*HEADER    ANTIFREEZE PROTEIN                      21-FEB-12   2LQ1              
*TITLE     SOLUTION STRUCTURE OF DE NOVO DESIGNED ANTIFREEZE PEPTIDE 3           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DE NOVO DESIGNED ANTIFREEZE PEPTIDE 3;                     
*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 2LQ1    0                                                


 1 THR QB 2 GLY  H 3.3 2.0
 2 GLY QA 3 ASN  H 3.3 2.0
 3 ASN QB 3 ASN  H 3.5 2.0
 3 ASN HA 4 VAL  H 3.3 2.0
 3 ASN QB 4 VAL  H 3.3 2.0
 4 VAL HB 4 VAL  H 3.3 2.0
 4 VAL QQG 4 VAL  H 3.8 2.0
 4 VAL HA 5 GLY  H 3.3 2.0
 4 VAL HB 5 GLY  H 3.3 2.0
 4 VAL QQG 5 GLY  H 3.9 2.0
 4 VAL HA 6 LEU  H 4.2 2.0
 5 GLY QA 6 LEU  H 3.3 2.0
 6 LEU QB 6 LEU  H 3.3 2.0
 6 LEU QQD 6 LEU  H 4.0 2.0
 6 LEU HA 7 SER  H 3.3 2.0
 6 LEU QB 7 SER  H 3.3 2.0
 6 LEU QQD 7 SER  H 4.0 2.0
 5 GLY QA 7 SER  H 4.2 2.0
 7 SER QB 7 SER  H 3.3 2.0
 8 PRO QB 9 GLY  H 3.7 2.0
 8 PRO QG 9 GLY  H 3.6 2.0
 8 PRO QD 9 GLY  H 3.9 2.0
 5 GLY  QA 9 GLY  H  3.4 2.0
 9 GLY QA 10 LEU H 3.3 2.0
 7 SER HA 10 LEU H 3.3 2.0
10 LEU QB 10 LEU H 3.3 2.0
10 LEU QQD 10 LEU H 3.9 2.0
10 LEU HA 11 SER H 3.3 2.0
10 LEU QB 11 SER H 3.3 2.0
10 LEU QQD 11 SER H 3.9 2.0
11 SER QB 11 SER H 3.3 2.0
11 SER HA 12 THR H 3.3 2.0
 9 GLY QA 12 THR H 3.3 2.0
10 LEU HA 12 THR H 4.0 2.0
11 SER QB 12 THR H 3.3 2.0
12 THR HB 12 THR H 3.3 2.0
12 THR QG2 12 THR H 3.9 2.0
12 THR  HA 13 ALA H 3.3 2.0
 9 GLY QA 13 ALA H 4.0 2.0
11 SER HA 13 ALA H 4.0 2.0
12 THR HB 13 ALA H 3.3 2.0
12 THR QG2 13 ALA H 3.9 2.0
13 ALA QB 13 ALA H 3.3 2.0
13 ALA HA 14 LEU H 3.3 2.0
11 SER HA 14 LEU H 3.3 2.0
10 LEU HA 14 LEU H 4.0 2.0
13 ALA QB 14 LEU H 3.3 2.0
14 LEU QB 14 LEU H 3.3 2.0
14 LEU QQD 14 LEU  H 3.9 2.0
14 LEU HA 15 THR H 3.3 2.0
11 SER  HA 15 THR H 3.6 2.0
14 LEU QB 15 THR H 3.3 2.0
14 LEU QQD 15 THR H 3.9 2.0
15 THR  QB 15 THR H 3.3 2.0
15 THR QG2 15 THR H 3.9 2.0
13 ALA QB 15 THR H 4.5 2.0
15 THR HA 16 GLY H 3.3 2.0
15 THR QB 16 GLY H 3.3 2.0
15 THR QG2 16 GLY H 3.9 2.0
16 GLY HA 17 PHE H 3.3 2.0
13 ALA HA 17 PHE H 3.4 2.0
14 LEU HA 17 PHE H 3.6 2.0
15 THR HA 17 PHE H 4.0 2.0
15 THR QB 17 PHE H 4.5 2.0
17 PHE QB 17 PHE H 3.3 2.0
13 ALA HA 17 PHE H 3.4 2.0
17 PHE HA 18 THR H 3.3 2.0
17 PHE QB 18 THR H 3.3 2.0
18 THR QB 18 THR H 3.3 2.0
18 THR QG2 18 THR H 3.9 2.0
18 THR HA 19 LEU H 3.3 2.0
17 PHE HA 19 LEU H 4.6 2.0
18 THR QB 19 LEU H 3.3 2.0
18 THR QG2 19 LEU H 4.0 2.0
19 LEU QB 19 LEU H 3.3 2.0
19 LEU QQD 19 LEU H 4.0 2.0
19 LEU HA 20 VAL H 3.3 2.0
18 THR QB 20 VAL H 5.0 2.0
17 PHE HA 20 VAL H 4.9 2.0
19 LEU QB 20 VAL H 3.3 2.0
19 LEU QQD 20 VAL H 3.9 2.0
20 VAL HB 20 VAL H 3.3 2.0
20 VAL QQG 20 VAL H 3.8 2.0
21 PRO QD 22 VAL H 4.0 2.0
22 VAL HB 22 VAL H 3.3 2.0
22 VAL  QQG 22 VAL H 3.9 2.0
22 VAL HA 23 GLU H 3.3 2.0
20 VAL HA 23 GLU H 3.3 2.0
22 VAL HB 23 GLU H 3.3 2.0
22 VAL QQG 23 GLU H 3.8 2.0
23 GLU QB 23 GLU H 3.3 2.0
23 GLU QG 23 GLU H 3.6 2.0
23 GLU HA 24 ASP H 3.3 2.0
22 VAL HA 24 ASP H 4.0 2.0
23 GLU QB 24 ASP H 3.3 2.0
23 GLU QG 24 ASP H 3.8 2.0
24 ASP QB 24 ASP H 3.3 2.0
24 ASP HA 25 HIS H 3.3 2.0
25 HIS QB 25 HIS H 3.3 2.0
24 ASP QB 25 HIS H 3.3 2.0
19 LEU QQD 17 PHE QD 3.5 2.0
15 THR QG2 17 PHE QD 4.5 2.0
19 LEU QB 17 PHE QD 3.9 2.0
19 LEU QQD 17 PHE HZ 4.0 2.0
19 LEU QB 17 PHE HZ 5.5 2.0
14 LEU QQD 17 PHE QE 4.0 2.0
20 VAL QQG 17 PHE QE 5.8 2.0
18 THR QG2 17 PHE QE 4.2 2.0
15 THR QG2 17 PHE QE 4.5 2.0
19 LEU QB 17 PHE QE 4.0 2.0
14 LEU QB 17 PHE QE 5.0 2.0
 2 GLY H 3 ASN  H 2.8 2.0
 3 ASN H 4 VAL  H 2.8 2.0
 4 VAL H 5 GLY  H 2.8 2.0
 5 GLY H 6 LEU  H 2.8 2.0
 6 LEU H 7 SER  H 2.8 2.0
 9 GLY H 10 LEU H 2.8 2.0
10 LEU H 11 SER H 2.8 2.0
11 SER H 12 THR H 2.8 2.0
12 THR H 13 ALA H 2.8 2.0
13 ALA H 14 LEU H 2.8 2.0
14 LEU H 15 THR H 2.8 2.0
15 THR H 16 GLY H 2.8 2.0
16 GLY H 17 PHE H 2.8 2.0
17 PHE H 18 THR H 3.3 2.0
18 THR H 19 LEU H 2.8 2.0
19 LEU H 20 VAL H 2.8 2.0
22 VAL H 23 GLU H 2.8 2.0
23 GLU H 24 ASP H 2.8 2.0
24 ASP H 25 HIS H 2.8 2.0
13 ALA QB 10 LEU HA 3.0 2.0
14 LEU QB 11 SER  HA 3.0 2.0
15 THR QB 12 THR HA 3.0 2.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   THR   1           H        THR   1   1.806   0.001   0.856
    2    HA   THR   1           HA       THR   1   2.624   0.939  -1.306
    3    HB   THR   1           HB       THR   1   2.603  -2.079  -1.383
    4    HG1  THR   1           HG1      THR   1   4.710  -1.584  -0.174
    5   HG21  THR   1          3HG2      THR   1   5.092  -1.224  -2.104
    6   HG22  THR   1          1HG2      THR   1   4.071   0.051  -2.769
    7   HG23  THR   1          2HG2      THR   1   3.802  -1.629  -3.235
    8    H    GLY   2           H        GLY   2   0.185  -1.637  -1.575
    9    HA2  GLY   2           2HA      GLY   2  -0.118  -1.516  -4.370
   10    HA3  GLY   2           3HA      GLY   2  -1.311  -2.139  -3.240
   11    H    ASN   3           H        ASN   3  -1.245   0.588  -1.881
   12    HA   ASN   3           HA       ASN   3  -2.994   1.946  -3.825
   13    HB2  ASN   3           2HB      ASN   3  -3.149   1.863  -0.806
   14    HB3  ASN   3           3HB      ASN   3  -4.132   2.924  -1.811
   15   HD21  ASN   3          1HD2      ASN   3  -5.578   1.425  -0.310
   16   HD22  ASN   3          2HD2      ASN   3  -6.245   0.064  -1.139
   17    H    VAL   4           H        VAL   4  -0.052   2.127  -2.325
   18    HA   VAL   4           HA       VAL   4  -0.034   5.036  -2.057
   19    HB   VAL   4           HB       VAL   4   2.248   3.127  -1.550
   20   HG11  VAL   4          1HG1      VAL   4   2.703   5.176   0.084
   21   HG12  VAL   4          2HG1      VAL   4   3.268   5.160  -1.587
   22   HG13  VAL   4          3HG1      VAL   4   1.795   6.031  -1.162
   23   HG21  VAL   4          3HG2      VAL   4   1.561   3.550   0.895
   24   HG22  VAL   4          1HG2      VAL   4  -0.004   4.009   0.222
   25   HG23  VAL   4          2HG2      VAL   4   0.629   2.384  -0.045
   26    H    GLY   5           H        GLY   5   0.599   2.698  -4.396
   27    HA2  GLY   5           2HA      GLY   5   2.475   4.482  -5.814
   28    HA3  GLY   5           3HA      GLY   5   2.353   2.750  -6.080
   29    H    LEU   6           H        LEU   6  -0.380   4.942  -5.773
   30    HA   LEU   6           HA       LEU   6  -1.326   4.086  -8.383
   31    HB2  LEU   6           2HB      LEU   6  -2.501   5.322  -5.981
   32    HB3  LEU   6           3HB      LEU   6  -3.207   5.820  -7.517
   33    HG   LEU   6           HG       LEU   6  -4.415   3.959  -6.408
   34   HD11  LEU   6          1HD1      LEU   6  -3.521   4.128  -9.123
   35   HD12  LEU   6          2HD1      LEU   6  -5.070   3.574  -8.489
   36   HD13  LEU   6          3HD1      LEU   6  -3.733   2.438  -8.666
   37   HD21  LEU   6          3HD2      LEU   6  -3.476   1.812  -6.178
   38   HD22  LEU   6          1HD2      LEU   6  -2.277   2.922  -5.513
   39   HD23  LEU   6          2HD2      LEU   6  -2.052   2.244  -7.125
   40    H    SER   7           H        SER   7  -1.517   7.293  -6.865
   41    HA   SER   7           HA       SER   7  -1.368   8.639  -9.360
   42    HB2  SER   7           2HB      SER   7  -0.662  10.359  -7.155
   43    HB3  SER   7           3HB      SER   7  -2.130  10.353  -8.133
   44    HG   SER   7           HG       SER   7  -2.916   8.680  -6.755
   45    HA   PRO   8           HA       PRO   8   3.102   9.831  -7.945
   46    HB2  PRO   8           2HB      PRO   8   4.141   8.455  -5.849
   47    HB3  PRO   8           3HB      PRO   8   3.226   9.954  -5.654
   48    HG2  PRO   8           2HG      PRO   8   2.315   7.122  -5.322
   49    HG3  PRO   8           3HG      PRO   8   1.970   8.535  -4.307
   50    HD2  PRO   8           2HD      PRO   8   0.203   7.579  -6.123
   51    HD3  PRO   8           3HD      PRO   8   0.320   9.304  -5.720
   52    H    GLY   9           H        GLY   9   1.795   6.768  -8.406
   53    HA2  GLY   9           2HA      GLY   9   4.411   5.649  -9.193
   54    HA3  GLY   9           3HA      GLY   9   3.009   4.687  -8.748
   55    H    LEU  10           H        LEU  10   1.241   6.514 -10.329
   56    HA   LEU  10           HA       LEU  10   1.455   5.087 -12.813
   57    HB2  LEU  10           2HB      LEU  10  -0.726   5.490 -11.923
   58    HB3  LEU  10           3HB      LEU  10  -0.427   7.224 -11.838
   59    HG   LEU  10           HG       LEU  10  -0.175   6.207 -14.545
   60   HD11  LEU  10          1HD1      LEU  10  -2.423   5.584 -14.953
   61   HD12  LEU  10          2HD1      LEU  10  -2.913   6.013 -13.314
   62   HD13  LEU  10          3HD1      LEU  10  -1.873   4.615 -13.586
   63   HD21  LEU  10          3HD2      LEU  10  -0.416   8.471 -14.477
   64   HD22  LEU  10          1HD2      LEU  10  -1.485   8.428 -13.074
   65   HD23  LEU  10          2HD2      LEU  10  -2.110   8.015 -14.671
   66    H    SER  11           H        SER  11   1.912   8.424 -11.743
   67    HA   SER  11           HA       SER  11   2.512   9.380 -14.390
   68    HB2  SER  11           2HB      SER  11   1.493  10.784 -12.551
   69    HB3  SER  11           3HB      SER  11   3.072  10.775 -11.766
   70    HG   SER  11           HG       SER  11   2.972  12.601 -13.015
   71    H    THR  12           H        THR  12   4.253   7.876 -11.861
   72    HA   THR  12           HA       THR  12   6.838   8.896 -12.693
   73    HB   THR  12           HB       THR  12   6.129   6.780 -10.652
   74    HG1  THR  12           HG1      THR  12   5.593   9.133 -10.317
   75   HG21  THR  12          3HG2      THR  12   8.333   6.296 -11.312
   76   HG22  THR  12          1HG2      THR  12   8.511   7.296  -9.870
   77   HG23  THR  12          2HG2      THR  12   8.752   8.002 -11.468
   78    H    ALA  13           H        ALA  13   4.786   6.215 -13.361
   79    HA   ALA  13           HA       ALA  13   6.952   4.615 -14.481
   80    HB1  ALA  13           1HB      ALA  13   4.935   3.081 -15.046
   81    HB2  ALA  13           2HB      ALA  13   5.477   3.224 -13.373
   82    HB3  ALA  13           3HB      ALA  13   4.059   4.118 -13.920
   83    H    LEU  14           H        LEU  14   4.188   6.530 -15.504
   84    HA   LEU  14           HA       LEU  14   4.380   5.780 -18.264
   85    HB2  LEU  14           2HB      LEU  14   2.633   7.352 -16.606
   86    HB3  LEU  14           3HB      LEU  14   3.043   8.238 -18.073
   87    HG   LEU  14           HG       LEU  14   0.966   7.022 -18.360
   88   HD11  LEU  14          1HD1      LEU  14   1.644   6.922 -20.471
   89   HD12  LEU  14          2HD1      LEU  14   2.209   5.284 -20.144
   90   HD13  LEU  14          3HD1      LEU  14   3.318   6.646 -19.986
   91   HD21  LEU  14          3HD2      LEU  14   1.481   4.381 -18.526
   92   HD22  LEU  14          1HD2      LEU  14   0.820   5.166 -17.092
   93   HD23  LEU  14          2HD2      LEU  14   2.548   4.828 -17.194
   94    H    THR  15           H        THR  15   6.157   7.830 -16.274
   95    HA   THR  15           HA       THR  15   6.955   9.595 -18.471
   96    HB   THR  15           HB       THR  15   7.641   9.714 -15.528
   97    HG1  THR  15           HG1      THR  15   6.312  11.727 -15.849
   98   HG21  THR  15          3HG2      THR  15   9.288  11.108 -16.080
   99   HG22  THR  15          1HG2      THR  15   8.103  12.181 -16.821
  100   HG23  THR  15          2HG2      THR  15   8.895  10.939 -17.791
  101    H    GLY  16           H        GLY  16   8.208   7.119 -16.309
  102    HA2  GLY  16           2HA      GLY  16  10.831   7.303 -17.633
  103    HA3  GLY  16           3HA      GLY  16  10.520   6.510 -16.096
  104    H    PHE  17           H        PHE  17   7.990   5.549 -17.809
  105    HA   PHE  17           HA       PHE  17   8.360   2.947 -18.003
  106    HB2  PHE  17           2HB      PHE  17   6.960   2.866 -20.024
  107    HB3  PHE  17           3HB      PHE  17   6.349   4.045 -18.867
  108    HD1  PHE  17           HD2      PHE  17   7.513   6.478 -19.247
  109    HD2  PHE  17           HD1      PHE  17   6.855   3.498 -22.214
  110    HE1  PHE  17           HE2      PHE  17   7.553   8.211 -20.993
  111    HE2  PHE  17           HE1      PHE  17   6.895   5.227 -23.965
  112    HZ   PHE  17           HZ       PHE  17   7.243   7.587 -23.355
  113    H    THR  18           H        THR  18   9.481   5.112 -20.604
  114    HA   THR  18           HA       THR  18  11.393   3.012 -21.396
  115    HB   THR  18           HB       THR  18  10.322   5.206 -23.175
  116    HG1  THR  18           HG1      THR  18   8.929   3.661 -23.997
  117   HG21  THR  18          3HG2      THR  18  12.455   4.398 -23.925
  118   HG22  THR  18          1HG2      THR  18  11.212   3.713 -24.971
  119   HG23  THR  18          2HG2      THR  18  11.950   2.722 -23.711
  120    H    LEU  19           H        LEU  19  11.043   6.141 -20.147
  121    HA   LEU  19           HA       LEU  19  13.563   7.167 -21.114
  122    HB2  LEU  19           2HB      LEU  19  11.378   8.154 -19.358
  123    HB3  LEU  19           3HB      LEU  19  12.971   8.888 -19.191
  124    HG   LEU  19           HG       LEU  19  11.624  10.242 -20.647
  125   HD11  LEU  19          1HD1      LEU  19  14.092   9.076 -21.391
  126   HD12  LEU  19          2HD1      LEU  19  13.447  10.655 -21.834
  127   HD13  LEU  19          3HD1      LEU  19  13.121   9.253 -22.852
  128   HD21  LEU  19          3HD2      LEU  19  11.382   8.079 -22.678
  129   HD22  LEU  19          1HD2      LEU  19  10.367   9.496 -22.408
  130   HD23  LEU  19          2HD2      LEU  19  10.246   8.106 -21.328
  131    H    VAL  20           H        VAL  20  12.553   5.132 -18.606
  132    HA   VAL  20           HA       VAL  20  14.560   5.821 -16.679
  133    HB   VAL  20           HB       VAL  20  12.675   3.498 -16.966
  134   HG11  VAL  20          1HG1      VAL  20  14.359   2.300 -15.995
  135   HG12  VAL  20          2HG1      VAL  20  15.088   3.721 -15.245
  136   HG13  VAL  20          3HG1      VAL  20  13.633   3.006 -14.552
  137   HG21  VAL  20          3HG2      VAL  20  12.570   6.039 -15.726
  138   HG22  VAL  20          1HG2      VAL  20  11.360   4.756 -15.694
  139   HG23  VAL  20          2HG2      VAL  20  12.604   4.827 -14.445
  140    HA   PRO  21           HA       PRO  21  16.683   1.820 -18.392
  141    HB2  PRO  21           2HB      PRO  21  15.761   0.859 -20.757
  142    HB3  PRO  21           3HB      PRO  21  15.115   0.344 -19.194
  143    HG2  PRO  21           2HG      PRO  21  14.022   2.353 -21.127
  144    HG3  PRO  21           3HG      PRO  21  13.164   1.101 -20.209
