8.118
   94    HB3  SER  13           3HB      SER  13   5.592  15.365  -9.279
   95    HG   SER  13           HG       SER  13   7.178  14.002  -8.937
   96    HA   PRO  14           HA       PRO  14   6.578  19.071  -9.989
   97    HB2  PRO  14           2HB      PRO  14   4.297  20.529 -10.185
   98    HB3  PRO  14           3HB      PRO  14   4.582  19.060 -11.126
   99    HG2  PRO  14           2HG      PRO  14   2.998  19.422  -8.611
  100    HG3  PRO  14           3HG      PRO  14   2.598  18.480 -10.060
  101    HD2  PRO  14           2HD      PRO  14   3.573  17.341  -7.805
  102    HD3  PRO  14           3HD      PRO  14   3.923  16.704  -9.425
  103    H    ALA  15           H        ALA  15   5.063  19.392  -6.886
  104    HA   ALA  15           HA       ALA  15   5.668  22.200  -6.596
  105    HB1  ALA  15           1HB      ALA  15   4.174  22.101  -4.958
  106    HB2  ALA  15           2HB      ALA  15   3.955  20.389  -5.324
  107    HB3  ALA  15           3HB      ALA  15   5.123  20.886  -4.099
  108    H    ILE  16           H        ILE  16   6.962  19.133  -5.385
  109    HA   ILE  16           HA       ILE  16   8.984  20.365  -3.781
  110    HB   ILE  16           HB       ILE  16   9.901  18.119  -3.515
  111   HG12  ILE  16          2HG1      ILE  16   7.844  17.339  -5.592
  112   HG13  ILE  16          3HG1      ILE  16   9.593  17.281  -5.781
  113   HG21  ILE  16          1HG2      ILE  16   7.930  17.045  -2.510
  114   HG22  ILE  16          2HG2      ILE  16   8.033  18.759  -2.112
  115   HG23  ILE  16          3HG2      ILE  16   6.892  18.206  -3.338
  116   HD11  ILE  16          3HD1      ILE  16   7.772  15.443  -4.359
  117   HD12  ILE  16          1HD1      ILE  16   9.226  15.106  -5.300
  118   HD13  ILE  16          2HD1      ILE  16   9.363  15.711  -3.648
  119    H    LEU  17           H        LEU  17   8.825  19.058  -7.042
  120    HA   LEU  17           HA       LEU  17  11.641  19.203  -7.519
  121    HB2  LEU  17           2HB      LEU  17   9.228  18.507  -9.035
  122    HB3  LEU  17           3HB      LEU  17  10.513  19.233  -9.998
  123    HG   LEU  17           HG       LEU  17  10.655  16.823 -10.100
  124   HD11  LEU  17          1HD1      LEU  17  12.900  17.535  -8.277
  125   HD12  LEU  17          2HD1      LEU  17  12.722  18.406  -9.800
  126   HD13  LEU  17          3HD1      LEU  17  12.921  16.654  -9.805
  127   HD21  LEU  17          3HD2      LEU  17  11.141  16.768  -7.136
  128   HD22  LEU  17          1HD2      LEU  17  10.859  15.414  -8.231
  129   HD23  LEU  17          2HD2      LEU  17   9.541  16.516  -7.834
  130    H    GLY  18           H        GLY  18   8.913  21.356  -7.969
  131    HA2  GLY  18           2HA      GLY  18  10.419  23.249  -9.551
  132    HA3  GLY  18           3HA      GLY  18   8.784  23.461  -8.943
  133    H    LYS  19           H        LYS  19   9.637  22.794  -6.183
  134    HA   LYS  19           HA       LYS  19  10.399  25.464  -5.414
  135    HB2  LYS  19           2HB      LYS  19   9.594  22.980  -3.940
  136    HB3  LYS  19           3HB      LYS  19  10.329  24.318  -3.067
  137    HG2  LYS  19           2HG      LYS  19   8.542  25.729  -3.458
  138    HG3  LYS  19           3HG      LYS  19   7.985  24.803  -4.854
  139    HD2  LYS  19           2HD      LYS  19   6.556  23.728  -3.534
  140    HD3  LYS  19           3HD      LYS  19   7.921  23.061  -2.635
  141    HE2  LYS  19           2HE      LYS  19   7.704  24.551  -0.936
  142    HE3  LYS  19           3HE      LYS  19   7.133  25.840  -1.994
  143    HZ1  LYS  19           3HZ      LYS  19   5.206  23.817  -1.976
  144    HZ2  LYS  19           1HZ      LYS  19   5.077  25.388  -1.360
  145    HZ3  LYS  19           2HZ      LYS  19   5.623  24.132  -0.367
  146    H    ALA  20           H        ALA  20  11.921  22.335  -5.657
  147    HA   ALA  20           HA       ALA  20  14.200  22.905  -4.065
  148    HB1  ALA  20           1HB      ALA  20  13.543  20.622  -4.580
  149    HB2  ALA  20           2HB      ALA  20  13.859  20.901  -6.293
  150    HB3  ALA  20           3HB      ALA  20  15.188  20.933  -5.135
  151    H    ALA  21           H        ALA  21  13.415  23.403  -7.451
  152    HA   ALA  21           HA       ALA  21  16.059  24.066  -8.282
  153    HB1  ALA  21           1HB      ALA  21  14.725  25.153 -10.230
  154    HB2  ALA  21           2HB      ALA  21  14.721  23.399 -10.041
  155    HB3  ALA  21           3HB      ALA  21  13.341  24.348  -9.490
  156    H    THR  22           H        THR  22  13.265  25.942  -7.206
  157    HA   THR  22           HA       THR  22  14.582  28.470  -7.635
  158    HB   THR  22           HB       THR  22  12.139  28.293  -7.847
  159    HG1  THR  22           HG1      THR  22  11.744  30.063  -6.151
  160   HG21  THR  22          3HG2      THR  22  11.930  26.610  -5.956
  161   HG22  THR  22          1HG2      THR  22  10.703  27.875  -6.012
  162   HG23  THR  22          2HG2      THR  22  12.029  27.983  -4.853
  163    H    ASP  23           H        ASP  23  14.342  26.161  -5.090
  164    HA   ASP  23           HA       ASP  23  14.953  27.960  -2.943
  165    HB2  ASP  23           2HB      ASP  23  14.707  25.002  -3.253
  166    HB3  ASP  23           3HB      ASP  23  15.584  25.622  -1.858
  167    H    VAL  24           H        VAL  24  16.796  25.797  -5.028
  168    HA   VAL  24           HA       VAL  24  19.263  26.043  -3.654
  169    HB   VAL  24           HB       VAL  24  18.719  25.330  -6.539
  170   HG11  VAL  24          1HG1      VAL  24  20.937  25.792  -6.691
  171   HG12  VAL  24          2HG1      VAL  24  21.222  25.542  -4.968
  172   HG13  VAL  24          3HG1      VAL  24  21.058  24.156  -6.046
  173   HG21  VAL  24          3HG2      VAL  24  19.607  23.277  -4.634
  174   HG22  VAL  24          1HG2      VAL  24  17.997  23.931  -4.330
  175   HG23  VAL  24          2HG2      VAL  24  18.372  23.202  -5.891
  176    H    VAL  25           H        VAL  25  17.805  27.803  -6.350
  177    HA   VAL  25           HA       VAL  25  20.084  29.401  -6.923
  178    HB   VAL  25           HB       VAL  25  18.334  29.092  -8.586
  179   HG11  VAL  25          1HG1      VAL  25  16.575  30.702  -6.737
  180   HG12  VAL  25          2HG1      VAL  25  16.147  30.142  -8.355
  181   HG13  VAL  25          3HG1      VAL  25  16.421  28.975  -7.061
  182   HG21  VAL  25          3HG2      VAL  25  18.031  31.455  -9.257
  183   HG22  VAL  25          1HG2      VAL  25  18.628  31.952  -7.673
  184   HG23  VAL  25          2HG2      VAL  25  19.688  31.082  -8.783
  185    H    ALA  26           H        ALA  26  17.339  29.746  -4.765
  186    HA   ALA  26           HA       ALA  26  17.942  32.484  -4.096
  187    HB1  ALA  26           1HB      ALA  26  16.132  32.290  -2.491
  188    HB2  ALA  26           2HB      ALA  26  15.638  31.638  -4.054
  189    HB3  ALA  26           3HB      ALA  26  16.072  30.545  -2.740
  190    H    ALA  27           H        ALA  27  18.716  29.321  -2.860
  191    HA   ALA  27           HA       ALA  27  19.480  29.987  -0.250
  192    HB1  ALA  27           1HB      ALA  27  19.929  27.744  -2.088
  193    HB2  ALA  27           2HB      ALA  27  21.173  27.955  -0.855
  194    HB3  ALA  27           3HB      ALA  27  19.487  27.746  -0.381
  195    H    TRP  28           H        TRP  28  20.955  30.702  -3.260
  196    HA   TRP  28           HA       TRP  28  23.653  30.871  -2.535
  197    HB2  TRP  28           2HB      TRP  28  22.436  31.146  -4.857
  198    HB3  TRP  28           3HB      TRP  28  22.474  32.856  -4.437
  199    HD1  TRP  28           HD1      TRP  28  24.737  34.119  -4.728
  200    HE1  TRP  28           HE1      TRP  28  27.061  33.447  -5.607
  201    HE3  TRP  28           HE3      TRP  28  24.100  29.050  -4.915
  202    HZ2  TRP  28           HZ2      TRP  28  28.441  31.081  -6.289
  203    HZ3  TRP  28           HZ3      TRP  28  25.970  27.654  -5.693
  204    HH2  TRP  28           HH2      TRP  28  28.095  28.650  -6.366
  205    H    LYS  29           H        LYS  29  20.966  32.983  -1.896
  206    HA   LYS  29           HA       LYS  29  22.475  35.295  -1.212
  207    HB2  LYS  29           2HB      LYS  29  20.438  36.214  -0.429
  208    HB3  LYS  29           3HB      LYS  29  20.009  35.209  -1.807
  209    HG2  LYS  29           2HG      LYS  29  19.655  33.399   0.091
  210    HG3  LYS  29           3HG      LYS  29  19.407  34.845   1.072
  211    HD2  LYS  29           2HD      LYS  29  18.011  34.648  -1.551
  212    HD3  LYS  29           3HD      LYS  29  17.406  33.685  -0.201
  213    HE2  LYS  29           2HE      LYS  29  17.685  36.032   1.044
  214    HE3  LYS  29           3HE      LYS  29  17.420  36.622  -0.596
  215    HZ1  LYS  29           3HZ      LYS  29  15.484  35.893   1.174
  216    HZ2  LYS  29           1HZ      LYS  29  15.580  34.557   0.140
  217    HZ3  LYS  29           2HZ      LYS  29  15.276  36.096  -0.492
  218    H    SER  30           H        SER  30  21.408  32.462   0.543
  219    HA   SER  30           HA       SER  30  21.864  33.432   3.156
  220    HB2  SER  30           2HB      SER  30  20.625  31.277   2.331
  221    HB3  SER  30           3HB      SER  30  22.221  30.536   2.454
  222    HG   SER  30           HG       SER  30  20.719  30.549   4.380
  Start of MODEL   15
    1    H1   VAL   1           H        VAL   1   0.849  -0.808   0.230
    2    HA   VAL   1           HA       VAL   1   2.870  -0.591  -1.261
    3    HB   VAL   1           HB       VAL   1   1.628  -0.481  -3.404
    4   HG11  VAL   1          1HG1      VAL   1   1.600  -2.441  -1.553
    5   HG12  VAL   1          2HG1      VAL   1  -0.132  -2.170  -1.753
    6   HG13  VAL   1          3HG1      VAL   1   0.863  -2.587  -3.148
    7   HG21  VAL   1          3HG2      VAL   1  -0.386   0.459  -3.608
    8   HG22  VAL   1          1HG2      VAL   1  -1.017  -0.417  -2.214
    9   HG23  VAL   1          2HG2      VAL   1  -0.145   1.098  -1.982
   10    H    LYS   2           H        LYS   2   3.333   0.739  -3.370
   11    HA   LYS   2           HA       LYS   2   3.866   3.432  -2.497
   12    HB2  LYS   2           2HB      LYS   2   5.280   3.613  -4.372
   13    HB3  LYS   2           3HB      LYS   2   5.442   1.943  -3.844
   14    HG2  LYS   2           2HG      LYS   2   5.192   1.573  -6.059
   15    HG3  LYS   2           3HG      LYS   2   3.485   1.608  -5.613
   16    HD2  LYS   2           2HD      LYS   2   3.421   3.081  -7.347
   17    HD3  LYS   2           3HD      LYS   2   3.831   4.210  -6.053
   18    HE2  LYS   2           2HE      LYS   2   6.296   3.411  -6.764
   19    HE3  LYS   2           3HE      LYS   2   5.465   3.219  -8.307
   20    HZ1  LYS   2           3HZ      LYS   2   4.844   5.493  -8.296
   21    HZ2  LYS   2           1HZ      LYS   2   6.497   5.440  -7.938
   22    HZ3  LYS   2           2HZ      LYS   2   5.373   5.712  -6.704
   23    H    GLY   3           H        GLY   3   1.450   1.857  -4.343
   24    HA2  GLY   3           2HA      GLY   3   0.694   3.976  -6.061
   25    HA3  GLY   3           3HA      GLY   3  -0.325   2.627  -5.582
   26    H    ARG   4           H        ARG   4  -0.208   3.157  -2.756
   27    HA   ARG   4           HA       ARG   4  -2.369   4.975  -2.553
   28    HB2  ARG   4           2HB      ARG   4  -0.602   3.738  -0.437
   29    HB3  ARG   4           3HB      ARG   4  -2.034   4.695  -0.083
   30    HG2  ARG   4           2HG      ARG   4  -1.978   2.112  -1.630
   31    HG3  ARG   4           3HG      ARG   4  -2.505   2.313   0.042
   32    HD2  ARG   4           2HD      ARG   4  -4.264   3.869  -0.750
   33    HD3  ARG   4           3HD      ARG   4  -3.771   3.531  -2.409
   34    HE   ARG   4           HE       ARG   4  -4.906   1.550  -2.298
   35   HH11  ARG   4          1HH1      ARG   4  -4.404   2.748   0.932
   36   HH12  ARG   4          2HH1      ARG   4  -5.395   1.537   1.675
   37   HH21  ARG   4          1HH2      ARG   4  -6.213  -0.049  -1.331
   38   HH22  ARG   4          2HH2      ARG   4  -6.423  -0.054   0.387
   39    H    ILE   5           H        ILE   5   1.081   5.236  -1.847
   40    HA   ILE   5           HA       ILE   5   0.804   7.956  -0.889
   41    HB   ILE   5           HB       ILE   5   3.212   7.920  -0.573
   42   HG12  ILE   5          2HG1      ILE   5   3.113   5.190  -1.877
   43   HG13  ILE   5          3HG1      ILE   5   3.807   6.642  -2.591
   44   HG21  ILE   5          1HG2      ILE   5   2.773   5.270   0.491
   45   HG22  ILE   5          2HG2      ILE   5   2.946   6.808   1.335
   46   HG23  ILE   5          3HG2      ILE   5   1.366   6.305   0.734
   47   HD11  ILE   5          3HD1      ILE   5   5.682   5.621  -1.799
   48   HD12  ILE   5          1HD1      ILE   5   5.263   6.624  -0.410
   49   HD13  ILE   5          2HD1      ILE   5   4.848   4.909  -0.417
   50    H    ASP   6           H        ASP   6   1.364   6.354  -3.863
   51    HA   ASP   6           HA       ASP   6   2.845   8.379  -5.190
   52    HB2  ASP   6           2HB      ASP   6   2.868   6.172  -6.115
   53    HB3  ASP   6           3HB      ASP   6   1.110   6.131  -6.217
   54    H    ALA   7           H        ALA   7  -0.586   7.763  -4.747
   55    HA   ALA   7           HA       ALA   7  -1.613   9.551  -6.634
   56    HB1  ALA   7           1HB      ALA   7  -2.624   7.987  -4.459
   57    HB2  ALA   7           2HB      ALA   7  -3.352   9.593  -4.428
   58    HB3  ALA   7           3HB      ALA   7  -3.470   8.600  -5.880
   59    HA   PRO   8           HA       PRO   8  -1.683  12.886  -3.130
   60    HB2  PRO   8           2HB      PRO   8  -0.238  12.357  -0.893
   61    HB3  PRO   8           3HB      PRO   8  -1.936  11.900  -1.070
   62    HG2  PRO   8           2HG      PRO   8   0.522  10.229  -1.422
   63    HG3  PRO   8           3HG      PRO   8  -1.002   9.820  -0.612
   64    HD2  PRO   8           2HD      PRO   8  -0.416   8.988  -3.122
   65    HD3  PRO   8           3HD      PRO   8  -2.074   9.345  -2.597
   66    H    ASP   9           H        ASP   9   1.243  10.996  -3.604
   67    HA   ASP   9           HA       ASP   9   3.001  13.257  -3.287
   68    HB2  ASP   9           2HB      ASP   9   3.425  10.409  -4.185
   69    HB3  ASP   9           3HB      ASP   9   4.720  11.603  -4.201
   70    H    PHE  10           H        PHE  10   1.109  11.951  -5.798
   71    HA   PHE  10           HA       PHE  10   2.618  12.531  -8.070
   72    HB2  PHE  10           2HB      PHE  10   0.042  11.615  -7.551
   73    HB3  PHE  10           3HB      PHE  10  -0.209  13.119  -8.431
   74    HD1  PHE  10           HD2      PHE  10   1.918  13.216 -10.346
   75    HD2  PHE  10           HD1      PHE  10  -0.305   9.853  -8.981
   76    HE1  PHE  10           HE2      PHE  10   2.382  12.054 -12.464
   77    HE2  PHE  10           HE1      PHE  10   0.156   8.685 -11.097
   78    HZ   PHE  10           HZ       PHE  10   1.500   9.786 -12.842
   79    HA   PRO  11           HA       PRO  11   0.563  16.915  -8.066
   80    HB2  PRO  11           2HB      PRO  11  -0.641  17.700  -5.763
   81    HB3  PRO  11           3HB      PRO  11  -1.498  16.849  -7.053
   82    HG2  PRO  11           2HG      PRO  11  -0.357  15.770  -4.505
   83    HG3  PRO  11           3HG      PRO  11  -1.914  15.412  -5.273
   84    HD2  PRO  11           2HD      PRO  11   0.222  13.761  -5.472
   85    HD3  PRO  11           3HD      PRO  11  -0.978  13.930  -6.769
   86    H    SER  12           H        SER  12   2.071  15.648  -5.173
   87    HA   SER  12           HA       SER  12   3.269  18.176  -4.448
   88    HB2  SER  12           2HB      SER  12   2.603  16.445  -2.758
   89    HB3  SER  12           3HB      SER  12   3.901  15.420  -3.368
   90    HG   SER  12           HG       SER  12   4.019  17.678  -1.781
   91    H    SER  13           H        SER  13   4.015  15.547  -6.499
   92    HA   SER  13           HA       SER  13   6.801  15.501  -6.435
   93    HB2  SER  13           2HB      SER  13   5.930  13.775  -7.701
   94    HB3  SER  13           3HB      SER  13   4.742  14.813  -8.491
   95    HG   SER  13           HG       SER  13   7.538  14.944  -8.955
   96    HA   PRO  14           HA       PRO  14   6.689  18.901  -9.891
   97    HB2  PRO  14           2HB      PRO  14   4.372  20.296 -10.137
   98    HB3  PRO  14           3HB      PRO  14   4.707  18.821 -11.051
   99    HG2  PRO  14           2HG      PRO  14   3.084  19.178  -8.562
  100    HG3  PRO  14           3HG      PRO  14   2.726  18.205 -10.000
  101    HD2  PRO  14           2HD      PRO  14   3.702  17.126  -7.717
  102    HD3  PRO  14           3HD      PRO  14   4.089  16.474  -9.323
  103    H    ALA  15           H        ALA  15   5.015  19.284  -6.854
  104    HA   ALA  15           HA       ALA  15   5.623  22.091  -6.596
  105    HB1  ALA  15           1HB      ALA  15   4.803  20.356  -4.302
  106    HB2  ALA  15           2HB      ALA  15   4.416  22.047  -4.623
  107    HB3  ALA  15           3HB      ALA  15   3.643  20.772  -5.564
  108    H    ILE  16           H        ILE  16   6.862  19.052  -5.267
  109    HA   ILE  16           HA       ILE  16   8.804  20.320  -3.592
  110    HB   ILE  16           HB       ILE  16   7.858  18.032  -3.182
  111   HG12  ILE  16          2HG1      ILE  16  10.872  18.231  -3.373
  112   HG13  ILE  16          3HG1      ILE  16   9.887  18.829  -2.042
  113   HG21  ILE  16          1HG2      ILE  16   7.972  17.211  -5.481
  114   HG22  ILE  16          2HG2      ILE  16   9.733  17.246  -5.408
  115   HG23  ILE  16          3HG2      ILE  16   8.831  16.139  -4.374
  116   HD11  ILE  16          3HD1      ILE  16  10.228  15.957  -2.868
  117   HD12  ILE  16          1HD1      ILE  16  10.913  16.737  -1.443
  118   HD13  ILE  16          2HD1      ILE  16   9.167  16.525  -1.579
  119    H    LEU  17           H        LEU  17   8.783  18.998  -6.842
  120    HA   LEU  17           HA       LEU  17  11.624  19.120  -7.186
  121    HB2  LEU  17           2HB      LEU  17  10.260  17.554  -8.456
  122    HB3  LEU  17           3HB      LEU  17   9.395  18.896  -9.205
  123    HG   LEU  17           HG       LEU  17  11.837  19.536 -10.013
  124   HD11  LEU  17          1HD1      LEU  17  12.353  16.757 -10.503
  125   HD12  LEU  17          2HD1      LEU  17  12.292  17.068  -8.769
  126   HD13  LEU  17          3HD1      LEU  17  13.402  17.982  -9.790
  127   HD21  LEU  17          3HD2      LEU  17  10.003  19.175 -11.513
  128   HD22  LEU  17          1HD2      LEU  17  10.050  17.435 -11.228
  129   HD23  LEU  17          2HD2      LEU  17  11.378  18.225 -12.079
  130    H    GLY  18           H        GLY  18   8.919  21.262  -7.794
  131    HA2  GLY  18           2HA      GLY  18  10.496  23.130  -9.337
  132    HA3  GLY  18           3HA      GLY  18   8.834  23.350  -8.810
  133    H    LYS  19           H        LYS  19   9.564  22.726  -6.002
  134    HA   LYS  19           HA       LYS  19  10.280  25.411  -5.241
  135    HB2  LYS  19           2HB      LYS  19   9.451  22.940  -3.750
  136    HB3  LYS  19           3HB      LYS  19  10.102  24.326  -2.884
  137    HG2  LYS  19           2HG      LYS  19   8.308  25.693  -3.482
  138    HG3  LYS  19           3HG      LYS  19   7.805  24.615  -4.786
  139    HD2  LYS  19           2HD      LYS  19   6.756  23.161  -3.362
  140    HD3  LYS  19           3HD      LYS  19   7.821  23.549  -2.008
  141    HE2  LYS  19           2HE      LYS  19   6.619  25.432  -1.434
  142    HE3  LYS  19           3HE      LYS  19   5.960  25.634  -3.056
  143    HZ1  LYS  19           3HZ      LYS  19   4.227  24.325  -2.593
  144    HZ2  LYS  19           1HZ      LYS  19   4.623  24.586  -0.968
  145    HZ3  LYS  19           2HZ      LYS  19   5.161  23.189  -1.756
  146    H    ALA  20           H        ALA  20  11.821  22.278  -5.345
  147    HA   ALA  20           HA       ALA  20  14.022  22.873  -3.669
  148    HB1  ALA  20           1HB      ALA  20  13.231  20.720  -5.473
  149    HB2  ALA  20           2HB      ALA  20  14.974  20.986  -5.412
  150    HB3  ALA  20           3HB      ALA  20  14.081  20.654  -3.928
  151    H    ALA  21           H        ALA  21  13.482  23.203  -7.145
  152    HA   ALA  21           HA       ALA  21  16.141  23.970  -7.787
  153    HB1  ALA  21           1HB      ALA  21  14.171  23.137  -9.306
  154    HB2  ALA  21           2HB      ALA  21  13.834  24.863  -9.447
  155    HB3  ALA  21           3HB      ALA  21  15.403  24.228  -9.942
  156    H    THR  22           H        THR  22  13.235  25.746  -6.893
  157    HA   THR  22           HA       THR  22  14.427  28.323  -7.383
  158    HB   THR  22           HB       THR  22  11.889  27.664  -5.877
  159    HG1  THR  22           HG1      THR  22  11.866  26.968  -8.085
  160   HG21  THR  22          3HG2      THR  22  13.291  30.145  -6.460
  161   HG22  THR  22          1HG2      THR  22  11.948  29.841  -5.358
  162   HG23  THR  22          2HG2      THR  22  11.635  30.148  -7.066
  163    H    ASP  23           H        ASP  23  14.197  26.109  -4.738
  164    HA   ASP  23           HA       ASP  23  14.748  28.036  -2.681
  165    HB2  ASP  23           2HB      ASP  23  14.526  25.057  -2.810
  166    HB3  ASP  23           3HB      ASP  23  15.318  25.791  -1.418
  167    H    VAL  24           H        VAL  24  16.623  25.767  -4.612
  168    HA   VAL  24           HA       VAL  24  19.063  26.113  -3.185
  169    HB   VAL  24           HB       VAL  24  18.590  25.126  -6.001
  170   HG11  VAL  24          1HG1      VAL  24  20.883  23.995  -5.436
  171   HG12  VAL  24          2HG1      VAL  24  20.830  25.647  -6.052
  172   HG13  VAL  24          3HG1      VAL  24  21.047  25.355  -4.326
  173   HG21  VAL  24          3HG2      VAL  24  19.385  23.266  -3.864
  174   HG22  VAL  24          1HG2      VAL  24  17.765  23.947  -3.711
  175   HG23  VAL  24          2HG2      VAL  24  18.216  23.064  -5.170
  176    H    VAL  25           H        VAL  25  17.660  27.602  -6.065
  177    HA   VAL  25           HA       VAL  25  19.949  29.127  -6.765
  178    HB   VAL  25           HB       VAL  25  18.148  28.650  -8.370
  179   HG11  VAL  25          1HG1      VAL  25  16.518  30.612  -6.761
  180   HG12  VAL  25          2HG1      VAL  25  16.032  29.832  -8.267
  181   HG13  VAL  25          3HG1      VAL  25  16.261  28.868  -6.808
  182   HG21  VAL  25          3HG2      VAL  25  17.931  31.543  -8.401
  183   HG22  VAL  25          1HG2      VAL  25  19.578  31.000  -8.081
  184   HG23  VAL  25          2HG2      VAL  25  18.738  30.459  -9.534
  185    H    ALA  26           H        ALA  26  17.211  29.687  -4.649
  186    HA   ALA  26           HA       ALA  26  17.823  32.473  -4.242
  187    HB1  ALA  26           1HB      ALA  26  16.129  31.955  -2.245
  188    HB2  ALA  26           2HB      ALA  26  15.596  32.219  -3.905
  189    HB3  ALA  26           3HB      ALA  26  15.763  30.577  -3.284
  190    H    ALA  27           H        ALA  27  18.500  29.433  -2.642
  191    HA   ALA  27           HA       ALA  27  19.330  30.395  -0.148
  192    HB1  ALA  27           1HB      ALA  27  19.058  28.110  -0.191
  193    HB2  ALA  27           2HB      ALA  27  19.914  27.928  -1.723
  194    HB3  ALA  27           3HB      ALA  27  20.815  28.253  -0.242
  195    H    TRP  28           H        TRP  28  20.798  30.637  -3.236
  196    HA   TRP  28           HA       TRP  28  23.510  30.765  -2.558
  197    HB2  TRP  28           2HB      TRP  28  21.920  31.231  -4.866
  198    HB3  TRP  28           3HB      TRP  28  22.957  32.638  -4.648
  199    HD1  TRP  28           HD1      TRP  28  23.205  28.817  -5.129
  200    HE1  TRP  28           HE1      TRP  28  25.513  28.283  -6.135
  201    HE3  TRP  28           HE3      TRP  28  25.265  33.493  -4.964
  202    HZ2  TRP  28           HZ2      TRP  28  27.892  29.661  -6.775
  203    HZ3  TRP  28           HZ3      TRP  28  27.562  33.800  -5.792
  204    HH2  TRP  28           HH2      TRP  28  28.846  31.922  -6.678
  205    H    LYS  29           H        LYS  29  20.942  33.108  -2.251
  206    HA   LYS  29           HA       LYS  29  22.561  35.401  -1.872
  207    HB2  LYS  29           2HB      LYS  29  20.583  36.508  -1.187
  208    HB3  LYS  29           3HB      LYS  29  20.082  35.348  -2.410
  209    HG2  LYS  29           2HG      LYS  29  19.693  33.827  -0.279
  210    HG3  LYS  29           3HG      LYS  29  19.527  35.402   0.501
  211    HD2  LYS  29           2HD      LYS  29  18.080  35.094  -2.045
  212    HD3  LYS  29           3HD      LYS  29  17.501  34.084  -0.719
  213    HE2  LYS  29           2HE      LYS  29  17.943  37.055  -0.492
  214    HE3  LYS  29           3HE      LYS  29  16.394  36.328  -0.916
  215    HZ1  LYS  29           3HZ      LYS  29  17.347  36.805   1.615
  216    HZ2  LYS  29           1HZ      LYS  29  17.490  35.131   1.419
  217    HZ3  LYS  29           2HZ      LYS  29  15.990  35.883   1.205
  218    H    SER  30           H        SER  30  21.413  32.879   0.265
  219    HA   SER  30           HA       SER  30  21.941  34.154   2.721
  220    HB2  SER  30           2HB      SER  30  21.372  32.160   3.691
  221    HB3  SER  30           3HB      SER  30  20.730  31.851   2.078
  222    HG   SER  30           HG       SER  30  22.267  30.434   1.725
  Start of MODEL   16
    1    H1   VAL   1           H        VAL   1   1.601  -1.661  -3.210
    2    HA   VAL   1           HA       VAL   1   0.608   0.058  -1.936
    3    HB   VAL   1           HB       VAL   1   3.368  -0.101  -0.731
    4   HG11  VAL   1          1HG1      VAL   1   2.219   1.397   0.569
    5   HG12  VAL   1          2HG1      VAL   1   0.654   0.650   0.242
    6   HG13  VAL   1          3HG1      VAL   1   1.781  -0.114   1.365
    7   HG21  VAL   1          3HG2      VAL   1   1.124  -2.104  -0.679
    8   HG22  VAL   1          1HG2      VAL   1   2.805  -2.355  -1.150
    9   HG23  VAL   1          2HG2      VAL   1   2.397  -2.067   0.542
   10    H    LYS   2           H        LYS   2   3.081   0.925  -3.979
   11    HA   LYS   2           HA       LYS   2   3.568   3.576  -2.961
   12    HB2  LYS   2           2HB      LYS   2   5.029   3.858  -4.789
   13    HB3  LYS   2           3HB      LYS   2   5.196   2.169  -4.330
   14    HG2  LYS   2           2HG      LYS   2   5.011   1.892  -6.565