  145    HD2  PRO  21           2HD      PRO  21  13.197   3.699 -19.449
  146    HD3  PRO  21           3HD      PRO  21  13.124   2.363 -18.282
  147    H    VAL  22           H        VAL  22  15.593   4.396 -20.451
  148    HA   VAL  22           HA       VAL  22  18.008   4.220 -22.103
  149    HB   VAL  22           HB       VAL  22  15.635   6.062 -22.426
  150   HG11  VAL  22          1HG1      VAL  22  16.874   5.761 -24.867
  151   HG12  VAL  22          2HG1      VAL  22  17.028   7.150 -23.791
  152   HG13  VAL  22          3HG1      VAL  22  18.224   5.855 -23.738
  153   HG21  VAL  22          3HG2      VAL  22  14.846   4.583 -24.139
  154   HG22  VAL  22          1HG2      VAL  22  16.273   3.559 -23.979
  155   HG23  VAL  22          2HG2      VAL  22  15.093   3.638 -22.671
  156    H    GLU  23           H        GLU  23  16.846   5.792 -19.362
  157    HA   GLU  23           HA       GLU  23  17.881   8.373 -19.595
  158    HB2  GLU  23           2HB      GLU  23  16.755   8.376 -17.654
  159    HB3  GLU  23           3HB      GLU  23  16.947   6.640 -17.448
  160    HG2  GLU  23           2HG      GLU  23  19.114   6.941 -16.461
  161    HG3  GLU  23           3HG      GLU  23  19.070   8.671 -16.799
  162    H    ASP  24           H        ASP  24  19.485   5.359 -19.254
  163    HA   ASP  24           HA       ASP  24  21.997   6.673 -18.493
  164    HB2  ASP  24           2HB      ASP  24  21.133   4.604 -17.260
  165    HB3  ASP  24           3HB      ASP  24  21.544   3.700 -18.716
  166    H    HIS  25           H        HIS  25  20.338   5.751 -21.207
  167    HA   HIS  25           HA       HIS  25  22.811   5.256 -22.728
  168    HB2  HIS  25           2HB      HIS  25  20.841   3.544 -22.698
  169    HB3  HIS  25           3HB      HIS  25  20.072   4.675 -23.808
  170    HD1  HIS  25           HD1      HIS  25  21.270   5.033 -26.131
  171    HD2  HIS  25           HD2      HIS  25  22.811   1.959 -23.799
  172    HE1  HIS  25           HE1      HIS  25  22.690   3.658 -27.685
  Start of MODEL    2
    1    H1   THR   1           H        THR   1   2.252  -0.124   0.351
    2    HA   THR   1           HA       THR   1   2.654   0.806  -1.862
    3    HB   THR   1           HB       THR   1   2.540  -2.051  -2.609
    4    HG1  THR   1           HG1      THR   1   4.411  -1.344  -0.625
    5   HG21  THR   1          3HG2      THR   1   4.524  -1.597  -3.634
    6   HG22  THR   1          1HG2      THR   1   5.061  -0.506  -2.357
    7   HG23  THR   1          2HG2      THR   1   3.892   0.047  -3.555
    8    H    GLY   2           H        GLY   2  -0.030  -1.472  -1.646
    9    HA2  GLY   2           2HA      GLY   2  -0.878  -1.457  -4.300
   10    HA3  GLY   2           3HA      GLY   2  -1.931  -1.696  -2.913
   11    H    ASN   3           H        ASN   3  -1.616   0.826  -1.697
   12    HA   ASN   3           HA       ASN   3  -3.017   2.512  -3.661
   13    HB2  ASN   3           2HB      ASN   3  -3.192   2.469  -0.640
   14    HB3  ASN   3           3HB      ASN   3  -4.011   3.642  -1.667
   15   HD21  ASN   3          1HD2      ASN   3  -5.590   2.843  -3.178
   16   HD22  ASN   3          2HD2      ASN   3  -6.473   1.404  -2.810
   17    H    VAL   4           H        VAL   4  -0.098   2.178  -2.140
   18    HA   VAL   4           HA       VAL   4   0.416   5.032  -1.821
   19    HB   VAL   4           HB       VAL   4   2.351   2.753  -1.405
   20   HG11  VAL   4          1HG1      VAL   4   2.440   5.671  -1.045
   21   HG12  VAL   4          2HG1      VAL   4   3.084   4.723   0.297
   22   HG13  VAL   4          3HG1      VAL   4   3.746   4.519  -1.326
   23   HG21  VAL   4          3HG2      VAL   4   1.613   3.624   1.091
   24   HG22  VAL   4          1HG2      VAL   4   0.087   3.641   0.207
   25   HG23  VAL   4          2HG2      VAL   4   1.033   2.156   0.304
   26    H    GLY   5           H        GLY   5   0.617   2.692  -4.233
   27    HA2  GLY   5           2HA      GLY   5   2.643   4.286  -5.681
   28    HA3  GLY   5           3HA      GLY   5   2.466   2.549  -5.876
   29    H    LEU   6           H        LEU   6  -0.304   4.648  -5.597
   30    HA   LEU   6           HA       LEU   6  -1.204   3.802  -8.216
   31    HB2  LEU   6           2HB      LEU   6  -2.779   3.792  -6.380
   32    HB3  LEU   6           3HB      LEU   6  -2.501   5.509  -6.097
   33    HG   LEU   6           HG       LEU   6  -3.378   5.108  -8.798
   34   HD11  LEU   6          1HD1      LEU   6  -4.378   3.042  -7.883
   35   HD12  LEU   6          2HD1      LEU   6  -5.581   4.215  -8.417
   36   HD13  LEU   6          3HD1      LEU   6  -5.244   4.019  -6.697
   37   HD21  LEU   6          3HD2      LEU   6  -4.830   6.841  -8.290
   38   HD22  LEU   6          1HD2      LEU   6  -3.497   7.115  -7.167
   39   HD23  LEU   6          2HD2      LEU   6  -4.984   6.354  -6.601
   40    H    SER   7           H        SER   7  -1.422   7.012  -6.703
   41    HA   SER   7           HA       SER   7  -1.310   8.357  -9.201
   42    HB2  SER   7           2HB      SER   7  -0.620  10.184  -7.158
   43    HB3  SER   7           3HB      SER   7  -2.200   9.952  -7.905
   44    HG   SER   7           HG       SER   7  -2.175   9.690  -5.588
   45    HA   PRO   8           HA       PRO   8   3.168   9.581  -7.841
   46    HB2  PRO   8           2HB      PRO   8   4.242   8.213  -5.756
   47    HB3  PRO   8           3HB      PRO   8   3.319   9.706  -5.552
   48    HG2  PRO   8           2HG      PRO   8   2.431   6.868  -5.207
   49    HG3  PRO   8           3HG      PRO   8   2.089   8.279  -4.189
   50    HD2  PRO   8           2HD      PRO   8   0.307   7.310  -5.982
   51    HD3  PRO   8           3HD      PRO   8   0.416   9.036  -5.582
   52    H    GLY   9           H        GLY   9   1.875   6.510  -8.288
   53    HA2  GLY   9           2HA      GLY   9   4.490   5.410  -9.106
   54    HA3  GLY   9           3HA      GLY   9   3.103   4.437  -8.641
   55    H    LEU  10           H        LEU  10   1.304   6.258 -10.202
   56    HA   LEU  10           HA       LEU  10   1.491   4.826 -12.686
   57    HB2  LEU  10           2HB      LEU  10  -0.680   5.219 -11.763
   58    HB3  LEU  10           3HB      LEU  10  -0.390   6.956 -11.691
   59    HG   LEU  10           HG       LEU  10  -0.214   5.823 -14.389
   60   HD11  LEU  10          1HD1      LEU  10  -2.116   4.585 -13.038
   61   HD12  LEU  10          2HD1      LEU  10  -2.360   5.121 -14.700
   62   HD13  LEU  10          3HD1      LEU  10  -2.989   6.083 -13.362
   63   HD21  LEU  10          3HD2      LEU  10  -0.201   8.129 -14.323
   64   HD22  LEU  10          1HD2      LEU  10  -1.391   8.205 -13.023
   65   HD23  LEU  10          2HD2      LEU  10  -1.899   7.788 -14.660
   66    H    SER  11           H        SER  11   1.939   8.169 -11.629
   67    HA   SER  11           HA       SER  11   2.501   9.120 -14.285
   68    HB2  SER  11           2HB      SER  11   1.518  10.466 -12.312
   69    HB3  SER  11           3HB      SER  11   3.184  10.591 -11.747
   70    HG   SER  11           HG       SER  11   2.500  11.276 -14.394
   71    H    THR  12           H        THR  12   4.280   7.637 -11.772
   72    HA   THR  12           HA       THR  12   6.849   8.676 -12.633
   73    HB   THR  12           HB       THR  12   6.178   6.558 -10.580
   74    HG1  THR  12           HG1      THR  12   6.995   9.275 -10.279
   75   HG21  THR  12          3HG2      THR  12   8.540   6.996  -9.821
   76   HG22  THR  12          1HG2      THR  12   8.793   7.853 -11.341
   77   HG23  THR  12          2HG2      THR  12   8.393   6.135 -11.353
   78    H    ALA  13           H        ALA  13   4.811   5.976 -13.273
   79    HA   ALA  13           HA       ALA  13   6.978   4.392 -14.414
   80    HB1  ALA  13           1HB      ALA  13   5.558   2.954 -13.329
   81    HB2  ALA  13           2HB      ALA  13   4.117   3.877 -13.760
   82    HB3  ALA  13           3HB      ALA  13   4.916   2.872 -14.969
   83    H    LEU  14           H        LEU  14   4.186   6.280 -15.411
   84    HA   LEU  14           HA       LEU  14   4.355   5.526 -18.171
   85    HB2  LEU  14           2HB      LEU  14   2.612   7.084 -16.498
   86    HB3  LEU  14           3HB      LEU  14   3.001   7.975 -17.968
   87    HG   LEU  14           HG       LEU  14   0.920   6.716 -18.194
   88   HD11  LEU  14          1HD1      LEU  14   1.934   5.145 -20.139
   89   HD12  LEU  14          2HD1      LEU  14   3.281   6.254 -19.886
   90   HD13  LEU  14          3HD1      LEU  14   1.687   6.884 -20.301
   91   HD21  LEU  14          3HD2      LEU  14   2.510   4.626 -16.987
   92   HD22  LEU  14          1HD2      LEU  14   1.741   4.076 -18.476
   93   HD23  LEU  14          2HD2      LEU  14   0.759   4.747 -17.173
   94    H    THR  15           H        THR  15   6.139   7.592 -16.206
   95    HA   THR  15           HA       THR  15   6.898   9.362 -18.414
   96    HB   THR  15           HB       THR  15   7.613   9.487 -15.478
   97    HG1  THR  15           HG1      THR  15   6.070  11.386 -16.885
   98   HG21  THR  15          3HG2      THR  15   8.838  10.719 -17.756
   99   HG22  THR  15          1HG2      THR  15   9.256  10.878 -16.050
  100   HG23  THR  15          2HG2      THR  15   8.058  11.955 -16.769
  101    H    GLY  16           H        GLY  16   8.197   6.898 -16.264
  102    HA2  GLY  16           2HA      GLY  16  10.800   7.100 -17.622
  103    HA3  GLY  16           3HA      GLY  16  10.516   6.307 -16.079
  104    H    PHE  17           H        PHE  17   7.971   5.323 -17.757
  105    HA   PHE  17           HA       PHE  17   8.359   2.724 -17.950
  106    HB2  PHE  17           2HB      PHE  17   6.932   2.626 -19.951
  107    HB3  PHE  17           3HB      PHE  17   6.328   3.804 -18.789
  108    HD1  PHE  17           HD2      PHE  17   7.470   6.244 -19.193
  109    HD2  PHE  17           HD1      PHE  17   6.791   3.251 -22.141
  110    HE1  PHE  17           HE2      PHE  17   7.474   7.973 -20.943
  111    HE2  PHE  17           HE1      PHE  17   6.795   4.975 -23.897
  112    HZ   PHE  17           HZ       PHE  17   7.135   7.339 -23.299
  113    H    THR  18           H        THR  18   9.431   4.892 -20.567
  114    HA   THR  18           HA       THR  18  11.349   2.806 -21.381
  115    HB   THR  18           HB       THR  18  10.236   4.987 -23.152
  116    HG1  THR  18           HG1      THR  18   9.454   2.263 -22.847
  117   HG21  THR  18          3HG2      THR  18  11.114   3.497 -24.954
  118   HG22  THR  18          1HG2      THR  18  11.872   2.511 -23.704
  119   HG23  THR  18          2HG2      THR  18  12.368   4.189 -23.925
  120    H    LEU  19           H        LEU  19  10.987   5.937 -20.139
  121    HA   LEU  19           HA       LEU  19  13.487   6.980 -21.141
  122    HB2  LEU  19           2HB      LEU  19  11.318   7.955 -19.358
  123    HB3  LEU  19           3HB      LEU  19  12.906   8.705 -19.220
  124    HG   LEU  19           HG       LEU  19  11.520  10.037 -20.661
  125   HD11  LEU  19          1HD1      LEU  19  13.991   8.892 -21.437
  126   HD12  LEU  19          2HD1      LEU  19  13.327  10.468 -21.865
  127   HD13  LEU  19          3HD1      LEU  19  12.998   9.066 -22.884
  128   HD21  LEU  19          3HD2      LEU  19  10.254   9.267 -22.408
  129   HD22  LEU  19          1HD2      LEU  19  10.158   7.887 -21.315
  130   HD23  LEU  19          2HD2      LEU  19  11.279   7.857 -22.676
  131    H    VAL  20           H        VAL  20  12.524   4.947 -18.612
  132    HA   VAL  20           HA       VAL  20  14.550   5.659 -16.714
  133    HB   VAL  20           HB       VAL  20  12.674   3.327 -16.967
  134   HG11  VAL  20          1HG1      VAL  20  15.033   3.617 -15.141
  135   HG12  VAL  20          2HG1      VAL  20  13.612   2.690 -14.658
  136   HG13  VAL  20          3HG1      VAL  20  14.528   2.220 -16.090
  137   HG21  VAL  20          3HG2      VAL  20  12.569   5.866 -15.739
  138   HG22  VAL  20          1HG2      VAL  20  11.379   4.566 -15.657
  139   HG23  VAL  20          2HG2      VAL  20  12.657   4.669 -14.446
  140    HA   PRO  21           HA       PRO  21  16.683   1.668 -18.436
  141    HB2  PRO  21           2HB      PRO  21  15.736   0.686 -20.783
  142    HB3  PRO  21           3HB      PRO  21  15.117   0.175 -19.209
  143    HG2  PRO  21           2HG      PRO  21  13.981   2.164 -21.137
  144    HG3  PRO  21           3HG      PRO  21  13.146   0.910 -20.201
  145    HD2  PRO  21           2HD      PRO  21  13.168   3.512 -19.455
  146    HD3  PRO  21           3HD      PRO  21  13.122   2.183 -18.280
  147    H    VAL  22           H        VAL  22  15.546   4.226 -20.490
  148    HA   VAL  22           HA       VAL  22  17.939   4.061 -22.175
  149    HB   VAL  22           HB       VAL  22  15.544   5.879 -22.474
  150   HG11  VAL  22          1HG1      VAL  22  16.499   5.959 -24.867
  151   HG12  VAL  22          2HG1      VAL  22  17.290   6.916 -23.613
  152   HG13  VAL  22          3HG1      VAL  22  17.992   5.382 -24.129
  153   HG21  VAL  22          3HG2      VAL  22  15.023   3.451 -22.706
  154   HG22  VAL  22          1HG2      VAL  22  14.751   4.389 -24.174
  155   HG23  VAL  22          2HG2      VAL  22  16.188   3.376 -24.028
  156    H    GLU  23           H        GLU  23  16.801   5.638 -19.427
  157    HA   GLU  23           HA       GLU  23  17.810   8.225 -19.686
  158    HB2  GLU  23           2HB      GLU  23  16.715   8.228 -17.728
  159    HB3  GLU  23           3HB      GLU  23  16.923   6.495 -17.519
  160    HG2  GLU  23           2HG      GLU  23  19.103   6.816 -16.566
  161    HG3  GLU  23           3HG      GLU  23  19.039   8.544 -16.908
  162    H    ASP  24           H        ASP  24  19.446   5.228 -19.358
  163    HA   ASP  24           HA       ASP  24  21.959   6.571 -18.650
  164    HB2  ASP  24           2HB      ASP  24  21.150   4.526 -17.361
  165    HB3  ASP  24           3HB      ASP  24  21.505   3.593 -18.813
  166    H    HIS  25           H        HIS  25  20.262   5.601 -21.322
  167    HA   HIS  25           HA       HIS  25  20.776   5.194 -23.504
  168    HB2  HIS  25           2HB      HIS  25  21.972   7.433 -22.949
  169    HB3  HIS  25           3HB      HIS  25  23.450   6.479 -23.025
  170    HD1  HIS  25           HD1      HIS  25  23.309   4.867 -25.435
  171    HD2  HIS  25           HD2      HIS  25  21.597   8.651 -25.318