   15    HG3  LYS   2           3HG      LYS   2   3.292   1.892  -6.165
   16    HD2  LYS   2           2HD      LYS   2   3.006   4.099  -6.896
   17    HD3  LYS   2           3HD      LYS   2   4.739   4.431  -6.850
   18    HE2  LYS   2           2HE      LYS   2   4.197   4.210  -9.131
   19    HE3  LYS   2           3HE      LYS   2   4.973   2.693  -8.682
   20    HZ1  LYS   2           3HZ      LYS   2   2.255   3.195  -9.527
   21    HZ2  LYS   2           1HZ      LYS   2   2.393   2.149  -8.204
   22    HZ3  LYS   2           2HZ      LYS   2   3.187   1.789  -9.654
   23    H    GLY   3           H        GLY   3   1.219   2.076  -4.953
   24    HA2  GLY   3           2HA      GLY   3   0.494   4.255  -6.598
   25    HA3  GLY   3           3HA      GLY   3  -0.538   2.894  -6.183
   26    H    ARG   4           H        ARG   4  -0.430   3.360  -3.326
   27    HA   ARG   4           HA       ARG   4  -2.606   5.166  -3.107
   28    HB2  ARG   4           2HB      ARG   4  -0.877   3.826  -1.026
   29    HB3  ARG   4           3HB      ARG   4  -2.268   4.826  -0.628
   30    HG2  ARG   4           2HG      ARG   4  -3.776   3.305  -1.569
   31    HG3  ARG   4           3HG      ARG   4  -2.504   2.459  -2.452
   32    HD2  ARG   4           2HD      ARG   4  -1.819   2.360   0.284
   33    HD3  ARG   4           3HD      ARG   4  -3.530   1.949   0.167
   34    HE   ARG   4           HE       ARG   4  -2.311   0.466  -1.785
   35   HH11  ARG   4          1HH1      ARG   4  -1.960   0.810   1.661
   36   HH12  ARG   4          2HH1      ARG   4  -1.424  -0.820   1.901
   37   HH21  ARG   4          1HH2      ARG   4  -1.607  -1.682  -1.483
   38   HH22  ARG   4          2HH2      ARG   4  -1.223  -2.237   0.112
   39    H    ILE   5           H        ILE   5   0.835   5.401  -2.355
   40    HA   ILE   5           HA       ILE   5   0.548   8.091  -1.315
   41    HB   ILE   5           HB       ILE   5   3.017   8.028  -1.093
   42   HG12  ILE   5          2HG1      ILE   5   2.835   5.143  -1.955
   43   HG13  ILE   5          3HG1      ILE   5   3.282   6.431  -3.068
   44   HG21  ILE   5          1HG2      ILE   5   2.628   7.170   0.915
   45   HG22  ILE   5          2HG2      ILE   5   1.084   6.554   0.328
   46   HG23  ILE   5          3HG2      ILE   5   2.528   5.546   0.234
   47   HD11  ILE   5          3HD1      ILE   5   5.071   5.006  -1.730
   48   HD12  ILE   5          1HD1      ILE   5   5.330   6.699  -2.149
   49   HD13  ILE   5          2HD1      ILE   5   4.784   6.264  -0.529
   50    H    ASP   6           H        ASP   6   1.151   6.577  -4.328
   51    HA   ASP   6           HA       ASP   6   2.646   8.642  -5.576
   52    HB2  ASP   6           2HB      ASP   6   1.275   6.174  -6.410
   53    HB3  ASP   6           3HB      ASP   6   1.336   7.428  -7.645
   54    H    ALA   7           H        ALA   7  -0.792   8.010  -5.202
   55    HA   ALA   7           HA       ALA   7  -1.793   9.858  -7.045
   56    HB1  ALA   7           1HB      ALA   7  -2.849   8.145  -5.083
   57    HB2  ALA   7           2HB      ALA   7  -3.481   9.755  -4.735
   58    HB3  ALA   7           3HB      ALA   7  -3.725   9.037  -6.328
   59    HA   PRO   8           HA       PRO   8  -1.916  13.081  -3.438
   60    HB2  PRO   8           2HB      PRO   8  -0.507  12.481  -1.196
   61    HB3  PRO   8           3HB      PRO   8  -2.203  12.030  -1.415
   62    HG2  PRO   8           2HG      PRO   8   0.261  10.369  -1.780
   63    HG3  PRO   8           3HG      PRO   8  -1.276   9.937  -1.008
   64    HD2  PRO   8           2HD      PRO   8  -0.650   9.184  -3.533
   65    HD3  PRO   8           3HD      PRO   8  -2.316   9.525  -3.024
   66    H    ASP   9           H        ASP   9   1.015  11.205  -3.933
   67    HA   ASP   9           HA       ASP   9   2.770  13.452  -3.513
   68    HB2  ASP   9           2HB      ASP   9   3.461  11.117  -3.015
   69    HB3  ASP   9           3HB      ASP   9   3.377  10.753  -4.736
   70    H    PHE  10           H        PHE  10   0.915  12.233  -6.094
   71    HA   PHE  10           HA       PHE  10   2.459  12.888  -8.322
   72    HB2  PHE  10           2HB      PHE  10  -0.142  11.978  -7.861
   73    HB3  PHE  10           3HB      PHE  10  -0.348  13.490  -8.739
   74    HD1  PHE  10           HD2      PHE  10   1.709  13.624 -10.653
   75    HD2  PHE  10           HD1      PHE  10  -0.346  10.172  -9.247
   76    HE1  PHE  10           HE2      PHE  10   2.217  12.466 -12.764
   77    HE2  PHE  10           HE1      PHE  10   0.160   9.008 -11.355
   78    HZ   PHE  10           HZ       PHE  10   1.442  10.156 -13.118
   79    HA   PRO  11           HA       PRO  11   0.397  17.268  -8.201
   80    HB2  PRO  11           2HB      PRO  11  -0.835  17.975  -5.888
   81    HB3  PRO  11           3HB      PRO  11  -1.676  17.166  -7.216
   82    HG2  PRO  11           2HG      PRO  11  -0.564  16.004  -4.691
   83    HG3  PRO  11           3HG      PRO  11  -2.112  15.670  -5.489
   84    HD2  PRO  11           2HD      PRO  11   0.029  14.028  -5.717
   85    HD3  PRO  11           3HD      PRO  11  -1.156  14.239  -7.023
   86    H    SER  12           H        SER  12   1.834  15.926  -5.296
   87    HA   SER  12           HA       SER  12   3.038  18.426  -4.497
   88    HB2  SER  12           2HB      SER  12   3.748  15.685  -3.450
   89    HB3  SER  12           3HB      SER  12   3.916  17.240  -2.634
   90    HG   SER  12           HG       SER  12   2.094  16.311  -1.818
   91    H    SER  13           H        SER  13   3.800  15.867  -6.617
   92    HA   SER  13           HA       SER  13   6.584  15.778  -6.494
   93    HB2  SER  13           2HB      SER  13   4.564  14.733  -8.174
   94    HB3  SER  13           3HB      SER  13   5.716  15.553  -9.227
   95    HG   SER  13           HG       SER  13   7.292  14.212  -8.579
   96    HA   PRO  14           HA       PRO  14   6.602  19.300  -9.827
   97    HB2  PRO  14           2HB      PRO  14   4.306  20.724 -10.093
   98    HB3  PRO  14           3HB      PRO  14   4.655  19.278 -11.048
   99    HG2  PRO  14           2HG      PRO  14   2.961  19.567  -8.597
  100    HG3  PRO  14           3HG      PRO  14   2.638  18.647 -10.078
  101    HD2  PRO  14           2HD      PRO  14   3.536  17.481  -7.805
  102    HD3  PRO  14           3HD      PRO  14   3.965  16.881  -9.420
  103    H    ALA  15           H        ALA  15   4.848  19.592  -6.826
  104    HA   ALA  15           HA       ALA  15   5.466  22.383  -6.454
  105    HB1  ALA  15           1HB      ALA  15   3.437  21.116  -5.533
  106    HB2  ALA  15           2HB      ALA  15   4.540  20.526  -4.289
  107    HB3  ALA  15           3HB      ALA  15   4.253  22.257  -4.464
  108    H    ILE  16           H        ILE  16   6.650  19.292  -5.199
  109    HA   ILE  16           HA       ILE  16   8.555  20.489  -3.431
  110    HB   ILE  16           HB       ILE  16   7.579  18.196  -3.125
  111   HG12  ILE  16          2HG1      ILE  16  10.600  18.327  -3.224
  112   HG13  ILE  16          3HG1      ILE  16   9.604  18.980  -1.928
  113   HG21  ILE  16          1HG2      ILE  16   8.579  16.336  -4.345
  114   HG22  ILE  16          2HG2      ILE  16   7.762  17.447  -5.443
  115   HG23  ILE  16          3HG2      ILE  16   9.521  17.469  -5.314
  116   HD11  ILE  16          3HD1      ILE  16   8.734  16.652  -1.575
  117   HD12  ILE  16          1HD1      ILE  16   9.985  16.102  -2.689
  118   HD13  ILE  16          2HD1      ILE  16  10.434  16.902  -1.182
  119    H    LEU  17           H        LEU  17   8.609  19.272  -6.721
  120    HA   LEU  17           HA       LEU  17  11.460  19.380  -6.987
  121    HB2  LEU  17           2HB      LEU  17   9.691  18.015  -8.332
  122    HB3  LEU  17           3HB      LEU  17   9.583  19.477  -9.311
  123    HG   LEU  17           HG       LEU  17  12.334  18.686  -8.971
  124   HD11  LEU  17          1HD1      LEU  17  11.723  16.443  -8.752
  125   HD12  LEU  17          2HD1      LEU  17  12.057  16.635 -10.473
  126   HD13  LEU  17          3HD1      LEU  17  10.391  16.597  -9.897
  127   HD21  LEU  17          3HD2      LEU  17  12.407  18.989 -11.306
  128   HD22  LEU  17          1HD2      LEU  17  11.243  20.174 -10.712
  129   HD23  LEU  17          2HD2      LEU  17  10.677  18.691 -11.480
  130    H    GLY  18           H        GLY  18   8.789  21.564  -7.596
  131    HA2  GLY  18           2HA      GLY  18  10.421  23.467  -9.036
  132    HA3  GLY  18           3HA      GLY  18   8.748  23.684  -8.546
  133    H    LYS  19           H        LYS  19   9.395  22.966  -5.742
  134    HA   LYS  19           HA       LYS  19  10.115  25.618  -4.877
  135    HB2  LYS  19           2HB      LYS  19   9.271  23.106  -3.449
  136    HB3  LYS  19           3HB      LYS  19   9.827  24.521  -2.565
  137    HG2  LYS  19           2HG      LYS  19   8.002  25.800  -3.208
  138    HG3  LYS  19           3HG      LYS  19   7.625  24.750  -4.576
  139    HD2  LYS  19           2HD      LYS  19   6.095  23.795  -3.261
  140    HD3  LYS  19           3HD      LYS  19   7.444  23.074  -2.379
  141    HE2  LYS  19           2HE      LYS  19   6.665  25.846  -1.667
  142    HE3  LYS  19           3HE      LYS  19   5.574  24.549  -1.186
  143    HZ1  LYS  19           3HZ      LYS  19   8.086  25.295  -0.072
  144    HZ2  LYS  19           1HZ      LYS  19   8.076  23.660  -0.507
  145    HZ3  LYS  19           2HZ      LYS  19   6.901  24.260   0.551
  146    H    ALA  20           H        ALA  20  11.630  22.478  -5.049
  147    HA   ALA  20           HA       ALA  20  13.793  23.013  -3.294
  148    HB1  ALA  20           1HB      ALA  20  13.801  20.793  -3.582
  149    HB2  ALA  20           2HB      ALA  20  13.030  20.898  -5.165
  150    HB3  ALA  20           3HB      ALA  20  14.771  21.133  -5.015
  151    H    ALA  21           H        ALA  21  13.245  23.579  -6.712
  152    HA   ALA  21           HA       ALA  21  15.947  24.219  -7.354
  153    HB1  ALA  21           1HB      ALA  21  14.654  23.564  -9.180
  154    HB2  ALA  21           2HB      ALA  21  13.324  24.637  -8.744
  155    HB3  ALA  21           3HB      ALA  21  14.822  25.307  -9.389
  156    H    THR  22           H        THR  22  13.107  26.113  -6.438
  157    HA   THR  22           HA       THR  22  14.481  28.630  -6.731
  158    HB   THR  22           HB       THR  22  12.056  28.489  -7.112
  159    HG1  THR  22           HG1      THR  22  11.767  30.450  -6.280
  160   HG21  THR  22          3HG2      THR  22  11.683  26.775  -5.285
  161   HG22  THR  22          1HG2      THR  22  10.494  28.073  -5.373
  162   HG23  THR  22          2HG2      THR  22  11.752  28.112  -4.138
  163    H    ASP  23           H        ASP  23  14.016  26.289  -4.240
  164    HA   ASP  23           HA       ASP  23  14.509  28.042  -2.030
  165    HB2  ASP  23           2HB      ASP  23  14.277  25.084  -2.398
  166    HB3  ASP  23           3HB      ASP  23  15.015  25.700  -0.921
  167    H    VAL  24           H        VAL  24  16.463  25.903  -4.032
  168    HA   VAL  24           HA       VAL  24  18.838  26.161  -2.469
  169    HB   VAL  24           HB       VAL  24  18.495  25.295  -5.344
  170   HG11  VAL  24          1HG1      VAL  24  20.727  25.693  -5.345
  171   HG12  VAL  24          2HG1      VAL  24  20.865  25.559  -3.591
  172   HG13  VAL  24          3HG1      VAL  24  20.760  24.104  -4.582
  173   HG21  VAL  24          3HG2      VAL  24  19.092  23.438  -3.090
  174   HG22  VAL  24          1HG2      VAL  24  17.436  24.001  -3.319
  175   HG23  VAL  24          2HG2      VAL  24  18.259  23.130  -4.614
  176    H    VAL  25           H        VAL  25  17.490  27.853  -5.240
  177    HA   VAL  25           HA       VAL  25  19.823  29.358  -5.857
  178    HB   VAL  25           HB       VAL  25  16.932  29.958  -6.497
  179   HG11  VAL  25          1HG1      VAL  25  18.088  31.242  -8.413
  180   HG12  VAL  25          2HG1      VAL  25  18.029  31.985  -6.813
  181   HG13  VAL  25          3HG1      VAL  25  19.511  31.207  -7.373
  182   HG21  VAL  25          3HG2      VAL  25  18.470  27.849  -7.373
  183   HG22  VAL  25          1HG2      VAL  25  17.050  28.504  -8.190
  184   HG23  VAL  25          2HG2      VAL  25  18.663  29.046  -8.655
  185    H    ALA  26           H        ALA  26  17.024  29.906  -3.791
  186    HA   ALA  26           HA       ALA  26  17.773  32.619  -3.171
  187    HB1  ALA  26           1HB      ALA  26  15.835  31.078  -1.511
  188    HB2  ALA  26           2HB      ALA  26  15.798  32.769  -2.010
  189    HB3  ALA  26           3HB      ALA  26  15.405  31.499  -3.169
  190    H    ALA  27           H        ALA  27  18.250  29.448  -1.788
  191    HA   ALA  27           HA       ALA  27  19.199  30.441   0.746
  192    HB1  ALA  27           1HB      ALA  27  19.351  27.674  -0.446
  193    HB2  ALA  27           2HB      ALA  27  19.727  28.100   1.224
  194    HB3  ALA  27           3HB      ALA  27  18.081  28.280   0.617
  195    H    TRP  28           H        TRP  28  20.613  29.286  -2.264
  196    HA   TRP  28           HA       TRP  28  23.289  29.156  -1.339
  197    HB2  TRP  28           2HB      TRP  28  22.655  27.963  -3.340