  172    HE1  HIS  25           HE1      HIS  25  23.126   5.597 -27.834
  Start of MODEL    3
    1    H1   THR   1           H        THR   1   1.259   0.009  -0.757
    2    HA   THR   1           HA       THR   1   3.022   0.929  -2.572
    3    HB   THR   1           HB       THR   1   3.146  -1.972  -3.169
    4    HG1  THR   1           HG1      THR   1   4.907  -0.785  -1.269
    5   HG21  THR   1          3HG2      THR   1   4.243   0.331  -4.214
    6   HG22  THR   1          1HG2      THR   1   4.778  -1.314  -4.556
    7   HG23  THR   1          2HG2      THR   1   5.578  -0.369  -3.299
    8    H    GLY   2           H        GLY   2   0.588  -1.569  -2.071
    9    HA2  GLY   2           2HA      GLY   2  -0.423  -1.631  -4.709
   10    HA3  GLY   2           3HA      GLY   2  -1.290  -2.136  -3.265
   11    H    ASN   3           H        ASN   3  -1.140   0.440  -1.957
   12    HA   ASN   3           HA       ASN   3  -2.971   1.972  -3.685
   13    HB2  ASN   3           2HB      ASN   3  -3.940   0.766  -1.616
   14    HB3  ASN   3           3HB      ASN   3  -3.108   2.003  -0.678
   15   HD21  ASN   3          1HD2      ASN   3  -5.308   1.661  -3.434
   16   HD22  ASN   3          2HD2      ASN   3  -6.265   3.050  -3.063
   17    H    VAL   4           H        VAL   4  -0.007   1.980  -2.212
   18    HA   VAL   4           HA       VAL   4   0.017   4.858  -1.679
   19    HB   VAL   4           HB       VAL   4   2.269   2.893  -1.257
   20   HG11  VAL   4          1HG1      VAL   4   1.844   5.766  -0.700
   21   HG12  VAL   4          2HG1      VAL   4   2.663   4.826   0.550
   22   HG13  VAL   4          3HG1      VAL   4   3.325   4.890  -1.084
   23   HG21  VAL   4          3HG2      VAL   4  -0.046   3.631   0.490
   24   HG22  VAL   4          1HG2      VAL   4   0.644   2.042   0.159
   25   HG23  VAL   4          2HG2      VAL   4   1.501   3.176   1.203
   26    H    GLY   5           H        GLY   5   0.696   2.700  -4.172
   27    HA2  GLY   5           2HA      GLY   5   2.540   4.637  -5.430
   28    HA3  GLY   5           3HA      GLY   5   2.585   2.908  -5.741
   29    H    LEU   6           H        LEU   6  -0.324   4.881  -5.514
   30    HA   LEU   6           HA       LEU   6  -1.142   3.962  -8.136
   31    HB2  LEU   6           2HB      LEU   6  -2.717   4.013  -6.245
   32    HB3  LEU   6           3HB      LEU   6  -2.554   5.767  -6.176
   33    HG   LEU   6           HG       LEU   6  -3.373   4.830  -8.805
   34   HD11  LEU   6          1HD1      LEU   6  -4.884   3.949  -6.391
   35   HD12  LEU   6          2HD1      LEU   6  -4.612   3.112  -7.919
   36   HD13  LEU   6          3HD1      LEU   6  -5.768   4.442  -7.836
   37   HD21  LEU   6          3HD2      LEU   6  -4.480   6.784  -8.802
   38   HD22  LEU   6          1HD2      LEU   6  -3.497   7.137  -7.380
   39   HD23  LEU   6          2HD2      LEU   6  -5.141   6.526  -7.187
   40    H    SER   7           H        SER   7  -1.391   7.201  -6.681
   41    HA   SER   7           HA       SER   7  -1.283   8.504  -9.201
   42    HB2  SER   7           2HB      SER   7  -0.590  10.358  -7.176
   43    HB3  SER   7           3HB      SER   7  -2.164  10.131  -7.939
   44    HG   SER   7           HG       SER   7  -2.676   8.629  -6.342
   45    HA   PRO   8           HA       PRO   8   3.194   9.757  -7.865
   46    HB2  PRO   8           2HB      PRO   8   4.270   8.428  -5.756
   47    HB3  PRO   8           3HB      PRO   8   3.345   9.923  -5.578
   48    HG2  PRO   8           2HG      PRO   8   2.461   7.091  -5.182
   49    HG3  PRO   8           3HG      PRO   8   2.117   8.519  -4.190
   50    HD2  PRO   8           2HD      PRO   8   0.336   7.516  -5.965
   51    HD3  PRO   8           3HD      PRO   8   0.443   9.249  -5.596
   52    H    GLY   9           H        GLY   9   1.906   6.674  -8.250
   53    HA2  GLY   9           2HA      GLY   9   4.522   5.563  -9.050
   54    HA3  GLY   9           3HA      GLY   9   3.134   4.597  -8.570
   55    H    LEU  10           H        LEU  10   1.336   6.388 -10.164
   56    HA   LEU  10           HA       LEU  10   1.526   4.914 -12.622
   57    HB2  LEU  10           2HB      LEU  10  -0.642   5.346 -11.673
   58    HB3  LEU  10           3HB      LEU  10  -0.351   7.084 -11.704
   59    HG   LEU  10           HG       LEU  10  -0.084   6.182 -14.359
   60   HD11  LEU  10          1HD1      LEU  10  -1.362   4.173 -13.385
   61   HD12  LEU  10          2HD1      LEU  10  -1.982   4.935 -14.849
   62   HD13  LEU  10          3HD1      LEU  10  -2.732   5.280 -13.291
   63   HD21  LEU  10          3HD2      LEU  10  -1.696   7.786 -14.795
   64   HD22  LEU  10          1HD2      LEU  10  -1.002   8.346 -13.273
   65   HD23  LEU  10          2HD2      LEU  10  -2.546   7.494 -13.277
   66    H    SER  11           H        SER  11   1.965   8.278 -11.627
   67    HA   SER  11           HA       SER  11   2.532   9.182 -14.298
   68    HB2  SER  11           2HB      SER  11   2.184  10.390 -11.662
   69    HB3  SER  11           3HB      SER  11   3.495  11.132 -12.578
   70    HG   SER  11           HG       SER  11   1.141  11.850 -12.853
   71    H    THR  12           H        THR  12   4.313   7.745 -11.757
   72    HA   THR  12           HA       THR  12   6.882   8.763 -12.640
   73    HB   THR  12           HB       THR  12   6.208   6.682 -10.551
   74    HG1  THR  12           HG1      THR  12   6.798   9.458 -10.445
   75   HG21  THR  12          3HG2      THR  12   8.799   7.809 -11.529
   76   HG22  THR  12          1HG2      THR  12   8.391   6.149 -11.099
   77   HG23  THR  12          2HG2      THR  12   8.629   7.355  -9.834
   78    H    ALA  13           H        ALA  13   4.841   6.052 -13.230
   79    HA   ALA  13           HA       ALA  13   7.004   4.448 -14.348
   80    HB1  ALA  13           1HB      ALA  13   4.163   3.951 -13.633
   81    HB2  ALA  13           2HB      ALA  13   4.895   2.950 -14.888
   82    HB3  ALA  13           3HB      ALA  13   5.605   3.000 -13.275
   83    H    LEU  14           H        LEU  14   4.215   6.325 -15.373
   84    HA   LEU  14           HA       LEU  14   4.377   5.524 -18.120
   85    HB2  LEU  14           2HB      LEU  14   2.639   7.109 -16.471
   86    HB3  LEU  14           3HB      LEU  14   3.031   7.982 -17.951
   87    HG   LEU  14           HG       LEU  14   0.947   6.727 -18.164
   88   HD11  LEU  14          1HD1      LEU  14   3.308   6.235 -19.847
   89   HD12  LEU  14          2HD1      LEU  14   1.718   6.867 -20.272
   90   HD13  LEU  14          3HD1      LEU  14   1.955   5.129 -20.089
   91   HD21  LEU  14          3HD2      LEU  14   0.782   4.773 -17.114
   92   HD22  LEU  14          1HD2      LEU  14   2.532   4.645 -16.933
   93   HD23  LEU  14          2HD2      LEU  14   1.755   4.081 -18.413
   94    H    THR  15           H        THR  15   6.168   7.620 -16.192
   95    HA   THR  15           HA       THR  15   6.930   9.348 -18.432
   96    HB   THR  15           HB       THR  15   7.644   9.526 -15.499
   97    HG1  THR  15           HG1      THR  15   6.107  11.401 -16.945
   98   HG21  THR  15          3HG2      THR  15   8.101  11.968 -16.825
   99   HG22  THR  15          1HG2      THR  15   8.869  10.718 -17.803
  100   HG23  THR  15          2HG2      THR  15   9.296  10.893 -16.101
  101    H    GLY  16           H        GLY  16   8.222   6.918 -16.241
  102    HA2  GLY  16           2HA      GLY  16  10.827   7.091 -17.601
  103    HA3  GLY  16           3HA      GLY  16  10.541   6.326 -16.045
  104    H    PHE  17           H        PHE  17   7.993   5.319 -17.707
  105    HA   PHE  17           HA       PHE  17   8.375   2.716 -17.854
  106    HB2  PHE  17           2HB      PHE  17   6.950   2.588 -19.856
  107    HB3  PHE  17           3HB      PHE  17   6.348   3.785 -18.713
  108    HD1  PHE  17           HD2      PHE  17   7.493   6.217 -19.154
  109    HD2  PHE  17           HD1      PHE  17   6.812   3.178 -22.056
  110    HE1  PHE  17           HE2      PHE  17   7.501   7.918 -20.932
  111    HE2  PHE  17           HE1      PHE  17   6.820   4.874 -23.839
  112    HZ   PHE  17           HZ       PHE  17   7.163   7.247 -23.278
  113    H    THR  18           H        THR  18   9.451   4.834 -20.512
  114    HA   THR  18           HA       THR  18  11.364   2.729 -21.288
  115    HB   THR  18           HB       THR  18  10.258   4.884 -23.095
  116    HG1  THR  18           HG1      THR  18   9.538   2.130 -23.055
  117   HG21  THR  18          3HG2      THR  18  12.385   4.073 -23.857
  118   HG22  THR  18          1HG2      THR  18  11.133   3.359 -24.872
  119   HG23  THR  18          2HG2      THR  18  11.894   2.399 -23.603
  120    H    LEU  19           H        LEU  19  11.013   5.881 -20.095
  121    HA   LEU  19           HA       LEU  19  13.516   6.899 -21.114
  122    HB2  LEU  19           2HB      LEU  19  11.349   7.911 -19.350
  123    HB3  LEU  19           3HB      LEU  19  12.940   8.657 -19.221
  124    HG   LEU  19           HG       LEU  19  11.563   9.972 -20.686
  125   HD11  LEU  19          1HD1      LEU  19  14.033   8.827 -21.424
  126   HD12  LEU  19          2HD1      LEU  19  13.354  10.375 -21.925
  127   HD13  LEU  19          3HD1      LEU  19  13.048   8.926 -22.883
  128   HD21  LEU  19          3HD2      LEU  19  11.309   7.749 -22.655
  129   HD22  LEU  19          1HD2      LEU  19  10.302   9.179 -22.431
  130   HD23  LEU  19          2HD2      LEU  19  10.180   7.829 -21.302
  131    H    VAL  20           H        VAL  20  12.548   4.907 -18.556
  132    HA   VAL  20           HA       VAL  20  14.574   5.645 -16.667
  133    HB   VAL  20           HB       VAL  20  12.694   3.312 -16.883
  134   HG11  VAL  20          1HG1      VAL  20  15.082   3.614 -15.112
  135   HG12  VAL  20          2HG1      VAL  20  13.646   2.775 -14.524
  136   HG13  VAL  20          3HG1      VAL  20  14.488   2.186 -15.958
  137   HG21  VAL  20          3HG2      VAL  20  11.395   4.583 -15.607
  138   HG22  VAL  20          1HG2      VAL  20  12.665   4.696 -14.389
  139   HG23  VAL  20          2HG2      VAL  20  12.592   5.875 -15.698
  140    HA   PRO  21           HA       PRO  21  16.695   1.620 -18.323
  141    HB2  PRO  21           2HB      PRO  21  15.747   0.606 -20.657
  142    HB3  PRO  21           3HB      PRO  21  15.124   0.121 -19.075
  143    HG2  PRO  21           2HG      PRO  21  13.998   2.084 -21.035
  144    HG3  PRO  21           3HG      PRO  21  13.157   0.847 -20.081
  145    HD2  PRO  21           2HD      PRO  21  13.187   3.461 -19.375
  146    HD3  PRO  21           3HD      PRO  21  13.135   2.150 -18.180
  147    H    VAL  22           H        VAL  22  15.567   4.147 -20.423
  148    HA   VAL  22           HA       VAL  22  17.959   3.947 -22.103
  149    HB   VAL  22           HB       VAL  22  15.574   5.774 -22.425
  150   HG11  VAL  22          1HG1      VAL  22  18.140   5.510 -23.807
  151   HG12  VAL  22          2HG1      VAL  22  16.738   5.493 -24.878
  152   HG13  VAL  22          3HG1      VAL  22  16.995   6.851 -23.782
  153   HG21  VAL  22          3HG2      VAL  22  16.206   3.250 -23.948
  154   HG22  VAL  22          1HG2      VAL  22  15.044   3.345 -22.625
  155   HG23  VAL  22          2HG2      VAL  22  14.771   4.265 -24.104
  156    H    GLU  23           H        GLU  23  16.828   5.574 -19.379
  157    HA   GLU  23           HA       GLU  23  17.860   8.148 -19.678
  158    HB2  GLU  23           2HB      GLU  23  16.755   8.196 -17.726
  159    HB3  GLU  23           3HB      GLU  23  16.944   6.465 -17.487
  160    HG2  GLU  23           2HG      GLU  23  19.127   6.781 -16.533
  161    HG3  GLU  23           3HG      GLU  23  19.074   8.506 -16.895
  162    H    ASP  24           H        ASP  24  19.467   5.144 -19.301
  163    HA   ASP  24           HA       ASP  24  21.912   6.191 -18.225
  164    HB2  ASP  24           2HB      ASP  24  21.204   3.543 -19.495
  165    HB3  ASP  24           3HB      ASP  24  22.812   3.919 -18.881
  166    H    HIS  25           H        HIS  25  20.480   6.485 -21.189
  167    HA   HIS  25           HA       HIS  25  23.021   6.519 -22.659
  168    HB2  HIS  25           2HB      HIS  25  20.584   5.496 -23.384
  169    HB3  HIS  25           3HB      HIS  25  20.556   7.075 -24.161
  170    HD1  HIS  25           HD1      HIS  25  21.412   6.991 -26.467
  171    HD2  HIS  25           HD2      HIS  25  23.261   4.168 -24.044
  172    HE1  HIS  25           HE1      HIS  25  23.015   5.765 -27.967
  Start of MODEL    4
    1    H1   THR   1           H        THR   1   1.713  -0.369  -0.442
    2    HA   THR   1           HA       THR   1   2.872   0.549  -2.227
    3    HB   THR   1           HB       THR   1   3.211  -1.785  -3.912
    4    HG1  THR   1           HG1      THR   1   4.692  -2.843  -2.462
    5   HG21  THR   1          3HG2      THR   1   5.314  -0.152  -2.505
    6   HG22  THR   1          1HG2      THR   1   4.458   0.422  -3.935
    7   HG23  THR   1          2HG2      THR   1   5.456  -1.029  -4.028
    8    H    GLY   2           H        GLY   2   0.360  -1.837  -2.557
    9    HA2  GLY   2           2HA      GLY   2  -0.439  -1.200  -5.206
   10    HA3  GLY   2           3HA      GLY   2  -1.419  -2.023  -4.002
   11    H    ASN   3           H        ASN   3  -0.986   0.340  -2.157
   12    HA   ASN   3           HA       ASN   3  -2.984   2.103  -3.415
   13    HB2  ASN   3           2HB      ASN   3  -2.583   1.356  -0.514
   14    HB3  ASN   3           3HB      ASN   3  -3.645   2.658  -1.041
   15   HD21  ASN   3          1HD2      ASN   3  -4.901   0.896   0.347
   16   HD22  ASN   3          2HD2      ASN   3  -5.820  -0.205  -0.616
   17    H    VAL   4           H        VAL   4   0.191   1.931  -2.500
   18    HA   VAL   4           HA       VAL   4   0.359   4.800  -1.868
   19    HB   VAL   4           HB       VAL   4   2.541   2.741  -1.538
   20   HG11  VAL   4          1HG1      VAL   4   2.313   5.634  -1.101
   21   HG12  VAL   4          2HG1      VAL   4   3.031   4.736   0.238
   22   HG13  VAL   4          3HG1      VAL   4   3.740   4.634  -1.375
   23   HG21  VAL   4          3HG2      VAL   4   0.293   3.519   0.247
   24   HG22  VAL   4          1HG2      VAL   4   1.074   1.953   0.027
   25   HG23  VAL   4          2HG2      VAL   4   1.869   3.208   0.975