  198    HB3  TRP  28           3HB      TRP  28  22.152  29.457  -4.124
  199    HD1  TRP  28           HD1      TRP  28  25.486  28.333  -2.453
  200    HE1  TRP  28           HE1      TRP  28  27.407  28.949  -4.051
  201    HE3  TRP  28           HE3      TRP  28  22.754  30.393  -6.251
  202    HZ2  TRP  28           HZ2      TRP  28  27.723  30.150  -6.585
  203    HZ3  TRP  28           HZ3      TRP  28  23.942  31.253  -8.227
  204    HH2  TRP  28           HH2      TRP  28  26.375  31.133  -8.388
  205    H    LYS  29           H        LYS  29  21.380  31.689  -2.890
  206    HA   LYS  29           HA       LYS  29  23.558  33.516  -3.158
  207    HB2  LYS  29           2HB      LYS  29  21.804  35.176  -3.674
  208    HB3  LYS  29           3HB      LYS  29  21.620  33.699  -4.610
  209    HG2  LYS  29           2HG      LYS  29  19.459  34.067  -3.982
  210    HG3  LYS  29           3HG      LYS  29  20.002  33.035  -2.657
  211    HD2  LYS  29           2HD      LYS  29  19.681  34.654  -1.156
  212    HD3  LYS  29           3HD      LYS  29  20.560  35.829  -2.136
  213    HE2  LYS  29           2HE      LYS  29  18.327  35.723  -3.569
  214    HE3  LYS  29           3HE      LYS  29  17.651  35.238  -2.015
  215    HZ1  LYS  29           3HZ      LYS  29  17.564  37.386  -1.528
  216    HZ2  LYS  29           1HZ      LYS  29  18.461  37.818  -2.896
  217    HZ3  LYS  29           2HZ      LYS  29  19.254  37.397  -1.463
  218    H    SER  30           H        SER  30  21.244  32.781  -0.661
  219    HA   SER  30           HA       SER  30  21.596  35.168   0.850
  220    HB2  SER  30           2HB      SER  30  20.370  32.487   1.363
  221    HB3  SER  30           3HB      SER  30  20.689  33.554   2.731
  222    HG   SER  30           HG       SER  30  19.186  34.905   2.051
  Start of MODEL   17
    1    H1   VAL   1           H        VAL   1   1.644  -0.505   0.444
    2    HA   VAL   1           HA       VAL   1   2.704  -0.616  -1.568
    3    HB   VAL   1           HB       VAL   1   1.326  -0.405  -3.640
    4   HG11  VAL   1          1HG1      VAL   1  -0.296  -2.189  -1.956
    5   HG12  VAL   1          2HG1      VAL   1   0.628  -2.535  -3.419
    6   HG13  VAL   1          3HG1      VAL   1   1.447  -2.438  -1.860
    7   HG21  VAL   1          3HG2      VAL   1  -0.428   0.955  -1.871
    8   HG22  VAL   1          1HG2      VAL   1  -0.604   0.690  -3.605
    9   HG23  VAL   1          2HG2      VAL   1  -1.258  -0.483  -2.462
   10    H    LYS   2           H        LYS   2   3.133   0.731  -3.646
   11    HA   LYS   2           HA       LYS   2   3.715   3.413  -2.769
   12    HB2  LYS   2           2HB      LYS   2   5.085   3.591  -4.677
   13    HB3  LYS   2           3HB      LYS   2   5.242   1.916  -4.164
   14    HG2  LYS   2           2HG      LYS   2   4.934   1.563  -6.375
   15    HG3  LYS   2           3HG      LYS   2   3.239   1.613  -5.886
   16    HD2  LYS   2           2HD      LYS   2   3.146   3.099  -7.608
   17    HD3  LYS   2           3HD      LYS   2   3.602   4.215  -6.318
   18    HE2  LYS   2           2HE      LYS   2   5.253   4.799  -7.727
   19    HE3  LYS   2           3HE      LYS   2   6.036   3.338  -7.127
   20    HZ1  LYS   2           3HZ      LYS   2   5.706   3.781  -9.686
   21    HZ2  LYS   2           1HZ      LYS   2   4.203   3.065  -9.388
   22    HZ3  LYS   2           2HZ      LYS   2   5.626   2.219  -9.043
   23    H    GLY   3           H        GLY   3   1.238   1.875  -4.565
   24    HA2  GLY   3           2HA      GLY   3   0.463   4.014  -6.250
   25    HA3  GLY   3           3HA      GLY   3  -0.558   2.671  -5.756
   26    H    ARG   4           H        ARG   4  -0.368   3.179  -2.930
   27    HA   ARG   4           HA       ARG   4  -2.505   5.016  -2.662
   28    HB2  ARG   4           2HB      ARG   4  -0.908   3.299  -0.882
   29    HB3  ARG   4           3HB      ARG   4  -1.549   4.748  -0.119
   30    HG2  ARG   4           2HG      ARG   4  -3.763   4.118  -0.507
   31    HG3  ARG   4           3HG      ARG   4  -3.302   2.921  -1.720
   32    HD2  ARG   4           2HD      ARG   4  -1.958   2.037   0.484
   33    HD3  ARG   4           3HD      ARG   4  -3.425   2.703   1.200
   34    HE   ARG   4           HE       ARG   4  -4.299   1.165  -0.887
   35   HH11  ARG   4          1HH1      ARG   4  -2.354   0.626   1.949
   36   HH12  ARG   4          2HH1      ARG   4  -2.831  -1.031   2.121
   37   HH21  ARG   4          1HH2      ARG   4  -4.935  -1.015  -0.672
   38   HH22  ARG   4          2HH2      ARG   4  -4.298  -1.963   0.628
   39    H    ILE   5           H        ILE   5   0.964   5.240  -2.039
   40    HA   ILE   5           HA       ILE   5   0.736   7.956  -1.056
   41    HB   ILE   5           HB       ILE   5   2.421   6.355  -0.142
   42   HG12  ILE   5          2HG1      ILE   5   4.273   7.999  -0.086
   43   HG13  ILE   5          3HG1      ILE   5   3.508   8.883  -1.402
   44   HG21  ILE   5          1HG2      ILE   5   3.858   6.810  -2.752
   45   HG22  ILE   5          2HG2      ILE   5   4.403   5.829  -1.392
   46   HG23  ILE   5          3HG2      ILE   5   2.997   5.330  -2.331
   47   HD11  ILE   5          3HD1      ILE   5   2.164   8.387   1.236
   48   HD12  ILE   5          1HD1      ILE   5   3.151   9.809   0.901
   49   HD13  ILE   5          2HD1      ILE   5   1.686   9.511  -0.036
   50    H    ASP   6           H        ASP   6   1.211   6.368  -4.053
   51    HA   ASP   6           HA       ASP   6   2.679   8.386  -5.404
   52    HB2  ASP   6           2HB      ASP   6   2.658   6.193  -6.351
   53    HB3  ASP   6           3HB      ASP   6   0.898   6.159  -6.394
   54    H    ALA   7           H        ALA   7  -0.749   7.804  -4.885
   55    HA   ALA   7           HA       ALA   7  -1.798   9.622  -6.730
   56    HB1  ALA   7           1HB      ALA   7  -3.552   9.706  -4.599
   57    HB2  ALA   7           2HB      ALA   7  -3.589   8.558  -5.938
   58    HB3  ALA   7           3HB      ALA   7  -2.769   8.134  -4.435
   59    HA   PRO   8           HA       PRO   8  -1.750  12.924  -3.195
   60    HB2  PRO   8           2HB      PRO   8  -0.265  12.358  -0.995
   61    HB3  PRO   8           3HB      PRO   8  -1.972  11.922  -1.140
   62    HG2  PRO   8           2HG      PRO   8   0.458  10.225  -1.559
   63    HG3  PRO   8           3HG      PRO   8  -1.053   9.828  -0.721
   64    HD2  PRO   8           2HD      PRO   8  -0.531   9.012  -3.250
   65    HD3  PRO   8           3HD      PRO   8  -2.173   9.384  -2.686
   66    H    ASP   9           H        ASP   9   1.138  11.004  -3.760
   67    HA   ASP   9           HA       ASP   9   2.932  13.240  -3.456
   68    HB2  ASP   9           2HB      ASP   9   3.665  10.957  -2.912
   69    HB3  ASP   9           3HB      ASP   9   3.423  10.478  -4.590
   70    H    PHE  10           H        PHE  10   0.968  11.985  -5.937
   71    HA   PHE  10           HA       PHE  10   2.434  12.572  -8.236
   72    HB2  PHE  10           2HB      PHE  10  -0.143  11.682  -7.667
   73    HB3  PHE  10           3HB      PHE  10  -0.391  13.193  -8.537
   74    HD1  PHE  10           HD2      PHE  10   1.864  10.225  -8.798
   75    HD2  PHE  10           HD1      PHE  10  -0.704  12.975 -10.789
   76    HE1  PHE  10           HE2      PHE  10   2.273   9.061 -10.926
   77    HE2  PHE  10           HE1      PHE  10  -0.300  11.814 -12.920
   78    HZ   PHE  10           HZ       PHE  10   1.191   9.855 -12.991
   79    HA   PRO  11           HA       PRO  11   0.424  16.977  -8.135
   80    HB2  PRO  11           2HB      PRO  11  -0.709  17.750  -5.792
   81    HB3  PRO  11           3HB      PRO  11  -1.610  16.921  -7.067
   82    HG2  PRO  11           2HG      PRO  11  -0.411  15.803  -4.562
   83    HG3  PRO  11           3HG      PRO  11  -1.993  15.470  -5.292
   84    HD2  PRO  11           2HD      PRO  11   0.120  13.798  -5.566
   85    HD3  PRO  11           3HD      PRO  11  -1.113  13.994  -6.828
   86    H    SER  12           H        SER  12   1.962  15.683  -5.261
   87    HA   SER  12           HA       SER  12   3.222  18.186  -4.567
   88    HB2  SER  12           2HB      SER  12   3.137  15.440  -3.431
   89    HB3  SER  12           3HB      SER  12   4.559  16.414  -3.059
   90    HG   SER  12           HG       SER  12   3.039  18.070  -2.373
   91    H    SER  13           H        SER  13   3.876  15.565  -6.649
   92    HA   SER  13           HA       SER  13   6.659  15.446  -6.638
   93    HB2  SER  13           2HB      SER  13   4.577  14.365  -8.189
   94    HB3  SER  13           3HB      SER  13   5.638  15.193  -9.329
   95    HG   SER  13           HG       SER  13   6.394  13.111  -9.041
   96    HA   PRO  14           HA       PRO  14   6.593  18.905 -10.035
   97    HB2  PRO  14           2HB      PRO  14   4.308  20.356 -10.239
   98    HB3  PRO  14           3HB      PRO  14   4.601  18.888 -11.178
   99    HG2  PRO  14           2HG      PRO  14   3.007  19.245  -8.669
  100    HG3  PRO  14           3HG      PRO  14   2.615  18.303 -10.119
  101    HD2  PRO  14           2HD      PRO  14   3.585  17.166  -7.861
  102    HD3  PRO  14           3HD      PRO  14   3.942  16.531  -9.479
  103    H    ALA  15           H        ALA  15   4.972  19.271  -6.970
  104    HA   ALA  15           HA       ALA  15   5.630  22.062  -6.675
  105    HB1  ALA  15           1HB      ALA  15   4.976  20.679  -4.211
  106    HB2  ALA  15           2HB      ALA  15   4.153  22.020  -5.008
  107    HB3  ALA  15           3HB      ALA  15   3.803  20.360  -5.489
  108    H    ILE  16           H        ILE  16   6.852  18.982  -5.434
  109    HA   ILE  16           HA       ILE  16   8.821  20.162  -3.740
  110    HB   ILE  16           HB       ILE  16   8.569  17.356  -4.824
  111   HG12  ILE  16          2HG1      ILE  16   6.785  18.121  -3.269
  112   HG13  ILE  16          3HG1      ILE  16   7.749  16.805  -2.609
  113   HG21  ILE  16          1HG2      ILE  16  10.133  17.334  -2.509
  114   HG22  ILE  16          2HG2      ILE  16  10.659  17.009  -4.159
  115   HG23  ILE  16          3HG2      ILE  16  10.777  18.641  -3.502
  116   HD11  ILE  16          3HD1      ILE  16   7.259  18.518  -0.942
  117   HD12  ILE  16          1HD1      ILE  16   8.990  18.374  -1.242
  118   HD13  ILE  16          2HD1      ILE  16   8.084  19.718  -1.936
  119    H    LEU  17           H        LEU  17   8.840  18.839  -7.016
  120    HA   LEU  17           HA       LEU  17  11.655  19.086  -7.383
  121    HB2  LEU  17           2HB      LEU  17   9.322  18.364  -9.011
  122    HB3  LEU  17           3HB      LEU  17  10.641  19.115  -9.906
  123    HG   LEU  17           HG       LEU  17  10.743  16.665  -9.969
  124   HD11  LEU  17          1HD1      LEU  17  12.858  18.410  -8.974
  125   HD12  LEU  17          2HD1      LEU  17  12.883  17.223 -10.278
  126   HD13  LEU  17          3HD1      LEU  17  13.119  16.704  -8.609
  127   HD21  LEU  17          3HD2      LEU  17  11.284  16.790  -7.009
  128   HD22  LEU  17          1HD2      LEU  17  11.144  15.354  -8.023
  129   HD23  LEU  17          2HD2      LEU  17   9.723  16.347  -7.701
  130    H    GLY  18           H        GLY  18   8.907  21.192  -7.892
  131    HA2  GLY  18           2HA      GLY  18  10.415  23.130  -9.415
  132    HA3  GLY  18           3HA      GLY  18   8.765  23.309  -8.836
  133    H    LYS  19           H        LYS  19   9.567  22.624  -6.069
  134    HA   LYS  19           HA       LYS  19  10.278  25.294  -5.253
  135    HB2  LYS  19           2HB      LYS  19   9.488  22.780  -3.819
  136    HB3  LYS  19           3HB      LYS  19  10.169  24.131  -2.922
  137    HG2  LYS  19           2HG      LYS  19   8.367  25.524  -3.415
  138    HG3  LYS  19           3HG      LYS  19   7.828  24.506  -4.753
  139    HD2  LYS  19           2HD      LYS  19   6.331  24.194  -2.901
  140    HD3  LYS  19           3HD      LYS  19   7.290  22.725  -3.100
  141    HE2  LYS  19           2HE      LYS  19   7.747  22.898  -0.923
  142    HE3  LYS  19           3HE      LYS  19   8.798  24.243  -1.361
  143    HZ1  LYS  19           3HZ      LYS  19   6.123  25.130  -1.164
  144    HZ2  LYS  19           1HZ      LYS  19   7.477  25.632  -0.281
  145    HZ3  LYS  19           2HZ      LYS  19   6.554  24.321   0.257
  146    H    ALA  20           H        ALA  20  11.835  22.168  -5.445
  147    HA   ALA  20           HA       ALA  20  14.074  22.758  -3.818
  148    HB1  ALA  20           1HB      ALA  20  15.132  20.835  -5.041
  149    HB2  ALA  20           2HB      ALA  20  13.585  20.478  -4.271
  150    HB3  ALA  20           3HB      ALA  20  13.663  20.739  -6.013
  151    H    ALA  21           H        ALA  21  13.392  23.218  -7.241
  152    HA   ALA  21           HA       ALA  21  16.040  23.950  -7.982
  153    HB1  ALA  21           1HB      ALA  21  13.430  24.578  -9.357
  154    HB2  ALA  21           2HB      ALA  21  15.039  24.714 -10.068
  155    HB3  ALA  21           3HB      ALA  21  14.408  23.132  -9.610
  156    H    THR  22           H        THR  22  13.184  25.756  -6.963
  157    HA   THR  22           HA       THR  22  14.431  28.319  -7.384