   26    H    GLY   5           H        GLY   5   0.806   2.582  -4.361
   27    HA2  GLY   5           2HA      GLY   5   2.658   4.422  -5.748
   28    HA3  GLY   5           3HA      GLY   5   2.621   2.688  -6.029
   29    H    LEU   6           H        LEU   6  -0.180   4.804  -5.696
   30    HA   LEU   6           HA       LEU   6  -1.141   3.887  -8.281
   31    HB2  LEU   6           2HB      LEU   6  -2.726   3.842  -6.498
   32    HB3  LEU   6           3HB      LEU   6  -2.394   5.523  -6.086
   33    HG   LEU   6           HG       LEU   6  -3.339   6.097  -8.386
   34   HD11  LEU   6          1HD1      LEU   6  -3.300   3.388  -8.751
   35   HD12  LEU   6          2HD1      LEU   6  -4.243   4.534  -9.702
   36   HD13  LEU   6          3HD1      LEU   6  -4.990   3.689  -8.346
   37   HD21  LEU   6          3HD2      LEU   6  -4.880   6.792  -6.926
   38   HD22  LEU   6          1HD2      LEU   6  -4.688   5.364  -5.909
   39   HD23  LEU   6          2HD2      LEU   6  -5.744   5.304  -7.320
   40    H    SER   7           H        SER   7  -1.407   7.104  -6.794
   41    HA   SER   7           HA       SER   7  -1.325   8.426  -9.305
   42    HB2  SER   7           2HB      SER   7  -1.676   9.164  -6.508
   43    HB3  SER   7           3HB      SER   7  -0.720  10.353  -7.393
   44    HG   SER   7           HG       SER   7  -3.299  10.158  -7.402
   45    HA   PRO   8           HA       PRO   8   3.122   9.766  -7.954
   46    HB2  PRO   8           2HB      PRO   8   4.225   8.444  -5.855
   47    HB3  PRO   8           3HB      PRO   8   3.268   9.918  -5.666
   48    HG2  PRO   8           2HG      PRO   8   2.445   7.064  -5.293
   49    HG3  PRO   8           3HG      PRO   8   2.069   8.477  -4.290
   50    HD2  PRO   8           2HD      PRO   8   0.312   7.449  -6.075
   51    HD3  PRO   8           3HD      PRO   8   0.381   9.182  -5.692
   52    H    GLY   9           H        GLY   9   1.902   6.659  -8.365
   53    HA2  GLY   9           2HA      GLY   9   4.541   5.611  -9.171
   54    HA3  GLY   9           3HA      GLY   9   3.175   4.611  -8.698
   55    H    LEU  10           H        LEU  10   1.339   6.375 -10.280
   56    HA   LEU  10           HA       LEU  10   1.564   4.923 -12.750
   57    HB2  LEU  10           2HB      LEU  10  -0.618   5.272 -11.840
   58    HB3  LEU  10           3HB      LEU  10  -0.369   7.015 -11.775
   59    HG   LEU  10           HG       LEU  10  -0.078   6.134 -14.478
   60   HD11  LEU  10          1HD1      LEU  10  -2.250   4.859 -12.944
   61   HD12  LEU  10          2HD1      LEU  10  -1.457   4.350 -14.435
   62   HD13  LEU  10          3HD1      LEU  10  -2.707   5.594 -14.482
   63   HD21  LEU  10          3HD2      LEU  10  -0.646   8.386 -13.872
   64   HD22  LEU  10          1HD2      LEU  10  -2.102   7.842 -13.039
   65   HD23  LEU  10          2HD2      LEU  10  -1.984   7.698 -14.793
   66    H    SER  11           H        SER  11   1.932   8.286 -11.725
   67    HA   SER  11           HA       SER  11   2.476   9.225 -14.389
   68    HB2  SER  11           2HB      SER  11   1.733  10.424 -11.985
   69    HB3  SER  11           3HB      SER  11   3.379  10.993 -12.262
   70    HG   SER  11           HG       SER  11   2.460  12.342 -13.582
   71    H    THR  12           H        THR  12   4.287   7.807 -11.860
   72    HA   THR  12           HA       THR  12   6.832   8.895 -12.729
   73    HB   THR  12           HB       THR  12   6.204   6.782 -10.658
   74    HG1  THR  12           HG1      THR  12   6.579   8.470  -9.201
   75   HG21  THR  12          3HG2      THR  12   8.772   7.992 -11.607
   76   HG22  THR  12          1HG2      THR  12   8.402   6.310 -11.228
   77   HG23  THR  12          2HG2      THR  12   8.604   7.484  -9.927
   78    H    ALA  13           H        ALA  13   4.857   6.142 -13.344
   79    HA   ALA  13           HA       ALA  13   7.059   4.598 -14.471
   80    HB1  ALA  13           1HB      ALA  13   5.089   2.994 -14.997
   81    HB2  ALA  13           2HB      ALA  13   5.634   3.179 -13.329
   82    HB3  ALA  13           3HB      ALA  13   4.185   4.019 -13.882
   83    H    LEU  14           H        LEU  14   4.226   6.413 -15.487
   84    HA   LEU  14           HA       LEU  14   4.415   5.641 -18.240
   85    HB2  LEU  14           2HB      LEU  14   2.633   7.167 -16.582
   86    HB3  LEU  14           3HB      LEU  14   3.008   8.064 -18.053
   87    HG   LEU  14           HG       LEU  14   0.956   6.760 -18.285
   88   HD11  LEU  14          1HD1      LEU  14   2.014   5.205 -20.221
   89   HD12  LEU  14          2HD1      LEU  14   3.334   6.345 -19.965
   90   HD13  LEU  14          3HD1      LEU  14   1.728   6.937 -20.390
   91   HD21  LEU  14          3HD2      LEU  14   2.587   4.706 -17.067
   92   HD22  LEU  14          1HD2      LEU  14   1.831   4.138 -18.556
   93   HD23  LEU  14          2HD2      LEU  14   0.834   4.792 -17.256
   94    H    THR  15           H        THR  15   6.150   7.763 -16.291
   95    HA   THR  15           HA       THR  15   6.874   9.527 -18.515
   96    HB   THR  15           HB       THR  15   7.581   9.701 -15.580
   97    HG1  THR  15           HG1      THR  15   6.203  11.718 -16.019
   98   HG21  THR  15          3HG2      THR  15   8.776  10.939 -17.869
   99   HG22  THR  15          1HG2      THR  15   9.186  11.130 -16.166
  100   HG23  THR  15          2HG2      THR  15   7.961  12.165 -16.900
  101    H    GLY  16           H        GLY  16   8.221   7.116 -16.336
  102    HA2  GLY  16           2HA      GLY  16  10.824   7.363 -17.688
  103    HA3  GLY  16           3HA      GLY  16  10.552   6.580 -16.139
  104    H    PHE  17           H        PHE  17   8.036   5.524 -17.819
  105    HA   PHE  17           HA       PHE  17   8.482   2.932 -17.984
  106    HB2  PHE  17           2HB      PHE  17   7.069   2.785 -19.992
  107    HB3  PHE  17           3HB      PHE  17   6.432   3.956 -18.842
  108    HD1  PHE  17           HD1      PHE  17   7.515   6.419 -19.257
  109    HD2  PHE  17           HD2      PHE  17   6.925   3.390 -22.189
  110    HE1  PHE  17           HE1      PHE  17   7.486   8.136 -21.020
  111    HE2  PHE  17           HE2      PHE  17   6.896   5.102 -23.956
  112    HZ   PHE  17           HZ       PHE  17   7.177   7.478 -23.373
  113    H    THR  18           H        THR  18   9.518   5.098 -20.618
  114    HA   THR  18           HA       THR  18  11.485   3.047 -21.403
  115    HB   THR  18           HB       THR  18  10.334   5.184 -23.202
  116    HG1  THR  18           HG1      THR  18   9.684   2.425 -23.292
  117   HG21  THR  18          3HG2      THR  18  11.251   3.701 -24.985
  118   HG22  THR  18          1HG2      THR  18  12.015   2.732 -23.725
  119   HG23  THR  18          2HG2      THR  18  12.488   4.417 -23.951
  120    H    LEU  19           H        LEU  19  11.044   6.189 -20.205
  121    HA   LEU  19           HA       LEU  19  13.526   7.273 -21.203
  122    HB2  LEU  19           2HB      LEU  19  11.331   8.222 -19.434
  123    HB3  LEU  19           3HB      LEU  19  12.901   9.015 -19.319
  124    HG   LEU  19           HG       LEU  19  12.744   9.481 -21.778
  125   HD11  LEU  19          1HD1      LEU  19  10.440   7.805 -21.503
  126   HD12  LEU  19          2HD1      LEU  19  11.175   8.462 -22.965
  127   HD13  LEU  19          3HD1      LEU  19   9.956   9.394 -22.095
  128   HD21  LEU  19          3HD2      LEU  19  10.948  10.628 -19.704
  129   HD22  LEU  19          1HD2      LEU  19  10.744  11.154 -21.375
  130   HD23  LEU  19          2HD2      LEU  19  12.297  11.366 -20.567
  131    H    VAL  20           H        VAL  20  12.586   5.262 -18.644
  132    HA   VAL  20           HA       VAL  20  14.588   6.040 -16.749
  133    HB   VAL  20           HB       VAL  20  12.744   3.683 -16.977
  134   HG11  VAL  20          1HG1      VAL  20  13.684   2.999 -14.715
  135   HG12  VAL  20          2HG1      VAL  20  14.671   2.630 -16.131
  136   HG13  VAL  20          3HG1      VAL  20  15.075   4.009 -15.108
  137   HG21  VAL  20          3HG2      VAL  20  12.593   6.219 -15.788
  138   HG22  VAL  20          1HG2      VAL  20  11.456   4.881 -15.619
  139   HG23  VAL  20          2HG2      VAL  20  12.774   5.071 -14.462
  140    HA   PRO  21           HA       PRO  21  16.813   2.069 -18.395
  141    HB2  PRO  21           2HB      PRO  21  15.898   1.025 -20.728
  142    HB3  PRO  21           3HB      PRO  21  15.283   0.529 -19.147
  143    HG2  PRO  21           2HG      PRO  21  14.112   2.458 -21.114
  144    HG3  PRO  21           3HG      PRO  21  13.301   1.203 -20.159
  145    HD2  PRO  21           2HD      PRO  21  13.263   3.818 -19.459
  146    HD3  PRO  21           3HD      PRO  21  13.241   2.508 -18.260
  147    H    VAL  22           H        VAL  22  15.636   4.575 -20.485
  148    HA   VAL  22           HA       VAL  22  18.040   4.431 -22.159
  149    HB   VAL  22           HB       VAL  22  15.601   6.180 -22.510
  150   HG11  VAL  22          1HG1      VAL  22  17.034   7.295 -23.836
  151   HG12  VAL  22          2HG1      VAL  22  18.178   5.953 -23.902
  152   HG13  VAL  22          3HG1      VAL  22  16.760   5.957 -24.951
  153   HG21  VAL  22          3HG2      VAL  22  16.323   3.667 -24.011
  154   HG22  VAL  22          1HG2      VAL  22  15.147   3.736 -22.699
  155   HG23  VAL  22          2HG2      VAL  22  14.861   4.637 -24.188
  156    H    GLU  23           H        GLU  23  16.842   6.032 -19.450
  157    HA   GLU  23           HA       GLU  23  17.769   8.640 -19.742
  158    HB2  GLU  23           2HB      GLU  23  16.697   8.631 -17.772
  159    HB3  GLU  23           3HB      GLU  23  16.960   6.907 -17.549
  160    HG2  GLU  23           2HG      GLU  23  19.134   7.301 -16.616
  161    HG3  GLU  23           3HG      GLU  23  19.023   9.022 -16.981
  162    H    ASP  24           H        ASP  24  19.513   5.705 -19.379
  163    HA   ASP  24           HA       ASP  24  22.009   7.230 -19.014
  164    HB2  ASP  24           2HB      ASP  24  21.309   4.452 -18.051
  165    HB3  ASP  24           3HB      ASP  24  22.944   5.108 -18.034
  166    H    HIS  25           H        HIS  25  20.201   5.468 -21.157
  167    HA   HIS  25           HA       HIS  25  22.563   4.470 -22.600
  168    HB2  HIS  25           2HB      HIS  25  20.234   3.153 -21.983
  169    HB3  HIS  25           3HB      HIS  25  19.926   3.693 -23.630
  170    HD1  HIS  25           HD1      HIS  25  20.532   1.954 -25.261
  171    HD2  HIS  25           HD2      HIS  25  23.055   1.902 -21.961
  172    HE1  HIS  25           HE1      HIS  25  22.168   0.094 -25.695
  Start of MODEL    5
    1    H1   THR   1           H        THR   1   1.110  -0.516   1.485
    2    HA   THR   1           HA       THR   1   2.248   0.757  -0.158
    3    HB   THR   1           HB       THR   1   3.126  -1.938  -1.094
    4    HG1  THR   1           HG1      THR   1   4.389  -1.827   1.047
    5   HG21  THR   1          3HG2      THR   1   5.201  -0.325  -0.028
    6   HG22  THR   1          1HG2      THR   1   4.169   0.713  -1.011
    7   HG23  THR   1          2HG2      THR   1   4.892  -0.733  -1.716
    8    H    GLY   2           H        GLY   2   0.240  -1.820  -1.409
    9    HA2  GLY   2           2HA      GLY   2   0.673  -1.382  -4.163
   10    HA3  GLY   2           3HA      GLY   2  -0.742  -2.148  -3.458
   11    H    ASN   3           H        ASN   3  -1.505   0.135  -1.855
   12    HA   ASN   3           HA       ASN   3  -2.833   1.649  -3.947
   13    HB2  ASN   3           2HB      ASN   3  -3.829   0.690  -1.684
   14    HB3  ASN   3           3HB      ASN   3  -3.255   2.229  -1.049
   15   HD21  ASN   3          1HD2      ASN   3  -5.535   0.646  -3.100
   16   HD22  ASN   3          2HD2      ASN   3  -6.527   2.025  -3.418
   17    H    VAL   4           H        VAL   4   0.005   1.917  -2.263
   18    HA   VAL   4           HA       VAL   4  -0.041   4.818  -2.007
   19    HB   VAL   4           HB       VAL   4   2.274   2.959  -1.471
   20   HG11  VAL   4          1HG1      VAL   4   2.380   5.155   0.221
   21   HG12  VAL   4          2HG1      VAL   4   3.370   4.881  -1.214
   22   HG13  VAL   4          3HG1      VAL   4   1.884   5.824  -1.334
   23   HG21  VAL   4          3HG2      VAL   4   0.791   2.133   0.062
   24   HG22  VAL   4          1HG2      VAL   4   1.448   3.488   0.980
   25   HG23  VAL   4          2HG2      VAL   4  -0.111   3.644   0.170
   26    H    GLY   5           H        GLY   5   0.700   2.526  -4.359
   27    HA2  GLY   5           2HA      GLY   5   2.571   4.367  -5.709
   28    HA3  GLY   5           3HA      GLY   5   2.481   2.637  -6.007
   29    H    LEU   6           H        LEU   6  -0.311   4.748  -5.713
   30    HA   LEU   6           HA       LEU   6  -1.194   3.924  -8.348
   31    HB2  LEU   6           2HB      LEU   6  -2.782   3.926  -6.511
   32    HB3  LEU   6           3HB      LEU   6  -2.502   5.647  -6.248
   33    HG   LEU   6           HG       LEU   6  -3.341   5.264  -8.947
   34   HD11  LEU   6          1HD1      LEU   6  -5.391   4.165  -8.774
   35   HD12  LEU   6          2HD1      LEU   6  -5.372   4.207  -7.012
   36   HD13  LEU   6          3HD1      LEU   6  -4.276   3.132  -7.879
   37   HD21  LEU   6          3HD2      LEU   6  -5.149   6.382  -6.877
   38   HD22  LEU   6          1HD2      LEU   6  -4.708   7.017  -8.463
   39   HD23  LEU   6          2HD2      LEU   6  -3.586   7.166  -7.110
   40    H    SER   7           H        SER   7  -1.377   7.124  -6.807
   41    HA   SER   7           HA       SER   7  -1.231   8.492  -9.288
   42    HB2  SER   7           2HB      SER   7  -0.528  10.312  -7.267
   43    HB3  SER   7           3HB      SER   7  -2.131  10.056  -7.958
   44    HG   SER   7           HG       SER   7  -2.647   8.733  -6.305
   45    HA   PRO   8           HA       PRO   8   3.264   9.622  -7.903
   46    HB2  PRO   8           2HB      PRO   8   4.307   8.212  -5.831
   47    HB3  PRO   8           3HB      PRO   8   3.410   9.719  -5.612
   48    HG2  PRO   8           2HG      PRO   8   2.472   6.894  -5.301
   49    HG3  PRO   8           3HG      PRO   8   2.151   8.299  -4.268
   50    HD2  PRO   8           2HD      PRO   8   0.358   7.382  -6.077
   51    HD3  PRO   8           3HD      PRO   8   0.496   9.101  -5.658
   52    H    GLY   9           H        GLY   9   1.920   6.576  -8.379
   53    HA2  GLY   9           2HA      GLY   9   4.516   5.439  -9.205
   54    HA3  GLY   9           3HA      GLY   9   3.110   4.486  -8.755
   55    H    LEU  10           H        LEU  10   1.350   6.356 -10.302
   56    HA   LEU  10           HA       LEU  10   1.515   4.946 -12.799
   57    HB2  LEU  10           2HB      LEU  10  -0.654   5.358 -11.925
   58    HB3  LEU  10           3HB      LEU  10  -0.326   7.080 -11.750
   59    HG   LEU  10           HG       LEU  10  -0.063   6.299 -14.504
   60   HD11  LEU  10          1HD1      LEU  10  -2.591   5.899 -14.750
   61   HD12  LEU  10          2HD1      LEU  10  -2.530   5.406 -13.058
   62   HD13  LEU  10          3HD1      LEU  10  -1.571   4.545 -14.261
   63   HD21  LEU  10          3HD2      LEU  10  -2.159   7.958 -14.444
   64   HD22  LEU  10          1HD2      LEU  10  -0.492   8.512 -14.282
   65   HD23  LEU  10          2HD2      LEU  10  -1.490   8.289 -12.845
   66    H    SER  11           H        SER  11   2.016   8.276 -11.716
   67    HA   SER  11           HA       SER  11   2.613   9.237 -14.359
   68    HB2  SER  11           2HB      SER  11   2.270  10.381 -11.698
   69    HB3  SER  11           3HB      SER  11   3.612  11.115 -12.576
   70    HG   SER  11           HG       SER  11   1.108  10.737 -13.813
   71    H    THR  12           H        THR  12   4.356   7.697 -11.852
   72    HA   THR  12           HA       THR  12   6.948   8.684 -12.701
   73    HB   THR  12           HB       THR  12   6.223   6.563 -10.670
   74    HG1  THR  12           HG1      THR  12   5.777   8.974 -10.364
   75   HG21  THR  12          3HG2      THR  12   8.583   6.887  -9.906
   76   HG22  THR  12          1HG2      THR  12   8.875   7.819 -11.374
   77   HG23  THR  12          2HG2      THR  12   8.436   6.115 -11.485
   78    H    ALA  13           H        ALA  13   4.853   6.033 -13.368
   79    HA   ALA  13           HA       ALA  13   6.987   4.415 -14.523
   80    HB1  ALA  13           1HB      ALA  13   5.584   2.928 -13.549
   81    HB2  ALA  13           2HB      ALA  13   4.166   3.954 -13.762
   82    HB3  ALA  13           3HB      ALA  13   4.790   3.019 -15.121
   83    H    LEU  14           H        LEU  14   4.239   6.374 -15.505
   84    HA   LEU  14           HA       LEU  14   4.394   5.645 -18.272
   85    HB2  LEU  14           2HB      LEU  14   2.684   7.223 -16.585
   86    HB3  LEU  14           3HB      LEU  14   3.097   8.123 -18.043
   87    HG   LEU  14           HG       LEU  14   1.000   6.942 -18.331
   88   HD11  LEU  14          1HD1      LEU  14   1.667   6.872 -20.448
   89   HD12  LEU  14          2HD1      LEU  14   2.196   5.216 -20.154
   90   HD13  LEU  14          3HD1      LEU  14   3.336   6.551 -19.979
   91   HD21  LEU  14          3HD2      LEU  14   2.560   4.708 -17.213
   92   HD22  LEU  14          1HD2      LEU  14   1.477   4.297 -18.543
   93   HD23  LEU  14          2HD2      LEU  14   0.837   5.067 -17.092
   94    H    THR  15           H        THR  15   6.220   7.653 -16.284
   95    HA   THR  15           HA       THR  15   7.025   9.422 -18.476
   96    HB   THR  15           HB       THR  15   7.729   9.514 -15.536
   97    HG1  THR  15           HG1      THR  15   6.078  11.228 -17.108
   98   HG21  THR  15          3HG2      THR  15   8.241  11.981 -16.775
   99   HG22  THR  15          1HG2      THR  15   8.966  10.757 -17.816
  100   HG23  THR  15          2HG2      THR  15   9.419  10.848 -16.114
  101    H    GLY  16           H        GLY  16   8.259   6.916 -16.338
  102    HA2  GLY  16           2HA      GLY  16  10.874   7.071 -17.680
  103    HA3  GLY  16           3HA      GLY  16  10.563   6.272 -16.146
  104    H    PHE  17           H        PHE  17   8.008   5.361 -17.852
  105    HA   PHE  17           HA       PHE  17   8.340   2.755 -18.065
  106    HB2  PHE  17           2HB      PHE  17   6.926   2.708 -20.078
  107    HB3  PHE  17           3HB      PHE  17   6.339   3.884 -18.906
  108    HD1  PHE  17           HD2      PHE  17   7.529   6.305 -19.273
  109    HD2  PHE  17           HD1      PHE  17   6.815   3.360 -22.262
  110    HE1  PHE  17           HE2      PHE  17   7.580   8.054 -21.003
  111    HE2  PHE  17           HE1      PHE  17   6.865   5.104 -23.997
  112    HZ   PHE  17           HZ       PHE  17   7.247   7.455 -23.368
  113    H    THR  18           H        THR  18   9.477   4.924 -20.654
  114    HA   THR  18           HA       THR  18  11.354   2.803 -21.475
  115    HB   THR  18           HB       THR  18  10.301   5.021 -23.236
  116    HG1  THR  18           HG1      THR  18   9.380   2.385 -22.773
  117   HG21  THR  18          3HG2      THR  18  11.885   2.514 -23.793
  118   HG22  THR  18          1HG2      THR  18  12.416   4.181 -24.005
  119   HG23  THR  18          2HG2      THR  18  11.153   3.519 -25.043
  120    H    LEU  19           H        LEU  19  11.046   5.940 -20.222
  121    HA   LEU  19           HA       LEU  19  13.577   6.932 -21.196
  122    HB2  LEU  19           2HB      LEU  19  11.420   7.946 -19.415
  123    HB3  LEU  19           3HB      LEU  19  13.023   8.668 -19.283
  124    HG   LEU  19           HG       LEU  19  12.892   9.179 -21.736
  125   HD11  LEU  19          1HD1      LEU  19  11.278   8.257 -22.942
  126   HD12  LEU  19          2HD1      LEU  19  10.100   9.221 -22.051
  127   HD13  LEU  19          3HD1      LEU  19  10.517   7.601 -21.492
  128   HD21  LEU  19          3HD2      LEU  19  12.090  10.627 -19.636
  129   HD22  LEU  19          1HD2      LEU  19  10.563  10.531 -20.513
  130   HD23  LEU  19          2HD2      LEU  19  11.989  11.210 -21.298
  131    H    VAL  20           H        VAL  20  12.541   4.921 -18.673
  132    HA   VAL  20           HA       VAL  20  14.573   5.578 -16.762
  133    HB   VAL  20           HB       VAL  20  12.614   3.322 -17.028
  134   HG11  VAL  20          1HG1      VAL  20  15.050   3.436 -15.305
  135   HG12  VAL  20          2HG1      VAL  20  13.583   2.670 -14.693
  136   HG13  VAL  20          3HG1      VAL  20  14.345   2.068 -16.166
  137   HG21  VAL  20          3HG2      VAL  20  11.416   4.464 -15.525
  138   HG22  VAL  20          1HG2      VAL  20  12.825   4.763 -14.507
  139   HG23  VAL  20          2HG2      VAL  20  12.486   5.820 -15.878
  140    HA   PRO  21           HA       PRO  21  16.614   1.532 -18.465
  141    HB2  PRO  21           2HB      PRO  21  15.653   0.566 -20.814
  142    HB3  PRO  21           3HB      PRO  21  15.015   0.076 -19.240
  143    HG2  PRO  21           2HG      PRO  21  13.937   2.086 -21.180
  144    HG3  PRO  21           3HG      PRO  21  13.067   0.856 -20.244
  145    HD2  PRO  21           2HD      PRO  21  13.150   3.460 -19.506
  146    HD3  PRO  21           3HD      PRO  21  13.066   2.135 -18.326
  147    H    VAL  22           H        VAL  22  15.561   4.126 -20.512
  148    HA   VAL  22           HA       VAL  22  17.954   3.892 -22.191
  149    HB   VAL  22           HB       VAL  22  15.599   5.757 -22.509
  150   HG11  VAL  22          1HG1      VAL  22  18.030   5.198 -24.179
  151   HG12  VAL  22          2HG1      VAL  22  16.558   5.875 -24.877
  152   HG13  VAL  22          3HG1      VAL  22  17.415   6.749 -23.607
  153   HG21  VAL  22          3HG2      VAL  22  15.040   3.338 -22.752
  154   HG22  VAL  22          1HG2      VAL  22  14.798   4.284 -24.221
  155   HG23  VAL  22          2HG2      VAL  22  16.216   3.248 -24.063
  156    H    GLU  23           H        GLU  23  16.839   5.502 -19.454
  157    HA   GLU  23           HA       GLU  23  17.906   8.066 -19.713
  158    HB2  GLU  23           2HB      GLU  23  16.805   8.094 -17.758
  159    HB3  GLU  23           3HB      GLU  23  16.977   6.357 -17.545
  160    HG2  GLU  23           2HG      GLU  23  19.161   6.635 -16.589
  161    HG3  GLU  23           3HG      GLU  23  19.132   8.364 -16.932
  162    H    ASP  24           H        ASP  24  19.477   5.035 -19.380
  163    HA   ASP  24           HA       ASP  24  21.931   6.015 -18.280
  164    HB2  ASP  24           2HB      ASP  24  21.169   3.430 -19.636
  165    HB3  ASP  24           3HB      ASP  24  22.804   3.757 -19.069
  166    H    HIS  25           H        HIS  25  20.508   6.397 -21.254
  167    HA   HIS  25           HA       HIS  25  23.119   6.767 -22.571
  168    HB2  HIS  25           2HB      HIS  25  21.377   4.996 -23.450
  169    HB3  HIS  25           3HB      HIS  25  20.606   6.413 -24.156
  170    HD1  HIS  25           HD1      HIS  25  23.085   3.925 -24.876
  171    HD2  HIS  25           HD2      HIS  25  22.557   7.931 -25.841
  172    HE1  HIS  25           HE1      HIS  25  24.558   4.335 -26.872
  Start of MODEL    6
    1    H1   THR   1           H        THR   1   1.426  -0.022   1.135
    2    HA   THR   1           HA       THR   1   2.361   0.925  -0.804
    3    HB   THR   1           HB       THR   1   2.748  -1.996  -1.427
    4    HG1  THR   1           HG1      THR   1   4.408  -1.947   0.172
    5   HG21  THR   1          3HG2      THR   1   4.023  -0.941  -2.975
    6   HG22  THR   1          1HG2      THR   1   5.165  -0.821  -1.638
    7   HG23  THR   1          2HG2      THR   1   4.124   0.546  -2.034
    8    H    GLY   2           H        GLY   2  -0.102  -1.483  -1.373
    9    HA2  GLY   2           2HA      GLY   2  -0.185  -1.417  -4.177
   10    HA3  GLY   2           3HA      GLY   2  -1.537  -1.823  -3.131
   11    H    ASN   3           H        ASN   3  -1.831   0.612  -1.782
   12    HA   ASN   3           HA       ASN   3  -2.997   2.213  -3.930
   13    HB2  ASN   3           2HB      ASN   3  -3.416   2.201  -0.937
   14    HB3  ASN   3           3HB      ASN   3  -4.155   3.387  -2.010
   15   HD21  ASN   3          1HD2      ASN   3  -6.244   2.846  -1.880
   16   HD22  ASN   3          2HD2      ASN   3  -6.890   1.301  -2.304
   17    H    VAL   4           H        VAL   4  -0.187   2.136  -2.185
   18    HA   VAL   4           HA       VAL   4   0.130   5.001  -1.857
   19    HB   VAL   4           HB       VAL   4   2.232   2.864  -1.504
   20   HG11  VAL   4          1HG1      VAL   4   3.295   4.947  -1.583
   21   HG12  VAL   4          2HG1      VAL   4   2.000   5.743  -0.687
   22   HG13  VAL   4          3HG1      VAL   4   3.090   4.629   0.139
   23   HG21  VAL   4          3HG2      VAL   4   0.342   3.993   0.560
   24   HG22  VAL   4          1HG2      VAL   4   0.278   2.364  -0.114
   25   HG23  VAL   4          2HG2      VAL   4   1.658   2.860   0.866
   26    H    GLY   5           H        GLY   5   0.517   2.763  -4.342
   27    HA2  GLY   5           2HA      GLY   5   2.455   4.524  -5.712
   28    HA3  GLY   5           3HA      GLY   5   2.340   2.794  -5.999
   29    H    LEU   6           H        LEU   6  -0.364   5.035  -5.679
   30    HA   LEU   6           HA       LEU   6  -1.348   4.170  -8.272
   31    HB2  LEU   6           2HB      LEU   6  -2.483   5.295  -5.841
   32    HB3  LEU   6           3HB      LEU   6  -3.122   6.049  -7.300
   33    HG   LEU   6           HG       LEU   6  -4.495   4.165  -6.431
   34   HD11  LEU   6          1HD1      LEU   6  -3.413   3.364  -9.096
   35   HD12  LEU   6          2HD1      LEU   6  -4.230   4.915  -8.905
   36   HD13  LEU   6          3HD1      LEU   6  -5.083   3.418  -8.531
   37   HD21  LEU   6          3HD2      LEU   6  -3.658   2.145  -5.998
   38   HD22  LEU   6          1HD2      LEU   6  -2.066   2.894  -6.123
   39   HD23  LEU   6          2HD2      LEU   6  -2.776   2.094  -7.525
   40    H    SER   7           H        SER   7  -1.468   7.394  -6.783
   41    HA   SER   7           HA       SER   7  -1.308   8.715  -9.291
   42    HB2  SER   7           2HB      SER   7  -1.714   9.450  -6.525
   43    HB3  SER   7           3HB      SER   7  -0.592  10.567  -7.302
   44    HG   SER   7           HG       SER   7  -2.984  10.957  -7.467
   45    HA   PRO   8           HA       PRO   8   3.194   9.831  -7.918
   46    HB2  PRO   8           2HB      PRO   8   4.221   8.454  -5.816
   47    HB3  PRO   8           3HB      PRO   8   3.336   9.972  -5.629
   48    HG2  PRO   8           2HG      PRO   8   2.372   7.162  -5.265
   49    HG3  PRO   8           3HG      PRO   8   2.062   8.590  -4.260
   50    HD2  PRO   8           2HD      PRO   8   0.264   7.653  -6.055
   51    HD3  PRO   8           3HD      PRO   8   0.417   9.379  -5.669
   52    H    GLY   9           H        GLY   9   1.824   6.789  -8.340
   53    HA2  GLY   9           2HA      GLY   9   4.412   5.612  -9.134
   54    HA3  GLY   9           3HA      GLY   9   2.994   4.682  -8.673
   55    H    LEU  10           H        LEU  10   1.256   6.534 -10.260
   56    HA   LEU  10           HA       LEU  10   1.430   5.083 -12.734
   57    HB2  LEU  10           2HB      LEU  10  -0.725   5.606 -11.705
   58    HB3  LEU  10           3HB      LEU  10  -0.401   7.328 -11.896
   59    HG   LEU  10           HG       LEU  10  -1.993   6.163 -13.555
   60   HD11  LEU  10          1HD1      LEU  10  -1.633   7.877 -14.986
   61   HD12  LEU  10          2HD1      LEU  10   0.107   7.598 -15.061
   62   HD13  LEU  10          3HD1      LEU  10  -0.593   8.435 -13.676
   63   HD21  LEU  10          3HD2      LEU  10   0.477   5.524 -15.090
   64   HD22  LEU  10          1HD2      LEU  10  -1.150   4.857 -15.236
   65   HD23  LEU  10          2HD2      LEU  10  -0.109   4.360 -13.901
   66    H    SER  11           H        SER  11   1.957   8.414 -11.684
   67    HA   SER  11           HA       SER  11   2.549   9.346 -14.342
   68    HB2  SER  11           2HB      SER  11   1.586  10.727 -12.392
   69    HB3  SER  11           3HB      SER  11   3.244  10.800 -11.796
   70    HG   SER  11           HG       SER  11   3.765  12.120 -13.373
   71    H    THR  12           H        THR  12   4.282   7.831 -11.814
   72    HA   THR  12           HA       THR  12   6.878   8.805 -12.668
   73    HB   THR  12           HB       THR  12   6.144   6.715 -10.608
   74    HG1  THR  12           HG1      THR  12   6.333   8.338  -9.165
   75   HG21  THR  12          3HG2      THR  12   8.301   6.103 -10.964
   76   HG22  THR  12          1HG2      THR  12   8.626   7.494  -9.931
   77   HG23  THR  12          2HG2      THR  12   8.736   7.653 -11.684
   78    H    ALA  13           H        ALA  13   4.781   6.150 -13.304
   79    HA   ALA  13           HA       ALA  13   6.914   4.509 -14.427