  158    HB   THR  22           HB       THR  22  11.894  27.665  -5.873
  159    HG1  THR  22           HG1      THR  22  11.534  27.078  -7.964
  160   HG21  THR  22          3HG2      THR  22  11.923  29.821  -5.306
  161   HG22  THR  22          1HG2      THR  22  11.763  30.216  -7.016
  162   HG23  THR  22          2HG2      THR  22  13.363  30.113  -6.281
  163    H    ASP  23           H        ASP  23  14.198  26.020  -4.816
  164    HA   ASP  23           HA       ASP  23  14.774  27.845  -2.684
  165    HB2  ASP  23           2HB      ASP  23  14.646  24.863  -2.952
  166    HB3  ASP  23           3HB      ASP  23  15.385  25.576  -1.520
  167    H    VAL  24           H        VAL  24  16.662  25.675  -4.725
  168    HA   VAL  24           HA       VAL  24  19.116  26.020  -3.328
  169    HB   VAL  24           HB       VAL  24  18.633  25.144  -6.179
  170   HG11  VAL  24          1HG1      VAL  24  21.091  25.298  -4.490
  171   HG12  VAL  24          2HG1      VAL  24  20.933  24.014  -5.690
  172   HG13  VAL  24          3HG1      VAL  24  20.870  25.704  -6.192
  173   HG21  VAL  24          3HG2      VAL  24  19.464  23.160  -4.200
  174   HG22  VAL  24          1HG2      VAL  24  17.879  23.865  -3.880
  175   HG23  VAL  24          2HG2      VAL  24  18.199  23.078  -5.426
  176    H    VAL  25           H        VAL  25  17.559  27.683  -6.001
  177    HA   VAL  25           HA       VAL  25  19.814  29.230  -6.777
  178    HB   VAL  25           HB       VAL  25  16.874  29.783  -7.204
  179   HG11  VAL  25          1HG1      VAL  25  19.360  31.107  -8.198
  180   HG12  VAL  25          2HG1      VAL  25  17.920  31.066  -9.217
  181   HG13  VAL  25          3HG1      VAL  25  17.855  31.828  -7.627
  182   HG21  VAL  25          3HG2      VAL  25  18.363  27.698  -8.192
  183   HG22  VAL  25          1HG2      VAL  25  16.895  28.349  -8.920
  184   HG23  VAL  25          2HG2      VAL  25  18.475  28.900  -9.477
  185    H    ALA  26           H        ALA  26  17.176  29.717  -4.500
  186    HA   ALA  26           HA       ALA  26  17.909  32.445  -3.932
  187    HB1  ALA  26           1HB      ALA  26  15.927  32.574  -2.906
  188    HB2  ALA  26           2HB      ALA  26  15.611  30.990  -3.615
  189    HB3  ALA  26           3HB      ALA  26  16.216  31.111  -1.963
  190    H    ALA  27           H        ALA  27  18.509  29.281  -2.551
  191    HA   ALA  27           HA       ALA  27  19.460  30.049  -0.033
  192    HB1  ALA  27           1HB      ALA  27  20.948  27.831  -0.634
  193    HB2  ALA  27           2HB      ALA  27  19.318  27.819   0.040
  194    HB3  ALA  27           3HB      ALA  27  19.554  27.655  -1.700
  195    H    TRP  28           H        TRP  28  20.836  30.424  -3.149
  196    HA   TRP  28           HA       TRP  28  23.572  30.396  -2.560
  197    HB2  TRP  28           2HB      TRP  28  22.474  30.503  -4.851
  198    HB3  TRP  28           3HB      TRP  28  22.266  32.230  -4.571
  199    HD1  TRP  28           HD1      TRP  28  25.385  30.000  -3.940
  200    HE1  TRP  28           HE1      TRP  28  27.375  31.063  -5.179
  201    HE3  TRP  28           HE3      TRP  28  22.956  33.899  -6.185
  202    HZ2  TRP  28           HZ2      TRP  28  27.853  33.263  -6.881
  203    HZ3  TRP  28           HZ3      TRP  28  24.253  35.437  -7.602
  204    HH2  TRP  28           HH2      TRP  28  26.650  35.124  -7.941
  205    H    LYS  29           H        LYS  29  21.114  32.766  -1.926
  206    HA   LYS  29           HA       LYS  29  22.856  34.976  -1.482
  207    HB2  LYS  29           2HB      LYS  29  20.949  36.130  -0.682
  208    HB3  LYS  29           3HB      LYS  29  20.368  35.081  -1.968
  209    HG2  LYS  29           2HG      LYS  29  19.942  33.440   0.064
  210    HG3  LYS  29           3HG      LYS  29  19.870  34.964   0.951
  211    HD2  LYS  29           2HD      LYS  29  18.346  34.761  -1.592
  212    HD3  LYS  29           3HD      LYS  29  17.724  33.895  -0.186
  213    HE2  LYS  29           2HE      LYS  29  16.766  35.822   0.403
  214    HE3  LYS  29           3HE      LYS  29  18.385  36.374   0.828
  215    HZ1  LYS  29           3HZ      LYS  29  18.515  37.025  -1.642
  216    HZ2  LYS  29           1HZ      LYS  29  17.628  38.010  -0.590
  217    HZ3  LYS  29           2HZ      LYS  29  16.827  36.925  -1.610
  218    H    SER  30           H        SER  30  21.622  32.375   0.508
  219    HA   SER  30           HA       SER  30  22.359  33.498   3.015
  220    HB2  SER  30           2HB      SER  30  20.719  31.787   3.080
  221    HB3  SER  30           3HB      SER  30  21.712  30.691   2.119
  222    HG   SER  30           HG       SER  30  22.507  31.620   4.670
  Start of MODEL   18
    1    H1   VAL   1           H        VAL   1   0.816  -0.742   0.211
    2    HA   VAL   1           HA       VAL   1   2.692  -0.509  -1.323
    3    HB   VAL   1           HB       VAL   1   1.553  -0.519  -3.507
    4   HG11  VAL   1          1HG1      VAL   1   0.605  -2.572  -3.199
    5   HG12  VAL   1          2HG1      VAL   1   1.460  -2.415  -1.663
    6   HG13  VAL   1          3HG1      VAL   1  -0.269  -2.075  -1.750
    7   HG21  VAL   1          3HG2      VAL   1  -0.164   0.947  -3.615
    8   HG22  VAL   1          1HG2      VAL   1  -1.105  -0.451  -3.095
    9   HG23  VAL   1          2HG2      VAL   1  -0.583   0.749  -1.913
   10    H    LYS   2           H        LYS   2   3.186   0.768  -3.475
   11    HA   LYS   2           HA       LYS   2   3.662   3.492  -2.658
   12    HB2  LYS   2           2HB      LYS   2   5.141   3.637  -4.485
   13    HB3  LYS   2           3HB      LYS   2   5.305   1.985  -3.904
   14    HG2  LYS   2           2HG      LYS   2   5.139   1.548  -6.114
   15    HG3  LYS   2           3HG      LYS   2   3.416   1.575  -5.731
   16    HD2  LYS   2           2HD      LYS   2   3.403   2.996  -7.510
   17    HD3  LYS   2           3HD      LYS   2   3.746   4.166  -6.235
   18    HE2  LYS   2           2HE      LYS   2   6.206   3.728  -6.718
   19    HE3  LYS   2           3HE      LYS   2   5.662   2.905  -8.179
   20    HZ1  LYS   2           3HZ      LYS   2   6.233   5.485  -8.108
   21    HZ2  LYS   2           1HZ      LYS   2   4.589   5.570  -7.715
   22    HZ3  LYS   2           2HZ      LYS   2   5.077   4.835  -9.158
   23    H    GLY   3           H        GLY   3   1.322   1.831  -4.517
   24    HA2  GLY   3           2HA      GLY   3   0.603   3.889  -6.329
   25    HA3  GLY   3           3HA      GLY   3  -0.411   2.536  -5.851
   26    H    ARG   4           H        ARG   4  -0.362   3.172  -3.025
   27    HA   ARG   4           HA       ARG   4  -2.563   4.969  -2.962
   28    HB2  ARG   4           2HB      ARG   4  -2.666   4.535  -0.639
   29    HB3  ARG   4           3HB      ARG   4  -2.123   3.033  -1.377
   30    HG2  ARG   4           2HG      ARG   4   0.256   4.017  -0.846
   31    HG3  ARG   4           3HG      ARG   4  -0.646   4.942   0.356
   32    HD2  ARG   4           2HD      ARG   4  -1.580   2.823   1.225
   33    HD3  ARG   4           3HD      ARG   4  -0.578   1.940   0.074
   34    HE   ARG   4           HE       ARG   4   1.173   3.511   1.472
   35   HH11  ARG   4          1HH1      ARG   4  -1.188   1.087   2.291
   36   HH12  ARG   4          2HH1      ARG   4  -0.333   0.543   3.696
   37   HH21  ARG   4          1HH2      ARG   4   2.308   2.802   3.320
   38   HH22  ARG   4          2HH2      ARG   4   1.655   1.519   4.281
   39    H    ILE   5           H        ILE   5   0.860   5.256  -2.188
   40    HA   ILE   5           HA       ILE   5   0.542   7.981  -1.243
   41    HB   ILE   5           HB       ILE   5   2.180   6.570  -0.126
   42   HG12  ILE   5          2HG1      ILE   5   3.784   8.575  -1.689
   43   HG13  ILE   5          3HG1      ILE   5   2.524   9.103  -0.579
   44   HG21  ILE   5          1HG2      ILE   5   4.345   6.179  -1.588
   45   HG22  ILE   5          2HG2      ILE   5   3.015   5.022  -1.580
   46   HG23  ILE   5          3HG2      ILE   5   3.168   6.180  -2.901
   47   HD11  ILE   5          3HD1      ILE   5   5.089   7.689   0.019
   48   HD12  ILE   5          1HD1      ILE   5   4.464   9.197   0.686
   49   HD13  ILE   5          2HD1      ILE   5   3.741   7.658   1.156
   50    H    ASP   6           H        ASP   6   1.202   6.350  -4.181
   51    HA   ASP   6           HA       ASP   6   2.707   8.380  -5.480
   52    HB2  ASP   6           2HB      ASP   6   2.855   6.234  -6.444
   53    HB3  ASP   6           3HB      ASP   6   1.106   6.028  -6.463
   54    H    ALA   7           H        ALA   7  -0.729   7.706  -5.165
   55    HA   ALA   7           HA       ALA   7  -1.712   9.460  -7.106
   56    HB1  ALA   7           1HB      ALA   7  -2.784   7.847  -5.038
   57    HB2  ALA   7           2HB      ALA   7  -3.492   9.456  -4.893
   58    HB3  ALA   7           3HB      ALA   7  -3.620   8.570  -6.412
   59    HA   PRO   8           HA       PRO   8  -1.973  12.823  -3.637
   60    HB2  PRO   8           2HB      PRO   8  -0.600  12.342  -1.345
   61    HB3  PRO   8           3HB      PRO   8  -2.282  11.850  -1.579
   62    HG2  PRO   8           2HG      PRO   8   0.219  10.223  -1.827
   63    HG3  PRO   8           3HG      PRO   8  -1.325   9.793  -1.069
   64    HD2  PRO   8           2HD      PRO   8  -0.634   8.951  -3.548
   65    HD3  PRO   8           3HD      PRO   8  -2.316   9.281  -3.086
   66    H    ASP   9           H        ASP   9   1.003  10.985  -3.990
   67    HA   ASP   9           HA       ASP   9   2.705  13.283  -3.632
   68    HB2  ASP   9           2HB      ASP   9   3.503  11.065  -2.986
   69    HB3  ASP   9           3HB      ASP   9   3.323  10.500  -4.645
   70    H    PHE  10           H        PHE  10   0.930  11.916  -6.195
   71    HA   PHE  10           HA       PHE  10   2.510  12.502  -8.417
   72    HB2  PHE  10           2HB      PHE  10  -0.064  11.540  -7.983
   73    HB3  PHE  10           3HB      PHE  10  -0.313  13.030  -8.887
   74    HD1  PHE  10           HD1      PHE  10   1.431  13.289 -10.923
   75    HD2  PHE  10           HD2      PHE  10   0.124   9.620  -9.207
   76    HE1  PHE  10           HE1      PHE  10   1.993  12.116 -13.012
   77    HE2  PHE  10           HE2      PHE  10   0.685   8.441 -11.292
   78    HZ   PHE  10           HZ       PHE  10   1.621   9.689 -13.198
   79    HA   PRO  11           HA       PRO  11   0.371  16.845  -8.533
   80    HB2  PRO  11           2HB      PRO  11  -0.923  17.630  -6.280
   81    HB3  PRO  11           3HB      PRO  11  -1.721  16.749  -7.588
   82    HG2  PRO  11           2HG      PRO  11  -0.645  15.719  -4.992
   83    HG3  PRO  11           3HG      PRO  11  -2.169  15.323  -5.807
   84    HD2  PRO  11           2HD      PRO  11   0.004  13.711  -5.917
   85    HD3  PRO  11           3HD      PRO  11  -1.155  13.844  -7.255
   86    H    SER  12           H        SER  12   1.768  15.658  -5.542
   87    HA   SER  12           HA       SER  12   2.911  18.211  -4.830
   88    HB2  SER  12           2HB      SER  12   2.624  15.584  -3.587
   89    HB3  SER  12           3HB      SER  12   4.214  16.295  -3.308
   90    HG   SER  12           HG       SER  12   1.826  17.756  -2.913
   91    H    SER  13           H        SER  13   3.763  15.577  -6.819
   92    HA   SER  13           HA       SER  13   6.544  15.545  -6.635
   93    HB2  SER  13           2HB      SER  13   4.646  14.275  -8.200
   94    HB3  SER  13           3HB      SER  13   5.570  15.215  -9.371
   95    HG   SER  13           HG       SER  13   7.177  13.893  -9.117
   96    HA   PRO  14           HA       PRO  14   6.572  18.918 -10.118
   97    HB2  PRO  14           2HB      PRO  14   4.258  20.286 -10.495
   98    HB3  PRO  14           3HB      PRO  14   4.653  18.806 -11.377
   99    HG2  PRO  14           2HG      PRO  14   2.901  19.170  -8.977
  100    HG3  PRO  14           3HG      PRO  14   2.627  18.181 -10.423
  101    HD2  PRO  14           2HD      PRO  14   3.496  17.132  -8.082
  102    HD3  PRO  14           3HD      PRO  14   3.970  16.470  -9.659
  103    H    ALA  15           H        ALA  15   4.750  19.308  -7.170
  104    HA   ALA  15           HA       ALA  15   5.310  22.124  -6.909
  105    HB1  ALA  15           1HB      ALA  15   4.419  20.431  -4.618
  106    HB2  ALA  15           2HB      ALA  15   3.983  22.090  -5.028
  107    HB3  ALA  15           3HB      ALA  15   3.309  20.748  -5.951
  108    H    ILE  16           H        ILE  16   6.521  19.113  -5.494
  109    HA   ILE  16           HA       ILE  16   8.366  20.422  -3.742
  110    HB   ILE  16           HB       ILE  16   7.423  18.126  -3.354
  111   HG12  ILE  16          2HG1      ILE  16   9.597  17.184  -2.519
  112   HG13  ILE  16          3HG1      ILE  16  10.426  18.487  -3.363
  113   HG21  ILE  16          1HG2      ILE  16   9.425  17.340  -5.469
  114   HG22  ILE  16          2HG2      ILE  16   8.484  16.234  -4.470
  115   HG23  ILE  16          3HG2      ILE  16   7.670  17.279  -5.634
  116   HD11  ILE  16          3HD1      ILE  16   9.846  18.668  -0.819
  117   HD12  ILE  16          1HD1      ILE  16   9.731  20.073  -1.878
  118   HD13  ILE  16          2HD1      ILE  16   8.276  19.181  -1.435