   80    HB1  ALA  13           1HB      ALA  13   4.859   3.012 -14.978
   81    HB2  ALA  13           2HB      ALA  13   5.426   3.143 -13.312
   82    HB3  ALA  13           3HB      ALA  13   4.019   4.066 -13.840
   83    H    LEU  14           H        LEU  14   4.175   6.461 -15.450
   84    HA   LEU  14           HA       LEU  14   4.341   5.693 -18.205
   85    HB2  LEU  14           2HB      LEU  14   2.628   7.299 -16.549
   86    HB3  LEU  14           3HB      LEU  14   3.051   8.179 -18.017
   87    HG   LEU  14           HG       LEU  14   0.940   6.976 -18.259
   88   HD11  LEU  14          1HD1      LEU  14   1.929   5.374 -20.193
   89   HD12  LEU  14          2HD1      LEU  14   3.301   6.450 -19.931
   90   HD13  LEU  14          3HD1      LEU  14   1.727   7.118 -20.360
   91   HD21  LEU  14          3HD2      LEU  14   1.688   4.314 -18.530
   92   HD22  LEU  14          1HD2      LEU  14   0.720   5.015 -17.233
   93   HD23  LEU  14          2HD2      LEU  14   2.465   4.844 -17.037
   94    H    THR  15           H        THR  15   6.166   7.721 -16.238
   95    HA   THR  15           HA       THR  15   6.984   9.460 -18.449
   96    HB   THR  15           HB       THR  15   7.688   9.580 -15.510
   97    HG1  THR  15           HG1      THR  15   6.029  11.267 -17.104
   98   HG21  THR  15          3HG2      THR  15   9.363  10.934 -16.079
   99   HG22  THR  15          1HG2      THR  15   8.195  12.031 -16.814
  100   HG23  THR  15          2HG2      THR  15   8.954  10.770 -17.787
  101    H    GLY  16           H        GLY  16   8.207   6.975 -16.278
  102    HA2  GLY  16           2HA      GLY  16  10.823   7.102 -17.622
  103    HA3  GLY  16           3HA      GLY  16  10.508   6.324 -16.078
  104    H    PHE  17           H        PHE  17   7.949   5.399 -17.768
  105    HA   PHE  17           HA       PHE  17   8.270   2.790 -17.948
  106    HB2  PHE  17           2HB      PHE  17   6.855   2.721 -19.958
  107    HB3  PHE  17           3HB      PHE  17   6.274   3.919 -18.805
  108    HD1  PHE  17           HD1      PHE  17   7.481   6.327 -19.209
  109    HD2  PHE  17           HD2      PHE  17   6.744   3.341 -22.152
  110    HE1  PHE  17           HE1      PHE  17   7.541   8.048 -20.966
  111    HE2  PHE  17           HE2      PHE  17   6.804   5.058 -23.914
  112    HZ   PHE  17           HZ       PHE  17   7.204   7.415 -23.322
  113    H    THR  18           H        THR  18   9.416   4.918 -20.567
  114    HA   THR  18           HA       THR  18  11.283   2.778 -21.360
  115    HB   THR  18           HB       THR  18  10.240   4.981 -23.146
  116    HG1  THR  18           HG1      THR  18   9.298   2.367 -22.630
  117   HG21  THR  18          3HG2      THR  18  11.091   3.463 -24.937
  118   HG22  THR  18          1HG2      THR  18  11.813   2.460 -23.679
  119   HG23  THR  18          2HG2      THR  18  12.356   4.124 -23.901
  120    H    LEU  19           H        LEU  19  10.997   5.923 -20.131
  121    HA   LEU  19           HA       LEU  19  13.530   6.894 -21.120
  122    HB2  LEU  19           2HB      LEU  19  11.375   7.935 -19.357
  123    HB3  LEU  19           3HB      LEU  19  12.982   8.643 -19.210
  124    HG   LEU  19           HG       LEU  19  11.643  10.006 -20.668
  125   HD11  LEU  19          1HD1      LEU  19  14.087   8.791 -21.420
  126   HD12  LEU  19          2HD1      LEU  19  13.469  10.381 -21.863
  127   HD13  LEU  19          3HD1      LEU  19  13.110   8.983 -22.875
  128   HD21  LEU  19          3HD2      LEU  19  11.356   7.822 -22.673
  129   HD22  LEU  19          1HD2      LEU  19  10.371   9.263 -22.423
  130   HD23  LEU  19          2HD2      LEU  19  10.224   7.894 -21.321
  131    H    VAL  20           H        VAL  20  12.496   4.898 -18.590
  132    HA   VAL  20           HA       VAL  20  14.525   5.565 -16.680
  133    HB   VAL  20           HB       VAL  20  12.591   3.282 -16.938
  134   HG11  VAL  20          1HG1      VAL  20  14.451   2.157 -16.057
  135   HG12  VAL  20          2HG1      VAL  20  14.914   3.531 -15.051
  136   HG13  VAL  20          3HG1      VAL  20  13.478   2.586 -14.650
  137   HG21  VAL  20          3HG2      VAL  20  12.544   5.827 -15.719
  138   HG22  VAL  20          1HG2      VAL  20  11.319   4.560 -15.643
  139   HG23  VAL  20          2HG2      VAL  20  12.590   4.633 -14.422
  140    HA   PRO  21           HA       PRO  21  16.566   1.513 -18.370
  141    HB2  PRO  21           2HB      PRO  21  15.612   0.547 -20.721
  142    HB3  PRO  21           3HB      PRO  21  14.968   0.058 -19.150
  143    HG2  PRO  21           2HG      PRO  21  13.899   2.068 -21.094
  144    HG3  PRO  21           3HG      PRO  21  13.024   0.840 -20.160
  145    HD2  PRO  21           2HD      PRO  21  13.108   3.444 -19.423
  146    HD3  PRO  21           3HD      PRO  21  13.019   2.121 -18.243
  147    H    VAL  22           H        VAL  22  15.511   4.091 -20.444
  148    HA   VAL  22           HA       VAL  22  17.912   3.857 -22.109
  149    HB   VAL  22           HB       VAL  22  15.569   5.737 -22.434
  150   HG11  VAL  22          1HG1      VAL  22  16.619   5.628 -24.860
  151   HG12  VAL  22          2HG1      VAL  22  17.205   6.768 -23.647
  152   HG13  VAL  22          3HG1      VAL  22  18.083   5.268 -23.947
  153   HG21  VAL  22          3HG2      VAL  22  14.984   3.322 -22.658
  154   HG22  VAL  22          1HG2      VAL  22  14.747   4.260 -24.132
  155   HG23  VAL  22          2HG2      VAL  22  16.155   3.210 -23.972
  156    H    GLU  23           H        GLU  23  16.795   5.474 -19.376
  157    HA   GLU  23           HA       GLU  23  17.873   8.033 -19.637
  158    HB2  GLU  23           2HB      GLU  23  16.764   8.071 -17.687
  159    HB3  GLU  23           3HB      GLU  23  16.926   6.335 -17.470
  160    HG2  GLU  23           2HG      GLU  23  19.108   6.604 -16.505
  161    HG3  GLU  23           3HG      GLU  23  19.088   8.332 -16.850
  162    H    ASP  24           H        ASP  24  19.429   4.996 -19.291
  163    HA   ASP  24           HA       ASP  24  21.885   5.975 -18.187
  164    HB2  ASP  24           2HB      ASP  24  21.162   3.379 -19.554
  165    HB3  ASP  24           3HB      ASP  24  22.757   3.714 -18.885
  166    H    HIS  25           H        HIS  25  20.473   6.345 -21.163
  167    HA   HIS  25           HA       HIS  25  23.003   6.351 -22.637
  168    HB2  HIS  25           2HB      HIS  25  20.919   5.258 -23.582
  169    HB3  HIS  25           3HB      HIS  25  20.244   6.877 -23.745
  170    HD1  HIS  25           HD1      HIS  25  20.530   5.334 -26.278
  171    HD2  HIS  25           HD2      HIS  25  23.607   7.670 -24.748
  172    HE1  HIS  25           HE1      HIS  25  22.010   5.866 -28.240
  Start of MODEL    7
    1    H1   THR   1           H        THR   1   1.356   0.046   1.092
    2    HA   THR   1           HA       THR   1   2.485   0.926  -0.695
    3    HB   THR   1           HB       THR   1   3.543  -1.321  -1.974
    4    HG1  THR   1           HG1      THR   1   4.232  -2.406   0.142
    5   HG21  THR   1          3HG2      THR   1   5.321  -0.727   0.053
    6   HG22  THR   1          1HG2      THR   1   4.398   0.764  -0.129
    7   HG23  THR   1          2HG2      THR   1   5.236   0.071  -1.517
    8    H    GLY   2           H        GLY   2   0.413  -1.798  -1.496
    9    HA2  GLY   2           2HA      GLY   2   0.395  -1.555  -4.283
   10    HA3  GLY   2           3HA      GLY   2  -0.917  -2.215  -3.318
   11    H    ASN   3           H        ASN   3  -1.450   0.178  -1.830
   12    HA   ASN   3           HA       ASN   3  -2.898   1.640  -3.904
   13    HB2  ASN   3           2HB      ASN   3  -3.174   1.715  -0.890
   14    HB3  ASN   3           3HB      ASN   3  -4.205   2.575  -2.029
   15   HD21  ASN   3          1HD2      ASN   3  -5.914   1.562  -2.861
   16   HD22  ASN   3          2HD2      ASN   3  -6.282  -0.112  -2.636
   17    H    VAL   4           H        VAL   4  -0.030   1.897  -2.270
   18    HA   VAL   4           HA       VAL   4  -0.067   4.800  -2.015
   19    HB   VAL   4           HB       VAL   4   2.248   2.934  -1.496
   20   HG11  VAL   4          1HG1      VAL   4   3.350   4.857  -1.268
   21   HG12  VAL   4          2HG1      VAL   4   1.863   5.804  -1.356
   22   HG13  VAL   4          3HG1      VAL   4   2.391   5.130   0.187
   23   HG21  VAL   4          3HG2      VAL   4   0.906   2.116   0.125
   24   HG22  VAL   4          1HG2      VAL   4   1.366   3.598   0.964
   25   HG23  VAL   4          2HG2      VAL   4  -0.165   3.517   0.094
   26    H    GLY   5           H        GLY   5   0.641   2.500  -4.368
   27    HA2  GLY   5           2HA      GLY   5   2.511   4.324  -5.740
   28    HA3  GLY   5           3HA      GLY   5   2.400   2.596  -6.038
   29    H    LEU   6           H        LEU   6  -0.367   4.734  -5.711
   30    HA   LEU   6           HA       LEU   6  -1.286   3.923  -8.338
   31    HB2  LEU   6           2HB      LEU   6  -2.871   3.922  -6.516
   32    HB3  LEU   6           3HB      LEU   6  -2.548   5.624  -6.194
   33    HG   LEU   6           HG       LEU   6  -3.442   5.249  -8.911
   34   HD11  LEU   6          1HD1      LEU   6  -4.696   3.381  -8.326
   35   HD12  LEU   6          2HD1      LEU   6  -5.835   4.714  -8.141
   36   HD13  LEU   6          3HD1      LEU   6  -5.065   4.009  -6.720
   37   HD21  LEU   6          3HD2      LEU   6  -4.462   7.202  -8.490
   38   HD22  LEU   6          1HD2      LEU   6  -3.501   7.196  -7.011
   39   HD23  LEU   6          2HD2      LEU   6  -5.169   6.622  -6.980
   40    H    SER   7           H        SER   7  -1.450   7.121  -6.794
   41    HA   SER   7           HA       SER   7  -1.299   8.488  -9.277
   42    HB2  SER   7           2HB      SER   7  -2.320   9.912  -7.842
   43    HB3  SER   7           3HB      SER   7  -1.523   9.213  -6.433
   44    HG   SER   7           HG       SER   7  -0.527  11.160  -8.227
   45    HA   PRO   8           HA       PRO   8   3.192   9.618  -7.880
   46    HB2  PRO   8           2HB      PRO   8   4.229   8.214  -5.801
   47    HB3  PRO   8           3HB      PRO   8   3.331   9.722  -5.589
   48    HG2  PRO   8           2HG      PRO   8   2.391   6.898  -5.273
   49    HG3  PRO   8           3HG      PRO   8   2.067   8.306  -4.245
   50    HD2  PRO   8           2HD      PRO   8   0.279   7.384  -6.058
   51    HD3  PRO   8           3HD      PRO   8   0.417   9.105  -5.643
   52    H    GLY   9           H        GLY   9   1.847   6.577  -8.364
   53    HA2  GLY   9           2HA      GLY   9   4.446   5.436  -9.175
   54    HA3  GLY   9           3HA      GLY   9   3.039   4.484  -8.727
   55    H    LEU  10           H        LEU  10   1.285   6.353 -10.283
   56    HA   LEU  10           HA       LEU  10   1.465   4.940 -12.780
   57    HB2  LEU  10           2HB      LEU  10  -0.713   5.320 -11.941
   58    HB3  LEU  10           3HB      LEU  10  -0.400   7.039 -11.709
   59    HG   LEU  10           HG       LEU  10  -0.200   6.116 -14.492
   60   HD11  LEU  10          1HD1      LEU  10  -2.534   5.846 -14.866
   61   HD12  LEU  10          2HD1      LEU  10  -2.911   6.243 -13.190
   62   HD13  LEU  10          3HD1      LEU  10  -2.076   4.737 -13.572
   63   HD21  LEU  10          3HD2      LEU  10  -1.767   8.169 -14.662
   64   HD22  LEU  10          1HD2      LEU  10  -0.077   8.413 -14.220
   65   HD23  LEU  10          2HD2      LEU  10  -1.326   8.437 -12.975
   66    H    SER  11           H        SER  11   1.962   8.262 -11.683
   67    HA   SER  11           HA       SER  11   2.550   9.235 -14.326
   68    HB2  SER  11           2HB      SER  11   1.969  10.387 -11.793
   69    HB3  SER  11           3HB      SER  11   3.541  11.000 -12.303
   70    HG   SER  11           HG       SER  11   1.078  11.597 -13.249
   71    H    THR  12           H        THR  12   4.295   7.698 -11.819
   72    HA   THR  12           HA       THR  12   6.884   8.702 -12.661
   73    HB   THR  12           HB       THR  12   6.177   6.571 -10.635
   74    HG1  THR  12           HG1      THR  12   5.729   9.017 -10.365
   75   HG21  THR  12          3HG2      THR  12   8.563   7.084  -9.860
   76   HG22  THR  12          1HG2      THR  12   8.796   7.799 -11.454
   77   HG23  THR  12          2HG2      THR  12   8.378   6.092 -11.306
   78    H    ALA  13           H        ALA  13   4.805   6.042 -13.334
   79    HA   ALA  13           HA       ALA  13   6.949   4.432 -14.480
   80    HB1  ALA  13           1HB      ALA  13   4.770   3.020 -15.087
   81    HB2  ALA  13           2HB      ALA  13   5.542   2.946 -13.502
   82    HB3  ALA  13           3HB      ALA  13   4.121   3.962 -13.744
   83    H    LEU  14           H        LEU  14   4.196   6.379 -15.475
   84    HA   LEU  14           HA       LEU  14   4.366   5.650 -18.240
   85    HB2  LEU  14           2HB      LEU  14   2.644   7.221 -16.562
   86    HB3  LEU  14           3HB      LEU  14   3.061   8.125 -18.016
   87    HG   LEU  14           HG       LEU  14   0.958   6.915 -18.279
   88   HD11  LEU  14          1HD1      LEU  14   1.958   5.342 -20.231
   89   HD12  LEU  14          2HD1      LEU  14   3.325   6.421 -19.954
   90   HD13  LEU  14          3HD1      LEU  14   1.748   7.087 -20.377
   91   HD21  LEU  14          3HD2      LEU  14   0.747   4.940 -17.277
   92   HD22  LEU  14          1HD2      LEU  14   2.492   4.775 -17.084
   93   HD23  LEU  14          2HD2      LEU  14   1.719   4.260 -18.584
   94    H    THR  15           H        THR  15   6.178   7.664 -16.246
   95    HA   THR  15           HA       THR  15   6.985   9.437 -18.434
   96    HB   THR  15           HB       THR  15   7.682   9.524 -15.492
   97    HG1  THR  15           HG1      THR  15   6.017  10.834 -15.331
   98   HG21  THR  15          3HG2      THR  15   8.934  10.764 -17.760
   99   HG22  THR  15          1HG2      THR  15   9.368  10.869 -16.055
  100   HG23  THR  15          2HG2      THR  15   8.194  11.994 -16.737
  101    H    GLY  16           H        GLY  16   8.221   6.929 -16.299
  102    HA2  GLY  16           2HA      GLY  16  10.837   7.092 -17.639
  103    HA3  GLY  16           3HA      GLY  16  10.528   6.292 -16.105
  104    H    PHE  17           H        PHE  17   7.975   5.374 -17.811
  105    HA   PHE  17           HA       PHE  17   8.314   2.769 -18.023
  106    HB2  PHE  17           2HB      PHE  17   6.899   2.717 -20.034
  107    HB3  PHE  17           3HB      PHE  17   6.310   3.896 -18.866
  108    HD1  PHE  17           HD2      PHE  17   7.500   6.317 -19.239
  109    HD2  PHE  17           HD1      PHE  17   6.785   3.364 -22.220
  110    HE1  PHE  17           HE2      PHE  17   7.549   8.061 -20.973
  111    HE2  PHE  17           HE1      PHE  17   6.834   5.104 -23.959
  112    HZ   PHE  17           HZ       PHE  17   7.215   7.456 -23.337
  113    H    THR  18           H        THR  18   9.447   4.941 -20.612
  114    HA   THR  18           HA       THR  18  11.329   2.825 -21.433
  115    HB   THR  18           HB       THR  18  10.269   5.040 -23.192
  116    HG1  THR  18           HG1      THR  18   9.486   2.298 -23.125
  117   HG21  THR  18          3HG2      THR  18  11.863   2.540 -23.753
  118   HG22  THR  18          1HG2      THR  18  12.389   4.209 -23.960
  119   HG23  THR  18          2HG2      THR  18  11.130   3.547 -25.001
  120    H    LEU  19           H        LEU  19  11.016   5.955 -20.171
  121    HA   LEU  19           HA       LEU  19  13.543   6.956 -21.147
  122    HB2  LEU  19           2HB      LEU  19  11.380   7.962 -19.372
  123    HB3  LEU  19           3HB      LEU  19  12.981   8.682 -19.222
  124    HG   LEU  19           HG       LEU  19  11.623  10.044 -20.665
  125   HD11  LEU  19          1HD1      LEU  19  13.446  10.454 -21.852
  126   HD12  LEU  19          2HD1      LEU  19  13.105   9.063 -22.881
  127   HD13  LEU  19          3HD1      LEU  19  14.083   8.865 -21.427
  128   HD21  LEU  19          3HD2      LEU  19  11.366   7.873 -22.689
  129   HD22  LEU  19          1HD2      LEU  19  10.365   9.302 -22.433
  130   HD23  LEU  19          2HD2      LEU  19  10.229   7.924 -21.341
  131    H    VAL  20           H        VAL  20  12.520   4.930 -18.635
  132    HA   VAL  20           HA       VAL  20  14.549   5.591 -16.721
  133    HB   VAL  20           HB       VAL  20  12.605   3.320 -16.990
  134   HG11  VAL  20          1HG1      VAL  20  14.257   2.049 -16.067
  135   HG12  VAL  20          2HG1      VAL  20  15.068   3.434 -15.334
  136   HG13  VAL  20          3HG1      VAL  20  13.606   2.775 -14.598
  137   HG21  VAL  20          3HG2      VAL  20  12.773   4.773 -14.475
  138   HG22  VAL  20          1HG2      VAL  20  12.451   5.826 -15.853
  139   HG23  VAL  20          2HG2      VAL  20  11.381   4.465 -15.513
  140    HA   PRO  21           HA       PRO  21  16.594   1.552 -18.438
  141    HB2  PRO  21           2HB      PRO  21  15.637   0.596 -20.791
  142    HB3  PRO  21           3HB      PRO  21  14.997   0.098 -19.221
  143    HG2  PRO  21           2HG      PRO  21  13.919   2.116 -21.152
  144    HG3  PRO  21           3HG      PRO  21  13.050   0.881 -20.222
  145    HD2  PRO  21           2HD      PRO  21  13.130   3.482 -19.472
  146    HD3  PRO  21           3HD      PRO  21  13.046   2.152 -18.299
  147    H    VAL  22           H        VAL  22  15.540   4.153 -20.476
  148    HA   VAL  22           HA       VAL  22  17.933   3.927 -22.157
  149    HB   VAL  22           HB       VAL  22  15.581   5.800 -22.461
  150   HG11  VAL  22          1HG1      VAL  22  17.227   6.854 -23.649
  151   HG12  VAL  22          2HG1      VAL  22  18.092   5.355 -23.995
  152   HG13  VAL  22          3HG1      VAL  22  16.620   5.750 -24.883
  153   HG21  VAL  22          3HG2      VAL  22  16.187   3.298 -24.029
  154   HG22  VAL  22          1HG2      VAL  22  15.016   3.384 -22.713
  155   HG23  VAL  22          2HG2      VAL  22  14.770   4.337 -24.177
  156    H    GLU  23           H        GLU  23  16.822   5.524 -19.409
  157    HA   GLU  23           HA       GLU  23  17.906   8.085 -19.661
  158    HB2  GLU  23           2HB      GLU  23  16.622   7.952 -17.778
  159    HB3  GLU  23           3HB      GLU  23  17.149   6.317 -17.403
  160    HG2  GLU  23           2HG      GLU  23  17.939   7.803 -15.703
  161    HG3  GLU  23           3HG      GLU  23  19.314   7.227 -16.644
  162    H    ASP  24           H        ASP  24  19.434   5.026 -19.198
  163    HA   ASP  24           HA       ASP  24  21.903   6.054 -18.161
  164    HB2  ASP  24           2HB      ASP  24  21.106   3.376 -19.304
  165    HB3  ASP  24           3HB      ASP  24  22.742   3.727 -18.751
  166    H    HIS  25           H        HIS  25  20.485   6.248 -21.144
  167    HA   HIS  25           HA       HIS  25  23.098   6.457 -22.491
  168    HB2  HIS  25           2HB      HIS  25  21.435   4.619 -23.250
  169    HB3  HIS  25           3HB      HIS  25  20.529   5.948 -23.967
  170    HD1  HIS  25           HD1      HIS  25  22.668   7.616 -25.246
  171    HD2  HIS  25           HD2      HIS  25  22.725   3.463 -25.322
  172    HE1  HIS  25           HE1      HIS  25  24.102   7.000 -27.218
  Start of MODEL    8
    1    H1   THR   1           H        THR   1   2.406  -0.942  -0.338
    2    HA   THR   1           HA       THR   1   2.816   0.768  -2.284
    3    HB   THR   1           HB       THR   1   2.829  -2.051  -3.266
    4    HG1  THR   1           HG1      THR   1   4.357  -1.046  -1.086
    5   HG21  THR   1          3HG2      THR   1   3.841  -0.400  -4.676
    6   HG22  THR   1          1HG2      THR   1   5.137  -1.351  -3.951
    7   HG23  THR   1          2HG2      THR   1   4.770   0.258  -3.329
    8    H    GLY   2           H        GLY   2   0.155  -1.507  -2.302
    9    HA2  GLY   2           2HA      GLY   2  -0.626  -1.093  -5.008
   10    HA3  GLY   2           3HA      GLY   2  -1.622  -1.788  -3.737
   11    H    ASN   3           H        ASN   3  -1.272   0.611  -2.032
   12    HA   ASN   3           HA       ASN   3  -3.111   2.391  -3.492
   13    HB2  ASN   3           2HB      ASN   3  -2.952   1.733  -0.546
   14    HB3  ASN   3           3HB      ASN   3  -3.931   3.045  -1.194
   15   HD21  ASN   3          1HD2      ASN   3  -5.223   1.217   0.208
   16   HD22  ASN   3          2HD2      ASN   3  -6.146   0.168  -0.808
   17    H    VAL   4           H        VAL   4  -0.021   2.154  -2.330
   18    HA   VAL   4           HA       VAL   4   0.195   5.029  -1.754
   19    HB   VAL   4           HB       VAL   4   2.293   2.915  -1.267
   20   HG11  VAL   4          1HG1      VAL   4   2.759   4.911   0.500
   21   HG12  VAL   4          2HG1      VAL   4   3.529   4.788  -1.084
   22   HG13  VAL   4          3HG1      VAL   4   2.116   5.822  -0.866
   23   HG21  VAL   4          3HG2      VAL   4   0.790   2.183   0.266
   24   HG22  VAL   4          1HG2      VAL   4   1.454   3.524   1.200
   25   HG23  VAL   4          2HG2      VAL   4  -0.065   3.724   0.327
   26    H    GLY   5           H        GLY   5   0.704   2.772  -4.192
   27    HA2  GLY   5           2HA      GLY   5   2.678   4.543  -5.498
   28    HA3  GLY   5           3HA      GLY   5   2.632   2.804  -5.744
   29    H    LEU   6           H        LEU   6  -0.260   4.763  -5.568
   30    HA   LEU   6           HA       LEU   6  -1.004   3.892  -8.229
   31    HB2  LEU   6           2HB      LEU   6  -2.374   4.567  -5.868
   32    HB3  LEU   6           3HB      LEU   6  -2.847   5.762  -7.073
   33    HG   LEU   6           HG       LEU   6  -4.429   3.923  -7.014
   34   HD11  LEU   6          1HD1      LEU   6  -3.997   5.039  -9.149
   35   HD12  LEU   6          2HD1      LEU   6  -4.417   3.341  -9.374
   36   HD13  LEU   6          3HD1      LEU   6  -2.737   3.859  -9.508
   37   HD21  LEU   6          3HD2      LEU   6  -3.629   1.915  -6.461
   38   HD22  LEU   6          1HD2      LEU   6  -1.990   2.337  -6.959
   39   HD23  LEU   6          2HD2      LEU   6  -3.155   1.764  -8.153
   40    H    SER   7           H        SER   7  -1.235   7.080  -6.648
   41    HA   SER   7           HA       SER   7  -1.191   8.474  -9.127
   42    HB2  SER   7           2HB      SER   7  -0.467  10.253  -7.043
   43    HB3  SER   7           3HB      SER   7  -2.050  10.055  -7.795
   44    HG   SER   7           HG       SER   7  -2.718   9.021  -6.090
   45    HA   PRO   8           HA       PRO   8   3.305   9.688  -7.817
   46    HB2  PRO   8           2HB      PRO   8   4.418   8.284  -5.778
   47    HB3  PRO   8           3HB      PRO   8   3.493   9.770  -5.529
   48    HG2  PRO   8           2HG      PRO   8   2.621   6.922  -5.224
   49    HG3  PRO   8           3HG      PRO   8   2.290   8.312  -4.174
   50    HD2  PRO   8           2HD      PRO   8   0.483   7.371  -5.957
   51    HD3  PRO   8           3HD      PRO   8   0.593   9.090  -5.525
   52    H    GLY   9           H        GLY   9   2.017   6.618  -8.296
   53    HA2  GLY   9           2HA      GLY   9   4.621   5.544  -9.179
   54    HA3  GLY   9           3HA      GLY   9   3.244   4.558  -8.712
   55    H    LEU  10           H        LEU  10   1.405   6.382 -10.205
   56    HA   LEU  10           HA       LEU  10   1.565   5.007 -12.721
   57    HB2  LEU  10           2HB      LEU  10  -0.592   5.374 -11.742
   58    HB3  LEU  10           3HB      LEU  10  -0.313   7.113 -11.667
   59    HG   LEU  10           HG       LEU  10  -0.100   6.226 -14.384
   60   HD11  LEU  10          1HD1      LEU  10  -2.112   5.189 -14.818
   61   HD12  LEU  10          2HD1      LEU  10  -2.833   5.712 -13.295
   62   HD13  LEU  10          3HD1      LEU  10  -1.629   4.423 -13.304
   63   HD21  LEU  10          3HD2      LEU  10  -1.951   7.862 -14.657
   64   HD22  LEU  10          1HD2      LEU  10  -0.565   8.499 -13.771
   65   HD23  LEU  10          2HD2      LEU  10  -2.020   8.015 -12.900
   66    H    SER  11           H        SER  11   2.023   8.326 -11.599
   67    HA   SER  11           HA       SER  11   2.527   9.339 -14.245
   68    HB2  SER  11           2HB      SER  11   1.926  10.461 -11.730
   69    HB3  SER  11           3HB      SER  11   3.525  11.067 -12.163
   70    HG   SER  11           HG       SER  11   2.597  11.688 -14.200
   71    H    THR  12           H        THR  12   4.361   7.808 -11.801
   72    HA   THR  12           HA       THR  12   6.909   8.870 -12.702
   73    HB   THR  12           HB       THR  12   6.302   6.716 -10.666
   74    HG1  THR  12           HG1      THR  12   7.284   9.308 -10.109
   75   HG21  THR  12          3HG2      THR  12   8.768   7.647 -10.047
   76   HG22  THR  12          1HG2      THR  12   8.814   7.754 -11.807
   77   HG23  THR  12          2HG2      THR  12   8.475   6.209 -11.026
   78    H    ALA  13           H        ALA  13   4.857   6.189 -13.349
   79    HA   ALA  13           HA       ALA  13   7.003   4.614 -14.545
   80    HB1  ALA  13           1HB      ALA  13   4.902   3.122 -15.092
   81    HB2  ALA  13           2HB      ALA  13   5.613   3.145 -13.478
   82    HB3  ALA  13           3HB      ALA  13   4.165   4.094 -13.818
   83    H    LEU  14           H        LEU  14   4.193   6.516 -15.466
   84    HA   LEU  14           HA       LEU  14   4.318   5.803 -18.239
   85    HB2  LEU  14           2HB      LEU  14   2.592   7.319 -16.515
   86    HB3  LEU  14           3HB      LEU  14   2.957   8.244 -17.970
   87    HG   LEU  14           HG       LEU  14   0.879   6.980 -18.196
   88   HD11  LEU  14          1HD1      LEU  14   3.219   6.561 -19.929
   89   HD12  LEU  14          2HD1      LEU  14   1.621   7.201 -20.308
   90   HD13  LEU  14          3HD1      LEU  14   1.867   5.459 -20.190
   91   HD21  LEU  14          3HD2      LEU  14   0.743   4.988 -17.214
   92   HD22  LEU  14          1HD2      LEU  14   2.496   4.871 -17.058
   93   HD23  LEU  14          2HD2      LEU  14   1.707   4.351 -18.547
   94    H    THR  15           H        THR  15   6.122   7.849 -16.272
   95    HA   THR  15           HA       THR  15   6.836   9.655 -18.464
   96    HB   THR  15           HB       THR  15   7.616   9.742 -15.543
   97    HG1  THR  15           HG1      THR  15   6.030  11.220 -15.345
   98   HG21  THR  15          3HG2      THR  15   7.975  12.237 -16.819
   99   HG22  THR  15          1HG2      THR  15   8.764  11.025 -17.828
  100   HG23  THR  15          2HG2      THR  15   9.210  11.183 -16.129
  101    H    GLY  16           H        GLY  16   8.183   7.167 -16.373
  102    HA2  GLY  16           2HA      GLY  16  10.763   7.403 -17.769
  103    HA3  GLY  16           3HA      GLY  16  10.507   6.585 -16.235
  104    H    PHE  17           H        PHE  17   7.941   5.615 -17.889
  105    HA   PHE  17           HA       PHE  17   8.340   3.021 -18.130
  106    HB2  PHE  17           2HB      PHE  17   6.881   2.948 -20.108
  107    HB3  PHE  17           3HB      PHE  17   6.290   4.103 -18.919
  108    HD1  PHE  17           HD2      PHE  17   7.417   6.555 -19.302
  109    HD2  PHE  17           HD1      PHE  17   6.695   3.607 -22.285
  110    HE1  PHE  17           HE2      PHE  17   7.383   8.312 -21.025
  111    HE2  PHE  17           HE1      PHE  17   6.661   5.358 -24.013
  112    HZ   PHE  17           HZ       PHE  17   7.004   7.714 -23.384
  113    H    THR  18           H        THR  18   9.356   5.237 -20.729
  114    HA   THR  18           HA       THR  18  11.270   3.175 -21.610
  115    HB   THR  18           HB       THR  18  10.120   5.381 -23.324
  116    HG1  THR  18           HG1      THR  18   9.376   2.633 -23.134
  117   HG21  THR  18          3HG2      THR  18  12.245   4.602 -24.138
  118   HG22  THR  18          1HG2      THR  18  10.978   3.937 -25.167
  119   HG23  THR  18          2HG2      THR  18  11.751   2.920 -23.951
  120    H    LEU  19           H        LEU  19  10.913   6.288 -20.315
  121    HA   LEU  19           HA       LEU  19  13.393   7.356 -21.336
  122    HB2  LEU  19           2HB      LEU  19  11.247   8.294 -19.506
  123    HB3  LEU  19           3HB      LEU  19  12.834   9.049 -19.380
  124    HG   LEU  19           HG       LEU  19  11.419  10.396 -20.780
  125   HD11  LEU  19          1HD1      LEU  19  13.884   9.273 -21.610
  126   HD12  LEU  19          2HD1      LEU  19  13.210  10.855 -21.998
  127   HD13  LEU  19          3HD1      LEU  19  12.869   9.473 -23.039
  128   HD21  LEU  19          3HD2      LEU  19  10.059   8.249 -21.449
  129   HD22  LEU  19          1HD2      LEU  19  11.163   8.247 -22.825
  130   HD23  LEU  19          2HD2      LEU  19  10.134   9.647 -22.522
  131    H    VAL  20           H        VAL  20  12.476   5.281 -18.824
  132    HA   VAL  20           HA       VAL  20  14.538   5.972 -16.953
  133    HB   VAL  20           HB       VAL  20  12.629   3.668 -17.188