  119    H    LEU  17           H        LEU  17   8.512  19.062  -6.973
  120    HA   LEU  17           HA       LEU  17  11.366  19.212  -7.184
  121    HB2  LEU  17           2HB      LEU  17   9.769  17.699  -8.487
  122    HB3  LEU  17           3HB      LEU  17   9.438  19.113  -9.484
  123    HG   LEU  17           HG       LEU  17  12.133  19.050  -9.622
  124   HD11  LEU  17          1HD1      LEU  17  12.329  16.424 -10.200
  125   HD12  LEU  17          2HD1      LEU  17  11.245  16.365  -8.811
  126   HD13  LEU  17          3HD1      LEU  17  12.824  17.136  -8.663
  127   HD21  LEU  17          3HD2      LEU  17  10.561  17.280 -11.446
  128   HD22  LEU  17          1HD2      LEU  17  11.842  18.431 -11.827
  129   HD23  LEU  17          2HD2      LEU  17  10.233  19.013 -11.397
  130    H    GLY  18           H        GLY  18   8.669  21.314  -7.945
  131    HA2  GLY  18           2HA      GLY  18  10.295  23.181  -9.438
  132    HA3  GLY  18           3HA      GLY  18   8.608  23.388  -8.991
  133    H    LYS  19           H        LYS  19   9.213  22.809  -6.144
  134    HA   LYS  19           HA       LYS  19   9.863  25.511  -5.386
  135    HB2  LYS  19           2HB      LYS  19   8.987  23.050  -3.906
  136    HB3  LYS  19           3HB      LYS  19   9.589  24.449  -3.026
  137    HG2  LYS  19           2HG      LYS  19   7.829  25.817  -3.802
  138    HG3  LYS  19           3HG      LYS  19   7.343  24.627  -5.012
  139    HD2  LYS  19           2HD      LYS  19   6.345  23.251  -3.450
  140    HD3  LYS  19           3HD      LYS  19   7.323  23.877  -2.121
  141    HE2  LYS  19           2HE      LYS  19   5.926  25.613  -1.736
  142    HE3  LYS  19           3HE      LYS  19   5.540  25.820  -3.444
  143    HZ1  LYS  19           3HZ      LYS  19   3.907  24.727  -1.569
  144    HZ2  LYS  19           1HZ      LYS  19   4.527  23.367  -2.362
  145    HZ3  LYS  19           2HZ      LYS  19   3.727  24.569  -3.243
  146    H    ALA  20           H        ALA  20  11.440  22.394  -5.375
  147    HA   ALA  20           HA       ALA  20  13.556  23.042  -3.609
  148    HB1  ALA  20           1HB      ALA  20  12.909  20.734  -4.231
  149    HB2  ALA  20           2HB      ALA  20  13.579  21.014  -5.839
  150    HB3  ALA  20           3HB      ALA  20  14.633  21.051  -4.426
  151    H    ALA  21           H        ALA  21  13.116  23.401  -7.083
  152    HA   ALA  21           HA       ALA  21  15.806  24.126  -7.658
  153    HB1  ALA  21           1HB      ALA  21  13.351  24.817  -9.262
  154    HB2  ALA  21           2HB      ALA  21  15.016  24.719  -9.836
  155    HB3  ALA  21           3HB      ALA  21  14.170  23.257  -9.329
  156    H    THR  22           H        THR  22  12.880  25.949  -6.897
  157    HA   THR  22           HA       THR  22  14.153  28.503  -7.294
  158    HB   THR  22           HB       THR  22  11.513  27.887  -5.953
  159    HG1  THR  22           HG1      THR  22  12.205  28.439  -8.656
  160   HG21  THR  22          3HG2      THR  22  12.997  30.347  -6.446
  161   HG22  THR  22          1HG2      THR  22  11.602  30.059  -5.406
  162   HG23  THR  22          2HG2      THR  22  11.369  30.381  -7.124
  163    H    ASP  23           H        ASP  23  13.737  26.273  -4.691
  164    HA   ASP  23           HA       ASP  23  14.151  28.156  -2.572
  165    HB2  ASP  23           2HB      ASP  23  14.047  25.168  -2.770
  166    HB3  ASP  23           3HB      ASP  23  14.683  25.918  -1.309
  167    H    VAL  24           H        VAL  24  16.189  25.949  -4.416
  168    HA   VAL  24           HA       VAL  24  18.533  26.344  -2.851
  169    HB   VAL  24           HB       VAL  24  18.263  25.380  -5.702
  170   HG11  VAL  24          1HG1      VAL  24  20.589  25.645  -3.861
  171   HG12  VAL  24          2HG1      VAL  24  20.527  24.269  -4.965
  172   HG13  VAL  24          3HG1      VAL  24  20.490  25.914  -5.601
  173   HG21  VAL  24          3HG2      VAL  24  18.959  23.449  -3.630
  174   HG22  VAL  24          1HG2      VAL  24  17.364  24.168  -3.409
  175   HG23  VAL  24          2HG2      VAL  24  17.759  23.345  -4.918
  176    H    VAL  25           H        VAL  25  17.171  27.916  -5.682
  177    HA   VAL  25           HA       VAL  25  19.472  29.452  -6.336
  178    HB   VAL  25           HB       VAL  25  16.569  29.975  -6.994
  179   HG11  VAL  25          1HG1      VAL  25  17.453  31.998  -7.517
  180   HG12  VAL  25          2HG1      VAL  25  19.088  31.361  -7.705
  181   HG13  VAL  25          3HG1      VAL  25  17.901  31.140  -8.991
  182   HG21  VAL  25          3HG2      VAL  25  18.137  27.870  -7.807
  183   HG22  VAL  25          1HG2      VAL  25  16.722  28.489  -8.659
  184   HG23  VAL  25          2HG2      VAL  25  18.335  29.034  -9.117
  185    H    ALA  26           H        ALA  26  16.671  29.992  -4.274
  186    HA   ALA  26           HA       ALA  26  17.351  32.740  -3.737
  187    HB1  ALA  26           1HB      ALA  26  15.558  31.753  -1.781
  188    HB2  ALA  26           2HB      ALA  26  15.215  32.810  -3.150
  189    HB3  ALA  26           3HB      ALA  26  15.092  31.061  -3.335
  190    H    ALA  27           H        ALA  27  17.859  29.623  -2.220
  191    HA   ALA  27           HA       ALA  27  18.844  30.738   0.247
  192    HB1  ALA  27           1HB      ALA  27  19.411  28.404   0.803
  193    HB2  ALA  27           2HB      ALA  27  17.734  28.591   0.288
  194    HB3  ALA  27           3HB      ALA  27  18.928  27.920  -0.823
  195    H    TRP  28           H        TRP  28  20.144  30.004  -2.837
  196    HA   TRP  28           HA       TRP  28  22.801  29.401  -2.199
  197    HB2  TRP  28           2HB      TRP  28  21.298  29.973  -4.550
  198    HB3  TRP  28           3HB      TRP  28  22.745  30.978  -4.578
  199    HD1  TRP  28           HD1      TRP  28  22.381  27.308  -3.365
  200    HE1  TRP  28           HE1      TRP  28  24.074  25.875  -4.671
  201    HE3  TRP  28           HE3      TRP  28  24.265  30.905  -6.472
  202    HZ2  TRP  28           HZ2      TRP  28  25.958  26.223  -6.744
  203    HZ3  TRP  28           HZ3      TRP  28  26.010  30.272  -8.087
  204    HH2  TRP  28           HH2      TRP  28  26.838  27.979  -8.218
  205    H    LYS  29           H        LYS  29  21.055  32.365  -2.031
  206    HA   LYS  29           HA       LYS  29  23.229  34.170  -2.220
  207    HB2  LYS  29           2HB      LYS  29  21.721  35.826  -1.341
  208    HB3  LYS  29           3HB      LYS  29  20.830  34.803  -2.460
  209    HG2  LYS  29           2HG      LYS  29  19.323  34.875  -0.772
  210    HG3  LYS  29           3HG      LYS  29  20.272  33.490  -0.225
  211    HD2  LYS  29           2HD      LYS  29  20.675  34.573   1.675
  212    HD3  LYS  29           3HD      LYS  29  21.572  35.785   0.757
  213    HE2  LYS  29           2HE      LYS  29  19.106  36.668   0.284
  214    HE3  LYS  29           3HE      LYS  29  18.802  35.859   1.820
  215    HZ1  LYS  29           3HZ      LYS  29  21.151  37.359   2.068
  216    HZ2  LYS  29           1HZ      LYS  29  19.673  37.590   2.859
  217    HZ3  LYS  29           2HZ      LYS  29  19.973  38.362   1.385
  218    H    SER  30           H        SER  30  21.851  32.318   0.414
  219    HA   SER  30           HA       SER  30  23.044  33.660   2.568
  220    HB2  SER  30           2HB      SER  30  21.272  31.690   2.457
  221    HB3  SER  30           3HB      SER  30  22.710  30.693   2.679
  222    HG   SER  30           HG       SER  30  21.656  31.366   4.657
  Start of MODEL   19
    1    H1   VAL   1           H        VAL   1   2.211  -1.033   0.461
    2    HA   VAL   1           HA       VAL   1   2.845  -0.673  -1.796
    3    HB   VAL   1           HB       VAL   1   0.083   0.529  -1.690
    4   HG11  VAL   1          1HG1      VAL   1   0.475  -1.387  -3.756
    5   HG12  VAL   1          2HG1      VAL   1   0.155   0.342  -3.900
    6   HG13  VAL   1          3HG1      VAL   1   1.816  -0.242  -3.792
    7   HG21  VAL   1          3HG2      VAL   1  -0.380  -2.103  -2.064
    8   HG22  VAL   1          1HG2      VAL   1   1.004  -2.175  -0.973
    9   HG23  VAL   1          2HG2      VAL   1  -0.454  -1.307  -0.492
   10    H    LYS   2           H        LYS   2   3.473   0.740  -3.399
   11    HA   LYS   2           HA       LYS   2   3.985   3.446  -2.551
   12    HB2  LYS   2           2HB      LYS   2   5.390   3.623  -4.434
   13    HB3  LYS   2           3HB      LYS   2   5.569   1.959  -3.893
   14    HG2  LYS   2           2HG      LYS   2   5.313   1.569  -6.105
   15    HG3  LYS   2           3HG      LYS   2   3.607   1.592  -5.650
   16    HD2  LYS   2           2HD      LYS   2   3.520   3.052  -7.394
   17    HD3  LYS   2           3HD      LYS   2   3.929   4.194  -6.112
   18    HE2  LYS   2           2HE      LYS   2   6.245   4.140  -6.719
   19    HE3  LYS   2           3HE      LYS   2   5.968   2.823  -7.857
   20    HZ1  LYS   2           3HZ      LYS   2   5.176   4.218  -9.415
   21    HZ2  LYS   2           1HZ      LYS   2   6.069   5.379  -8.568
   22    HZ3  LYS   2           2HZ      LYS   2   4.406   5.230  -8.300
   23    H    GLY   3           H        GLY   3   1.577   1.832  -4.377
   24    HA2  GLY   3           2HA      GLY   3   0.795   3.932  -6.107
   25    HA3  GLY   3           3HA      GLY   3  -0.209   2.576  -5.615
   26    H    ARG   4           H        ARG   4  -0.088   3.127  -2.793
   27    HA   ARG   4           HA       ARG   4  -2.266   4.925  -2.595
   28    HB2  ARG   4           2HB      ARG   4  -0.501   3.976  -0.336
   29    HB3  ARG   4           3HB      ARG   4  -2.162   4.541  -0.226
   30    HG2  ARG   4           2HG      ARG   4  -1.300   2.056  -1.689
   31    HG3  ARG   4           3HG      ARG   4  -1.932   2.088  -0.042
   32    HD2  ARG   4           2HD      ARG   4  -3.427   3.187  -2.413
   33    HD3  ARG   4           3HD      ARG   4  -3.601   1.527  -1.844
   34    HE   ARG   4           HE       ARG   4  -4.705   3.891  -0.649
   35   HH11  ARG   4          1HH1      ARG   4  -3.640   0.629  -0.060
   36   HH12  ARG   4          2HH1      ARG   4  -4.636   0.418   1.341
   37   HH21  ARG   4          1HH2      ARG   4  -6.021   3.625   1.195
   38   HH22  ARG   4          2HH2      ARG   4  -5.991   2.123   2.054
   39    H    ILE   5           H        ILE   5   1.184   5.226  -1.904
   40    HA   ILE   5           HA       ILE   5   0.882   7.950  -0.965
   41    HB   ILE   5           HB       ILE   5   2.576   6.416   0.020
   42   HG12  ILE   5          2HG1      ILE   5   4.426   8.392  -0.934
   43   HG13  ILE   5          3HG1      ILE   5   2.847   9.138  -0.718
   44   HG21  ILE   5          1HG2      ILE   5   4.587   5.872  -1.181
   45   HG22  ILE   5          2HG2      ILE   5   3.198   5.315  -2.112
   46   HG23  ILE   5          3HG2      ILE   5   4.043   6.788  -2.586
   47   HD11  ILE   5          3HD1      ILE   5   3.466   9.390   1.403
   48   HD12  ILE   5          1HD1      ILE   5   3.117   7.669   1.570
   49   HD13  ILE   5          2HD1      ILE   5   4.767   8.208   1.260
   50    H    ASP   6           H        ASP   6   1.448   6.331  -3.928
   51    HA   ASP   6           HA       ASP   6   2.905   8.361  -5.277
   52    HB2  ASP   6           2HB      ASP   6   2.948   6.149  -6.187
   53    HB3  ASP   6           3HB      ASP   6   1.190   6.086  -6.278
   54    H    ALA   7           H        ALA   7  -0.519   7.715  -4.816
   55    HA   ALA   7           HA       ALA   7  -1.570   9.479  -6.713
   56    HB1  ALA   7           1HB      ALA   7  -3.449   9.585  -4.789
   57    HB2  ALA   7           2HB      ALA   7  -3.260   8.227  -5.899
   58    HB3  ALA   7           3HB      ALA   7  -2.566   8.146  -4.280
   59    HA   PRO   8           HA       PRO   8  -1.660  12.838  -3.232
   60    HB2  PRO   8           2HB      PRO   8  -0.203  12.340  -0.996
   61    HB3  PRO   8           3HB      PRO   8  -1.898  11.864  -1.164
   62    HG2  PRO   8           2HG      PRO   8   0.576  10.215  -1.512
   63    HG3  PRO   8           3HG      PRO   8  -0.941   9.797  -0.695
   64    HD2  PRO   8           2HD      PRO   8  -0.355   8.953  -3.200
   65    HD3  PRO   8           3HD      PRO   8  -2.015   9.298  -2.672
   66    H    ASP   9           H        ASP   9   1.281  10.973  -3.705
   67    HA   ASP   9           HA       ASP   9   3.018  13.254  -3.410
   68    HB2  ASP   9           2HB      ASP   9   3.468  10.404  -4.287
   69    HB3  ASP   9           3HB      ASP   9   4.751  11.611  -4.316
   70    H    PHE  10           H        PHE  10   1.130  11.912  -5.904
   71    HA   PHE  10           HA       PHE  10   2.626  12.489  -8.185
   72    HB2  PHE  10           2HB      PHE  10   0.042  11.577  -7.637
   73    HB3  PHE  10           3HB      PHE  10  -0.193  13.048  -8.576
   74    HD1  PHE  10           HD1      PHE  10   2.158  10.145  -8.663
   75    HD2  PHE  10           HD2      PHE  10  -0.498  12.685 -10.810
   76    HE1  PHE  10           HE1      PHE  10   2.641   8.898 -10.728
   77    HE2  PHE  10           HE2      PHE  10  -0.020  11.441 -12.879
   78    HZ   PHE  10           HZ       PHE  10   1.550   9.544 -12.839
   79    HA   PRO  11           HA       PRO  11   0.524  16.851  -8.205
   80    HB2  PRO  11           2HB      PRO  11  -0.673  17.642  -5.901
   81    HB3  PRO  11           3HB      PRO  11  -1.530  16.772  -7.179
   82    HG2  PRO  11           2HG      PRO  11  -0.361  15.725  -4.629
   83    HG3  PRO  11           3HG      PRO  11  -1.920  15.344  -5.385
   84    HD2  PRO  11           2HD      PRO  11   0.233  13.714  -5.585
   85    HD3  PRO  11           3HD      PRO  11  -0.977  13.860  -6.876
   86    H    SER  12           H        SER  12   2.027  15.643  -5.275
   87    HA   SER  12           HA       SER  12   3.220  18.184  -4.602
   88    HB2  SER  12           2HB      SER  12   2.950  15.562  -3.351
   89    HB3  SER  12           3HB      SER  12   4.563  16.242  -3.142
   90    HG   SER  12           HG       SER  12   2.215  16.976  -1.991
   91    H    SER  13           H        SER  13   3.969  15.548  -6.630
   92    HA   SER  13           HA       SER  13   6.755  15.490  -6.555
   93    HB2  SER  13           2HB      SER  13   4.728  14.333  -8.128
   94    HB3  SER  13           3HB      SER  13   5.804  15.153  -9.259
   95    HG   SER  13           HG       SER  13   6.637  13.131  -8.934
   96    HA   PRO  14           HA       PRO  14   6.677  18.872 -10.028
   97    HB2  PRO  14           2HB      PRO  14   4.363  20.263 -10.310
   98    HB3  PRO  14           3HB      PRO  14   4.709  18.782 -11.211
   99    HG2  PRO  14           2HG      PRO  14   3.056  19.155  -8.743
  100    HG3  PRO  14           3HG      PRO  14   2.717  18.172 -10.179
  101    HD2  PRO  14           2HD      PRO  14   3.667  17.109  -7.877
  102    HD3  PRO  14           3HD      PRO  14   4.073  16.447  -9.473
  103    H    ALA  15           H        ALA  15   4.976  19.270  -7.010
  104    HA   ALA  15           HA       ALA  15   5.572  22.081  -6.764
  105    HB1  ALA  15           1HB      ALA  15   3.799  21.874  -5.434
  106    HB2  ALA  15           2HB      ALA  15   3.983  20.123  -5.334
  107    HB3  ALA  15           3HB      ALA  15   4.891  21.169  -4.242
  108    H    ILE  16           H        ILE  16   6.810  19.055  -5.406
  109    HA   ILE  16           HA       ILE  16   8.735  20.342  -3.724
  110    HB   ILE  16           HB       ILE  16   7.787  18.053  -3.306
  111   HG12  ILE  16          2HG1      ILE  16  10.090  17.068  -2.694
  112   HG13  ILE  16          3HG1      ILE  16  10.757  18.548  -3.374
  113   HG21  ILE  16          1HG2      ILE  16   8.784  16.155  -4.467
  114   HG22  ILE  16          2HG2      ILE  16   7.936  17.211  -5.595
  115   HG23  ILE  16          3HG2      ILE  16   9.696  17.255  -5.500
  116   HD11  ILE  16          3HD1      ILE  16  10.447  19.542  -1.430
  117   HD12  ILE  16          1HD1      ILE  16   8.707  19.312  -1.604
  118   HD13  ILE  16          2HD1      ILE  16   9.680  18.091  -0.783
  119    H    LEU  17           H        LEU  17   8.741  18.990  -6.962
  120    HA   LEU  17           HA       LEU  17  11.585  19.114  -7.285
  121    HB2  LEU  17           2HB      LEU  17  10.305  17.526  -8.564
  122    HB3  LEU  17           3HB      LEU  17   9.341  18.819  -9.274
  123    HG   LEU  17           HG       LEU  17  11.875  19.515 -10.033
  124   HD11  LEU  17          1HD1      LEU  17  11.770  16.573 -10.537
  125   HD12  LEU  17          2HD1      LEU  17  12.502  17.194  -9.059
  126   HD13  LEU  17          3HD1      LEU  17  13.140  17.679 -10.629
  127   HD21  LEU  17          3HD2      LEU  17  11.095  18.163 -12.187
  128   HD22  LEU  17          1HD2      LEU  17  10.335  19.677 -11.695
  129   HD23  LEU  17          2HD2      LEU  17   9.573  18.137 -11.294
  130    H    GLY  18           H        GLY  18   8.881  21.245  -7.933
  131    HA2  GLY  18           2HA      GLY  18  10.466  23.102  -9.483
  132    HA3  GLY  18           3HA      GLY  18   8.800  23.323  -8.970
  133    H    LYS  19           H        LYS  19   9.508  22.728  -6.151
  134    HA   LYS  19           HA       LYS  19  10.214  25.421  -5.410
  135    HB2  LYS  19           2HB      LYS  19   9.391  22.963  -3.889
  136    HB3  LYS  19           3HB      LYS  19  10.006  24.379  -3.046
  137    HG2  LYS  19           2HG      LYS  19   8.220  25.736  -3.929
  138    HG3  LYS  19           3HG      LYS  19   7.638  24.386  -4.906
  139    HD2  LYS  19           2HD      LYS  19   6.260  24.569  -2.945
  140    HD3  LYS  19           3HD      LYS  19   7.245  23.111  -2.808
  141    HE2  LYS  19           2HE      LYS  19   8.759  24.213  -1.301
  142    HE3  LYS  19           3HE      LYS  19   7.945  25.758  -1.545
  143    HZ1  LYS  19           3HZ      LYS  19   6.681  25.243   0.183
  144    HZ2  LYS  19           1HZ      LYS  19   7.317  23.677   0.275
  145    HZ3  LYS  19           2HZ      LYS  19   5.991  23.994  -0.725
  146    H    ALA  20           H        ALA  20  11.760  22.291  -5.476
  147    HA   ALA  20           HA       ALA  20  13.946  22.903  -3.785
  148    HB1  ALA  20           1HB      ALA  20  15.001  20.989  -5.287
  149    HB2  ALA  20           2HB      ALA  20  13.783  20.649  -4.057
  150    HB3  ALA  20           3HB      ALA  20  13.313  20.775  -5.753
  151    H    ALA  21           H        ALA  21  13.436  23.198  -7.269
  152    HA   ALA  21           HA       ALA  21  16.100  23.966  -7.890
  153    HB1  ALA  21           1HB      ALA  21  15.278  23.487  -9.897
  154    HB2  ALA  21           2HB      ALA  21  13.618  23.592  -9.309
  155    HB3  ALA  21           3HB      ALA  21  14.452  25.045  -9.860
  156    H    THR  22           H        THR  22  13.173  25.742  -7.065
  157    HA   THR  22           HA       THR  22  14.367  28.317  -7.565
  158    HB   THR  22           HB       THR  22  11.784  27.610  -6.158
  159    HG1  THR  22           HG1      THR  22  10.898  28.313  -8.205
  160   HG21  THR  22          3HG2      THR  22  13.147  30.175  -6.717
  161   HG22  THR  22          1HG2      THR  22  12.014  29.750  -5.435
  162   HG23  THR  22          2HG2      THR  22  11.417  30.117  -7.053
  163    H    ASP  23           H        ASP  23  14.137  26.123  -4.914
  164    HA   ASP  23           HA       ASP  23  14.615  28.074  -2.859
  165    HB2  ASP  23           2HB      ASP  23  14.451  25.089  -2.970
  166    HB3  ASP  23           3HB      ASP  23  15.199  25.851  -1.569
  167    H    VAL  24           H        VAL  24  16.560  25.791  -4.711
  168    HA   VAL  24           HA       VAL  24  18.965  26.134  -3.266
  169    HB   VAL  24           HB       VAL  24  18.553  25.297  -6.139
  170   HG11  VAL  24          1HG1      VAL  24  20.985  25.422  -4.405
  171   HG12  VAL  24          2HG1      VAL  24  20.849  24.186  -5.657
  172   HG13  VAL  24          3HG1      VAL  24  20.788  25.894  -6.093
  173   HG21  VAL  24          3HG2      VAL  24  19.366  23.304  -4.159
  174   HG22  VAL  24          1HG2      VAL  24  17.767  23.991  -3.871
  175   HG23  VAL  24          2HG2      VAL  24  18.131  23.218  -5.414
  176    H    VAL  25           H        VAL  25  17.610  27.764  -6.094
  177    HA   VAL  25           HA       VAL  25  19.897  29.351  -6.650
  178    HB   VAL  25           HB       VAL  25  18.295  30.771  -7.963
  179   HG11  VAL  25          1HG1      VAL  25  17.644  28.058  -8.863
  180   HG12  VAL  25          2HG1      VAL  25  18.505  29.355  -9.693
  181   HG13  VAL  25          3HG1      VAL  25  19.355  28.330  -8.536
  182   HG21  VAL  25          3HG2      VAL  25  16.006  30.054  -8.217
  183   HG22  VAL  25          1HG2      VAL  25  16.272  28.699  -7.120
  184   HG23  VAL  25          2HG2      VAL  25  16.330  30.353  -6.510
  185    H    ALA  26           H        ALA  26  17.135  29.731  -4.540
  186    HA   ALA  26           HA       ALA  26  17.655  32.513  -3.991
  187    HB1  ALA  26           1HB      ALA  26  15.493  32.351  -3.488
  188    HB2  ALA  26           2HB      ALA  26  15.573  30.592  -3.384
  189    HB3  ALA  26           3HB      ALA  26  15.993  31.578  -1.984
  190    H    ALA  27           H        ALA  27  18.376  29.414  -2.509
  191    HA   ALA  27           HA       ALA  27  19.192  30.299   0.018
  192    HB1  ALA  27           1HB      ALA  27  19.759  27.888  -1.636
  193    HB2  ALA  27           2HB      ALA  27  20.716  28.172  -0.181
  194    HB3  ALA  27           3HB      ALA  27  18.962  28.020  -0.068
  195    H    TRP  28           H        TRP  28  20.664  30.657  -3.056
  196    HA   TRP  28           HA       TRP  28  23.373  30.785  -2.369
  197    HB2  TRP  28           2HB      TRP  28  21.985  31.017  -4.691
  198    HB3  TRP  28           3HB      TRP  28  22.449  32.696  -4.424
  199    HD1  TRP  28           HD1      TRP  28  25.123  33.219  -4.350
  200    HE1  TRP  28           HE1      TRP  28  27.093  31.997  -5.466
  201    HE3  TRP  28           HE3      TRP  28  22.830  28.771  -5.396
  202    HZ2  TRP  28           HZ2      TRP  28  27.608  29.480  -6.636
  203    HZ3  TRP  28           HZ3      TRP  28  24.131  27.008  -6.516
  204    HH2  TRP  28           HH2      TRP  28  26.471  27.357  -7.122
  205    H    LYS  29           H        LYS  29  20.778  33.010  -1.832
  206    HA   LYS  29           HA       LYS  29  22.283  35.375  -1.488
  207    HB2  LYS  29           2HB      LYS  29  20.324  36.319  -0.549
  208    HB3  LYS  29           3HB      LYS  29  19.769  35.180  -1.768
  209    HG2  LYS  29           2HG      LYS  29  19.697  33.546   0.309
  210    HG3  LYS  29           3HG      LYS  29  19.531  35.069   1.186
  211    HD2  LYS  29           2HD      LYS  29  17.831  34.667  -1.215
  212    HD3  LYS  29           3HD      LYS  29  17.432  33.741   0.234
  213    HE2  LYS  29           2HE      LYS  29  16.445  35.528   1.105
  214    HE3  LYS  29           3HE      LYS  29  17.966  36.416   1.020
  215    HZ1  LYS  29           3HZ      LYS  29  15.636  36.812  -0.486
  216    HZ2  LYS  29           1HZ      LYS  29  16.867  36.340  -1.546
  217    HZ3  LYS  29           2HZ      LYS  29  17.084  37.685  -0.544
  218    H    SER  30           H        SER  30  21.522  32.698   0.635
  219    HA   SER  30           HA       SER  30  22.267  33.925   3.071
  220    HB2  SER  30           2HB      SER  30  20.926  31.900   3.069
  221    HB3  SER  30           3HB      SER  30  22.221  31.005   2.274
  222    HG   SER  30           HG       SER  30  21.849  31.417   4.879
  Start of MODEL   20
    1    H1   VAL   1           H        VAL   1   1.383  -1.556  -3.012
    2    HA   VAL   1           HA       VAL   1   0.579   0.027  -1.566
    3    HB   VAL   1           HB       VAL   1   3.342  -0.097  -0.365
    4   HG11  VAL   1          1HG1      VAL   1   2.311   1.363   1.006
    5   HG12  VAL   1          2HG1      VAL   1   0.696   0.854   0.507
    6   HG13  VAL   1          3HG1      VAL   1   1.594  -0.094   1.693
    7   HG21  VAL   1          3HG2      VAL   1   2.006  -1.965   1.014
    8   HG22  VAL   1          1HG2      VAL   1   1.237  -2.164  -0.560
    9   HG23  VAL   1          2HG2      VAL   1   2.986  -2.335  -0.404
   10    H    LYS   2           H        LYS   2   3.048   0.809  -3.648
   11    HA   LYS   2           HA       LYS   2   3.549   3.494  -2.729
   12    HB2  LYS   2           2HB      LYS   2   5.007   3.701  -4.568
   13    HB3  LYS   2           3HB      LYS   2   5.163   2.026  -4.056
   14    HG2  LYS   2           2HG      LYS   2   4.968   1.682  -6.281
   15    HG3  LYS   2           3HG      LYS   2   3.250   1.705  -5.875
   16    HD2  LYS   2           2HD      LYS   2   3.220   3.200  -7.591
   17    HD3  LYS   2           3HD      LYS   2   3.597   4.314  -6.275
   18    HE2  LYS   2           2HE      LYS   2   6.068   3.347  -7.062
   19    HE3  LYS   2           3HE      LYS   2   5.190   3.540  -8.578
   20    HZ1  LYS   2           3HZ      LYS   2   6.489   5.527  -7.690
   21    HZ2  LYS   2           1HZ      LYS   2   5.242   5.694  -6.559
   22    HZ3  LYS   2           2HZ      LYS   2   4.904   5.803  -8.212
   23    H    GLY   3           H        GLY   3   1.184   1.931  -4.652
   24    HA2  GLY   3           2HA      GLY   3   0.462   4.069  -6.362
   25    HA3  GLY   3           3HA      GLY   3  -0.563   2.710  -5.925
   26    H    ARG   4           H        ARG   4  -0.518   3.205  -3.091
   27    HA   ARG   4           HA       ARG   4  -2.691   5.011  -2.918
   28    HB2  ARG   4           2HB      ARG   4  -0.974   3.904  -0.688
   29    HB3  ARG   4           3HB      ARG   4  -2.560   4.639  -0.504
   30    HG2  ARG   4           2HG      ARG   4  -2.027   2.138  -2.090
   31    HG3  ARG   4           3HG      ARG   4  -2.572   2.163  -0.412
   32    HD2  ARG   4           2HD      ARG   4  -4.320   3.864  -1.748
   33    HD3  ARG   4           3HD      ARG   4  -4.082   2.513  -2.855
   34    HE   ARG   4           HE       ARG   4  -5.551   2.481  -0.421
   35   HH11  ARG   4          1HH1      ARG   4  -3.520   0.531  -2.469
   36   HH12  ARG   4          2HH1      ARG   4  -4.205  -0.970  -1.940
   37   HH21  ARG   4          1HH2      ARG   4  -6.461   0.512   0.283
   38   HH22  ARG   4          2HH2      ARG   4  -5.879  -0.980  -0.375
   39    H    ILE   5           H        ILE   5   0.740   5.279  -2.126
   40    HA   ILE   5           HA       ILE   5   0.427   7.986  -1.143
   41    HB   ILE   5           HB       ILE   5   2.084   6.431  -0.136
   42   HG12  ILE   5          2HG1      ILE   5   3.929   8.452  -1.097
   43   HG13  ILE   5          3HG1      ILE   5   2.353   9.150  -0.740
   44   HG21  ILE   5          1HG2      ILE   5   4.083   5.822  -1.275
   45   HG22  ILE   5          2HG2      ILE   5   2.731   5.387  -2.320
   46   HG23  ILE   5          3HG2      ILE   5   3.676   6.838  -2.658
   47   HD11  ILE   5          3HD1      ILE   5   4.428   8.313   1.051
   48   HD12  ILE   5          1HD1      ILE   5   2.957   9.227   1.384
   49   HD13  ILE   5          2HD1      ILE   5   2.925   7.463   1.408
   50    H    ASP   6           H        ASP   6   1.067   6.421  -4.120
   51    HA   ASP   6           HA       ASP   6   2.572   8.467  -5.388
   52    HB2  ASP   6           2HB      ASP   6   2.643   6.292  -6.357
   53    HB3  ASP   6           3HB      ASP   6   0.886   6.206  -6.460
   54    H    ALA   7           H        ALA   7  -0.867   7.835  -5.034
   55    HA   ALA   7           HA       ALA   7  -1.854   9.643  -6.924
   56    HB1  ALA   7           1HB      ALA   7  -2.912   8.042  -4.803
   57    HB2  ALA   7           2HB      ALA   7  -3.642   9.647  -4.752
   58    HB3  ALA   7           3HB      ALA   7  -3.730   8.685  -6.228
   59    HA   PRO   8           HA       PRO   8  -2.022  12.933  -3.381
   60    HB2  PRO   8           2HB      PRO   8  -0.632  12.381  -1.115
   61    HB3  PRO   8           3HB      PRO   8  -2.323  11.920  -1.341
   62    HG2  PRO   8           2HG      PRO   8   0.150  10.261  -1.652
   63    HG3  PRO   8           3HG      PRO   8  -1.393   9.838  -0.886
   64    HD2  PRO   8           2HD      PRO   8  -0.742   9.039  -3.390
   65    HD3  PRO   8           3HD      PRO   8  -2.414   9.385  -2.902
   66    H    ASP   9           H        ASP   9   0.919  11.059  -3.813
   67    HA   ASP   9           HA       ASP   9   2.661  13.322  -3.423
   68    HB2  ASP   9           2HB      ASP   9   3.119  10.487  -4.343
   69    HB3  ASP   9           3HB      ASP   9   4.409  11.685  -4.312
   70    H    PHE  10           H        PHE  10   0.836  12.041  -5.994
   71    HA   PHE  10           HA       PHE  10   2.399  12.652  -8.221
   72    HB2  PHE  10           2HB      PHE  10  -0.213  11.756  -7.759
   73    HB3  PHE  10           3HB      PHE  10  -0.398  13.236  -8.694
   74    HD1  PHE  10           HD1      PHE  10   1.505  13.357 -10.663
   75    HD2  PHE  10           HD2      PHE  10  -0.219   9.840  -8.998
   76    HE1  PHE  10           HE1      PHE  10   2.042  12.123 -12.723
   77    HE2  PHE  10           HE2      PHE  10   0.316   8.600 -11.055
   78    HZ   PHE  10           HZ       PHE  10   1.449   9.741 -12.921
   79    HA   PRO  11           HA       PRO  11   0.320  17.026  -8.211
   80    HB2  PRO  11           2HB      PRO  11  -0.927  17.780  -5.920
   81    HB3  PRO  11           3HB      PRO  11  -1.758  16.940  -7.234
   82    HG2  PRO  11           2HG      PRO  11  -0.655  15.837  -4.679
   83    HG3  PRO  11           3HG      PRO  11  -2.198  15.481  -5.478
   84    HD2  PRO  11           2HD      PRO  11  -0.050  13.841  -5.658
   85    HD3  PRO  11           3HD      PRO  11  -1.229  14.019  -6.974
   86    H    SER  12           H        SER  12   1.756  15.748  -5.279
   87    HA   SER  12           HA       SER  12   2.944  18.270  -4.525
   88    HB2  SER  12           2HB      SER  12   2.809  15.537  -3.387
   89    HB3  SER  12           3HB      SER  12   4.246  16.475  -2.983
   90    HG   SER  12           HG       SER  12   1.880  16.652  -1.878
   91    H    SER  13           H        SER  13   3.735  15.645  -6.564
   92    HA   SER  13           HA       SER  13   6.510  15.567  -6.437
   93    HB2  SER  13           2HB      SER  13   4.506  14.491  -8.103
   94    HB3  SER  13           3HB      SER  13   5.638  15.318  -9.174
   95    HG   SER  13           HG       SER  13   6.642  13.453  -8.940
   96    HA   PRO  14           HA       PRO  14   6.554  19.053  -9.809
   97    HB2  PRO  14           2HB      PRO  14   4.268  20.490 -10.088
   98    HB3  PRO  14           3HB      PRO  14   4.608  19.033 -11.029
   99    HG2  PRO  14           2HG      PRO  14   2.916  19.356  -8.580
  100    HG3  PRO  14           3HG      PRO  14   2.586  18.424 -10.053
  101    HD2  PRO  14           2HD      PRO  14   3.477  17.274  -7.769
  102    HD3  PRO  14           3HD      PRO  14   3.901  16.656  -9.378
  103    H    ALA  15           H        ALA  15   4.897  19.335  -6.774
  104    HA   ALA  15           HA       ALA  15   5.460  22.144  -6.432
  105    HB1  ALA  15           1HB      ALA  15   3.978  22.038  -4.771
  106    HB2  ALA  15           2HB      ALA  15   3.661  20.386  -5.301
  107    HB3  ALA  15           3HB      ALA  15   4.814  20.689  -4.002
  108    H    ILE  16           H        ILE  16   6.744  19.082  -5.201
  109    HA   ILE  16           HA       ILE  16   8.694  20.338  -3.519
  110    HB   ILE  16           HB       ILE  16   9.600  18.102  -3.183
  111   HG12  ILE  16          2HG1      ILE  16   7.656  17.289  -5.353
  112   HG13  ILE  16          3HG1      ILE  16   9.413  17.235  -5.449
  113   HG21  ILE  16          1HG2      ILE  16   7.596  17.026  -2.257
  114   HG22  ILE  16          2HG2      ILE  16   7.656  18.748  -1.884
  115   HG23  ILE  16          3HG2      ILE  16   6.586  18.158  -3.156
  116   HD11  ILE  16          3HD1      ILE  16   8.902  15.720  -3.234
  117   HD12  ILE  16          1HD1      ILE  16   7.538  15.337  -4.284
  118   HD13  ILE  16          2HD1      ILE  16   9.189  15.102  -4.860
  119    H    LEU  17           H        LEU  17   8.649  19.019  -6.774
  120    HA   LEU  17           HA       LEU  17  11.489  19.185  -7.140
  121    HB2  LEU  17           2HB      LEU  17   9.595  17.783  -8.382
  122    HB3  LEU  17           3HB      LEU  17   9.651  19.169  -9.469
  123    HG   LEU  17           HG       LEU  17  11.039  17.329 -10.275
  124   HD11  LEU  17          1HD1      LEU  17  12.663  18.693 -11.048
  125   HD12  LEU  17          2HD1      LEU  17  13.087  19.285  -9.442
  126   HD13  LEU  17          3HD1      LEU  17  11.674  19.932 -10.276
  127   HD21  LEU  17          3HD2      LEU  17  11.831  17.205  -7.527
  128   HD22  LEU  17          1HD2      LEU  17  13.253  17.436  -8.545
  129   HD23  LEU  17          2HD2      LEU  17  12.171  16.074  -8.838
  130    H    GLY  18           H        GLY  18   8.750  21.284  -7.682
  131    HA2  GLY  18           2HA      GLY  18  10.244  23.155  -9.304
  132    HA3  GLY  18           3HA      GLY  18   8.601  23.361  -8.715
  133    H    LYS  19           H        LYS  19   9.403  22.793  -5.933
  134    HA   LYS  19           HA       LYS  19  10.166  25.485  -5.238
  135    HB2  LYS  19           2HB      LYS  19   9.588  24.927  -3.018
  136    HB3  LYS  19           3HB      LYS  19   8.428  24.072  -4.027
  137    HG2  LYS  19           2HG      LYS  19   8.960  22.376  -2.637
  138    HG3  LYS  19           3HG      LYS  19  10.265  22.154  -3.805
  139    HD2  LYS  19           2HD      LYS  19  11.743  22.438  -2.170
  140    HD3  LYS  19           3HD      LYS  19  11.144  24.082  -1.936
  141    HE2  LYS  19           2HE      LYS  19  10.960  23.037   0.166
  142    HE3  LYS  19           3HE      LYS  19   9.325  23.058  -0.494
  143    HZ1  LYS  19           3HZ      LYS  19  10.453  20.889   0.532
  144    HZ2  LYS  19           1HZ      LYS  19  10.912  20.696  -1.085
  145    HZ3  LYS  19           2HZ      LYS  19   9.275  20.828  -0.681
  146    H    ALA  20           H        ALA  20  11.650  22.324  -5.300
  147    HA   ALA  20           HA       ALA  20  13.895  22.937  -3.679
  148    HB1  ALA  20           1HB      ALA  20  13.247  20.779  -5.640
  149    HB2  ALA  20           2HB      ALA  20  14.890  20.941  -5.019
  150    HB3  ALA  20           3HB      ALA  20  13.550  20.667  -3.906
  151    H    ALA  21           H        ALA  21  13.194  23.319  -7.094
  152    HA   ALA  21           HA       ALA  21  15.870  23.895  -7.893
  153    HB1  ALA  21           1HB      ALA  21  14.302  23.097  -9.527
  154    HB2  ALA  21           2HB      ALA  21  13.230  24.467  -9.231
  155    HB3  ALA  21           3HB      ALA  21  14.807  24.726  -9.978
  156    H    THR  22           H        THR  22  13.089  25.865  -6.957
  157    HA   THR  22           HA       THR  22  14.468  28.347  -7.452
  158    HB   THR  22           HB       THR  22  12.027  28.211  -7.716
  159    HG1  THR  22           HG1      THR  22  12.576  29.926  -5.523
  160   HG21  THR  22          3HG2      THR  22  11.720  26.604  -5.786
  161   HG22  THR  22          1HG2      THR  22  10.542  27.912  -5.887
  162   HG23  THR  22          2HG2      THR  22  11.857  27.999  -4.715
  163    H    ASP  23           H        ASP  23  14.097  26.153  -4.816
  164    HA   ASP  23           HA       ASP  23  14.696  28.018  -2.729
  165    HB2  ASP  23           2HB      ASP  23  14.437  25.047  -2.930
  166    HB3  ASP  23           3HB      ASP  23  15.255  25.729  -1.527
  167    H    VAL  24           H        VAL  24  16.558  25.753  -4.685
  168    HA   VAL  24           HA       VAL  24  18.999  26.090  -3.251
  169    HB   VAL  24           HB       VAL  24  18.539  25.087  -6.063
  170   HG11  VAL  24          1HG1      VAL  24  20.968  25.453  -4.432
  171   HG12  VAL  24          2HG1      VAL  24  20.824  23.909  -5.273
  172   HG13  VAL  24          3HG1      VAL  24  20.770  25.419  -6.183
  173   HG21  VAL  24          3HG2      VAL  24  17.811  23.943  -3.633
  174   HG22  VAL  24          1HG2      VAL  24  17.931  23.130  -5.193
  175   HG23  VAL  24          2HG2      VAL  24  19.304  23.121  -4.087
  176    H    VAL  25           H        VAL  25  17.523  27.655  -6.028
  177    HA   VAL  25           HA       VAL  25  19.826  29.108  -6.843
  178    HB   VAL  25           HB       VAL  25  16.907  29.710  -7.340
  179   HG11  VAL  25          1HG1      VAL  25  17.759  31.684  -8.014
  180   HG12  VAL  25          2HG1      VAL  25  19.400  31.049  -8.150
  181   HG13  VAL  25          3HG1      VAL  25  18.234  30.767  -9.443
  182   HG21  VAL  25          3HG2      VAL  25  18.496  28.688  -9.554
  183   HG22  VAL  25          1HG2      VAL  25  18.381  27.552  -8.210
  184   HG23  VAL  25          2HG2      VAL  25  16.914  28.176  -8.965
  185    H    ALA  26           H        ALA  26  17.166  29.773  -4.636
  186    HA   ALA  26           HA       ALA  26  17.964  32.505  -4.188
  187    HB1  ALA  26           1HB      ALA  26  15.982  30.777  -2.710
  188    HB2  ALA  26           2HB      ALA  26  16.195  32.514  -2.491
  189    HB3  ALA  26           3HB      ALA  26  15.618  31.885  -4.034
  190    H    ALA  27           H        ALA  27  18.453  29.398  -2.644
  191    HA   ALA  27           HA       ALA  27  19.384  30.264  -0.150
  192    HB1  ALA  27           1HB      ALA  27  18.806  27.944  -0.598
  193    HB2  ALA  27           2HB      ALA  27  20.174  27.801  -1.702
  194    HB3  ALA  27           3HB      ALA  27  20.453  28.067   0.018
  195    H    TRP  28           H        TRP  28  20.820  30.446  -3.256
  196    HA   TRP  28           HA       TRP  28  23.545  30.373  -2.619
  197    HB2  TRP  28           2HB      TRP  28  22.761  30.312  -4.925
  198    HB3  TRP  28           3HB      TRP  28  22.117  31.944  -4.775
  199    HD1  TRP  28           HD1      TRP  28  25.643  30.592  -3.857
  200    HE1  TRP  28           HE1      TRP  28  27.384  32.053  -5.065
  201    HE3  TRP  28           HE3      TRP  28  22.475  33.655  -6.449
  202    HZ2  TRP  28           HZ2      TRP  28  27.411  34.217  -6.877
  203    HZ3  TRP  28           HZ3      TRP  28  23.439  35.395  -7.898
  204    HH2  TRP  28           HH2      TRP  28  25.856  35.669  -8.105
  205    H    LYS  29           H        LYS  29  21.142  32.813  -2.097
  206    HA   LYS  29           HA       LYS  29  22.946  35.000  -1.740
  207    HB2  LYS  29           2HB      LYS  29  21.058  36.251  -1.046
  208    HB3  LYS  29           3HB      LYS  29  20.475  35.159  -2.296
  209    HG2  LYS  29           2HG      LYS  29  19.946  33.633  -0.199
  210    HG3  LYS  29           3HG      LYS  29  19.902  35.200   0.612
  211    HD2  LYS  29           2HD      LYS  29  18.449  35.011  -1.954
  212    HD3  LYS  29           3HD      LYS  29  17.772  34.099  -0.603
  213    HE2  LYS  29           2HE      LYS  29  17.750  36.133   0.755
  214    HE3  LYS  29           3HE      LYS  29  18.438  37.043  -0.589
  215    HZ1  LYS  29           3HZ      LYS  29  15.807  36.795  -0.091
  216    HZ2  LYS  29           1HZ      LYS  29  16.039  35.583  -1.248
  217    HZ3  LYS  29           2HZ      LYS  29  16.464  37.182  -1.601
  218    H    SER  30           H        SER  30  21.579  32.538   0.337
  219    HA   SER  30           HA       SER  30  22.154  33.702   2.827
  220    HB2  SER  30           2HB      SER  30  20.703  31.833   2.842
  221    HB3  SER  30           3HB      SER  30  21.841  30.839   1.933
  222    HG   SER  30           HG       SER  30  22.358  30.160   3.863