  134   HG11  VAL  20          1HG1      VAL  20  15.065   3.870 -15.459
  135   HG12  VAL  20          2HG1      VAL  20  13.637   2.993 -14.905
  136   HG13  VAL  20          3HG1      VAL  20  14.462   2.494 -16.382
  137   HG21  VAL  20          3HG2      VAL  20  12.571   6.180 -15.941
  138   HG22  VAL  20          1HG2      VAL  20  11.403   4.869 -15.777
  139   HG23  VAL  20          2HG2      VAL  20  12.750   4.997 -14.646
  140    HA   PRO  21           HA       PRO  21  16.616   1.984 -18.745
  141    HB2  PRO  21           2HB      PRO  21  15.614   1.017 -21.075
  142    HB3  PRO  21           3HB      PRO  21  15.027   0.500 -19.489
  143    HG2  PRO  21           2HG      PRO  21  13.857   2.502 -21.382
  144    HG3  PRO  21           3HG      PRO  21  13.038   1.247 -20.434
  145    HD2  PRO  21           2HD      PRO  21  13.086   3.847 -19.676
  146    HD3  PRO  21           3HD      PRO  21  13.061   2.511 -18.507
  147    H    VAL  22           H        VAL  22  15.463   4.579 -20.729
  148    HA   VAL  22           HA       VAL  22  17.830   4.414 -22.458
  149    HB   VAL  22           HB       VAL  22  15.416   6.203 -22.761
  150   HG11  VAL  22          1HG1      VAL  22  16.708   7.279 -24.220
  151   HG12  VAL  22          2HG1      VAL  22  17.981   6.064 -24.090
  152   HG13  VAL  22          3HG1      VAL  22  16.648   5.828 -25.220
  153   HG21  VAL  22          3HG2      VAL  22  16.058   3.670 -24.265
  154   HG22  VAL  22          1HG2      VAL  22  14.891   3.779 -22.947
  155   HG23  VAL  22          2HG2      VAL  22  14.622   4.679 -24.440
  156    H    GLU  23           H        GLU  23  16.677   6.001 -19.719
  157    HA   GLU  23           HA       GLU  23  17.562   8.605 -19.947
  158    HB2  GLU  23           2HB      GLU  23  16.590   8.434 -17.922
  159    HB3  GLU  23           3HB      GLU  23  17.034   6.741 -17.750
  160    HG2  GLU  23           2HG      GLU  23  18.063   8.010 -16.000
  161    HG3  GLU  23           3HG      GLU  23  19.310   7.436 -17.107
  162    H    ASP  24           H        ASP  24  19.414   5.682 -19.353
  163    HA   ASP  24           HA       ASP  24  21.883   7.289 -19.427
  164    HB2  ASP  24           2HB      ASP  24  21.330   4.637 -18.087
  165    HB3  ASP  24           3HB      ASP  24  22.945   5.317 -18.272
  166    H    HIS  25           H        HIS  25  19.981   5.249 -21.209
  167    HA   HIS  25           HA       HIS  25  22.262   4.479 -22.898
  168    HB2  HIS  25           2HB      HIS  25  19.899   2.775 -22.106
  169    HB3  HIS  25           3HB      HIS  25  20.942   2.389 -23.472
  170    HD1  HIS  25           HD1      HIS  25  21.511   3.230 -19.794
  171    HD2  HIS  25           HD2      HIS  25  22.835   0.620 -22.743
  172    HE1  HIS  25           HE1      HIS  25  23.212   1.755 -18.673
  Start of MODEL    9
    1    H1   THR   1           H        THR   1   2.215   0.698   0.241
    2    HA   THR   1           HA       THR   1   2.719   0.937  -2.003
    3    HB   THR   1           HB       THR   1   2.698  -2.071  -2.010
    4    HG1  THR   1           HG1      THR   1   4.573  -2.044  -0.805
    5   HG21  THR   1          3HG2      THR   1   5.013  -0.540  -2.978
    6   HG22  THR   1          1HG2      THR   1   3.521  -0.273  -3.879
    7   HG23  THR   1          2HG2      THR   1   4.169  -1.904  -3.711
    8    H    GLY   2           H        GLY   2   0.068  -1.257  -1.338
    9    HA2  GLY   2           2HA      GLY   2  -0.808  -1.682  -3.978
   10    HA3  GLY   2           3HA      GLY   2  -1.810  -1.801  -2.539
   11    H    ASN   3           H        ASN   3  -1.565   0.878  -1.658
   12    HA   ASN   3           HA       ASN   3  -3.008   2.282  -3.811
   13    HB2  ASN   3           2HB      ASN   3  -4.337   1.562  -1.748
   14    HB3  ASN   3           3HB      ASN   3  -3.413   2.772  -0.862
   15   HD21  ASN   3          1HD2      ASN   3  -5.476   2.356  -3.701
   16   HD22  ASN   3          2HD2      ASN   3  -6.193   3.926  -3.627
   17    H    VAL   4           H        VAL   4  -0.211   2.248  -2.045
   18    HA   VAL   4           HA       VAL   4   0.102   5.121  -1.786
   19    HB   VAL   4           HB       VAL   4   2.200   2.996  -1.356
   20   HG11  VAL   4          1HG1      VAL   4   1.956   5.891  -0.594
   21   HG12  VAL   4          2HG1      VAL   4   3.062   4.793   0.235
   22   HG13  VAL   4          3HG1      VAL   4   3.246   5.094  -1.494
   23   HG21  VAL   4          3HG2      VAL   4   0.447   2.389   0.101
   24   HG22  VAL   4          1HG2      VAL   4   1.581   3.313   1.086
   25   HG23  VAL   4          2HG2      VAL   4   0.096   4.069   0.507
   26    H    GLY   5           H        GLY   5   0.514   2.818  -4.207
   27    HA2  GLY   5           2HA      GLY   5   2.465   4.544  -5.604
   28    HA3  GLY   5           3HA      GLY   5   2.355   2.807  -5.845
   29    H    LEU   6           H        LEU   6  -0.348   5.063  -5.617
   30    HA   LEU   6           HA       LEU   6  -1.315   4.119  -8.189
   31    HB2  LEU   6           2HB      LEU   6  -2.461   5.356  -5.811
   32    HB3  LEU   6           3HB      LEU   6  -3.094   6.026  -7.313
   33    HG   LEU   6           HG       LEU   6  -4.462   4.185  -6.344
   34   HD11  LEU   6          1HD1      LEU   6  -4.262   4.811  -8.832
   35   HD12  LEU   6          2HD1      LEU   6  -5.013   3.273  -8.409
   36   HD13  LEU   6          3HD1      LEU   6  -3.345   3.311  -8.982
   37   HD21  LEU   6          3HD2      LEU   6  -2.247   2.933  -5.697
   38   HD22  LEU   6          1HD2      LEU   6  -2.426   2.236  -7.307
   39   HD23  LEU   6          2HD2      LEU   6  -3.706   2.033  -6.111
   40    H    SER   7           H        SER   7  -1.424   7.392  -6.811
   41    HA   SER   7           HA       SER   7  -1.235   8.625  -9.361
   42    HB2  SER   7           2HB      SER   7  -1.594   9.470  -6.599
   43    HB3  SER   7           3HB      SER   7  -0.546  10.572  -7.493
   44    HG   SER   7           HG       SER   7  -2.903   9.704  -8.717
   45    HA   PRO   8           HA       PRO   8   3.261   9.761  -7.986
   46    HB2  PRO   8           2HB      PRO   8   4.261   8.450  -5.830
   47    HB3  PRO   8           3HB      PRO   8   3.384   9.980  -5.703
   48    HG2  PRO   8           2HG      PRO   8   2.399   7.189  -5.251
   49    HG3  PRO   8           3HG      PRO   8   2.089   8.653  -4.299
   50    HD2  PRO   8           2HD      PRO   8   0.302   7.665  -6.077
   51    HD3  PRO   8           3HD      PRO   8   0.462   9.403  -5.749
   52    H    GLY   9           H        GLY   9   1.875   6.717  -8.321
   53    HA2  GLY   9           2HA      GLY   9   4.463   5.498  -9.052
   54    HA3  GLY   9           3HA      GLY   9   3.037   4.592  -8.569
   55    H    LEU  10           H        LEU  10   1.324   6.403 -10.234
   56    HA   LEU  10           HA       LEU  10   1.533   4.872 -12.665
   57    HB2  LEU  10           2HB      LEU  10  -0.647   5.328 -11.728
   58    HB3  LEU  10           3HB      LEU  10  -0.356   7.064 -11.822
   59    HG   LEU  10           HG       LEU  10  -0.109   6.495 -14.406
   60   HD11  LEU  10          1HD1      LEU  10  -1.735   4.255 -13.253
   61   HD12  LEU  10          2HD1      LEU  10  -0.417   4.183 -14.422
   62   HD13  LEU  10          3HD1      LEU  10  -1.987   4.826 -14.903
   63   HD21  LEU  10          3HD2      LEU  10  -2.553   7.004 -14.614
   64   HD22  LEU  10          1HD2      LEU  10  -1.649   8.120 -13.590
   65   HD23  LEU  10          2HD2      LEU  10  -2.665   6.878 -12.858
   66    H    SER  11           H        SER  11   2.087   8.198 -11.657
   67    HA   SER  11           HA       SER  11   2.645   9.094 -14.346
   68    HB2  SER  11           2HB      SER  11   1.958  10.346 -11.927
   69    HB3  SER  11           3HB      SER  11   3.594  10.894 -12.290
   70    HG   SER  11           HG       SER  11   2.897  11.869 -14.067
   71    H    THR  12           H        THR  12   4.379   7.654 -11.779
   72    HA   THR  12           HA       THR  12   6.969   8.649 -12.627
   73    HB   THR  12           HB       THR  12   6.238   6.586 -10.540
   74    HG1  THR  12           HG1      THR  12   7.323   9.149 -10.051
   75   HG21  THR  12          3HG2      THR  12   8.894   7.816 -11.271
   76   HG22  THR  12          1HG2      THR  12   8.456   6.109 -11.316
   77   HG23  THR  12          2HG2      THR  12   8.595   6.943  -9.768
   78    H    ALA  13           H        ALA  13   4.919   5.940 -13.221
   79    HA   ALA  13           HA       ALA  13   7.088   4.335 -14.328
   80    HB1  ALA  13           1HB      ALA  13   5.039   2.791 -14.842
   81    HB2  ALA  13           2HB      ALA  13   5.668   2.925 -13.199
   82    HB3  ALA  13           3HB      ALA  13   4.226   3.825 -13.667
   83    H    LEU  14           H        LEU  14   4.299   6.205 -15.358
   84    HA   LEU  14           HA       LEU  14   4.462   5.387 -18.102
   85    HB2  LEU  14           2HB      LEU  14   2.510   6.488 -16.617
   86    HB3  LEU  14           3HB      LEU  14   3.132   7.933 -17.412
   87    HG   LEU  14           HG       LEU  14   2.274   5.492 -18.947
   88   HD11  LEU  14          1HD1      LEU  14   0.259   7.230 -19.340
   89   HD12  LEU  14          2HD1      LEU  14   0.643   7.577 -17.655
   90   HD13  LEU  14          3HD1      LEU  14   0.218   5.937 -18.141
   91   HD21  LEU  14          3HD2      LEU  14   3.283   8.164 -19.582
   92   HD22  LEU  14          1HD2      LEU  14   1.832   7.708 -20.476
   93   HD23  LEU  14          2HD2      LEU  14   3.271   6.691 -20.554
   94    H    THR  15           H        THR  15   6.241   7.499 -16.186
   95    HA   THR  15           HA       THR  15   6.990   9.221 -18.435
   96    HB   THR  15           HB       THR  15   7.691   9.429 -15.500
   97    HG1  THR  15           HG1      THR  15   5.468   9.989 -16.527
   98   HG21  THR  15          3HG2      THR  15   9.344  10.790 -16.117
   99   HG22  THR  15          1HG2      THR  15   8.140  11.867 -16.824
  100   HG23  THR  15          2HG2      THR  15   8.903  10.624 -17.816
  101    H    GLY  16           H        GLY  16   8.282   6.800 -16.242
  102    HA2  GLY  16           2HA      GLY  16  10.896   6.993 -17.584
  103    HA3  GLY  16           3HA      GLY  16  10.609   6.233 -16.026
  104    H    PHE  17           H        PHE  17   8.076   5.193 -17.682
  105    HA   PHE  17           HA       PHE  17   8.489   2.593 -17.820
  106    HB2  PHE  17           2HB      PHE  17   7.064   2.446 -19.826
  107    HB3  PHE  17           3HB      PHE  17   6.443   3.620 -18.671
  108    HD1  PHE  17           HD1      PHE  17   7.521   6.079 -19.092
  109    HD2  PHE  17           HD2      PHE  17   6.924   3.051 -22.023
  110    HE1  PHE  17           HE1      PHE  17   7.489   7.796 -20.854
  111    HE2  PHE  17           HE2      PHE  17   6.892   4.763 -23.790
  112    HZ   PHE  17           HZ       PHE  17   7.176   7.138 -23.207
  113    H    THR  18           H        THR  18   9.516   4.708 -20.500
  114    HA   THR  18           HA       THR  18  11.456   2.627 -21.271
  115    HB   THR  18           HB       THR  18  10.318   4.756 -23.087
  116    HG1  THR  18           HG1      THR  18   8.979   3.106 -23.881
  117   HG21  THR  18          3HG2      THR  18  12.454   3.944 -23.843
  118   HG22  THR  18          1HG2      THR  18  11.197   3.239 -24.860
  119   HG23  THR  18          2HG2      THR  18  11.955   2.271 -23.594
  120    H    LEU  19           H        LEU  19  11.064   5.788 -20.109
  121    HA   LEU  19           HA       LEU  19  13.549   6.831 -21.143
  122    HB2  LEU  19           2HB      LEU  19  11.388   7.826 -19.356
  123    HB3  LEU  19           3HB      LEU  19  12.967   8.605 -19.279
  124    HG   LEU  19           HG       LEU  19  12.767   9.021 -21.752
  125   HD11  LEU  19          1HD1      LEU  19  11.135   8.040 -22.882
  126   HD12  LEU  19          2HD1      LEU  19   9.961   8.988 -21.970
  127   HD13  LEU  19          3HD1      LEU  19  10.447   7.395 -21.391
  128   HD21  LEU  19          3HD2      LEU  19  11.105  10.257 -19.630
  129   HD22  LEU  19          1HD2      LEU  19  10.782  10.729 -21.298
  130   HD23  LEU  19          2HD2      LEU  19  12.393  10.953 -20.616
  131    H    VAL  20           H        VAL  20  12.610   4.863 -18.549
  132    HA   VAL  20           HA       VAL  20  14.646   5.638 -16.688
  133    HB   VAL  20           HB       VAL  20  12.757   3.312 -16.859
  134   HG11  VAL  20          1HG1      VAL  20  13.798   2.825 -14.487
  135   HG12  VAL  20          2HG1      VAL  20  14.485   2.118 -15.950
  136   HG13  VAL  20          3HG1      VAL  20  15.232   3.540 -15.222
  137   HG21  VAL  20          3HG2      VAL  20  11.539   4.458 -15.373
  138   HG22  VAL  20          1HG2      VAL  20  12.951   4.850 -14.391
  139   HG23  VAL  20          2HG2      VAL  20  12.550   5.840 -15.795
  140    HA   PRO  21           HA       PRO  21  16.784   1.606 -18.302
  141    HB2  PRO  21           2HB      PRO  21  15.823   0.545 -20.609
  142    HB3  PRO  21           3HB      PRO  21  15.220   0.081 -19.014
  143    HG2  PRO  21           2HG      PRO  21  14.057   2.001 -20.994
  144    HG3  PRO  21           3HG      PRO  21  13.237   0.774 -20.011
  145    HD2  PRO  21           2HD      PRO  21  13.251   3.399 -19.349
  146    HD3  PRO  21           3HD      PRO  21  13.222   2.108 -18.132
  147    H    VAL  22           H        VAL  22  15.629   4.108 -20.407
  148    HA   VAL  22           HA       VAL  22  18.006   3.896 -22.111
  149    HB   VAL  22           HB       VAL  22  15.591   5.680 -22.450
  150   HG11  VAL  22          1HG1      VAL  22  16.519   5.751 -24.836
  151   HG12  VAL  22          2HG1      VAL  22  17.356   6.697 -23.604
  152   HG13  VAL  22          3HG1      VAL  22  18.020   5.151 -24.132
  153   HG21  VAL  22          3HG2      VAL  22  15.114   3.232 -22.616
  154   HG22  VAL  22          1HG2      VAL  22  14.806   4.135 -24.100
  155   HG23  VAL  22          2HG2      VAL  22  16.264   3.153 -23.952
  156    H    GLU  23           H        GLU  23  16.878   5.551 -19.407
  157    HA   GLU  23           HA       GLU  23  17.864   8.136 -19.754
  158    HB2  GLU  23           2HB      GLU  23  16.785   8.189 -17.787
  159    HB3  GLU  23           3HB      GLU  23  17.013   6.466 -17.525
  160    HG2  GLU  23           2HG      GLU  23  19.199   6.838 -16.606
  161    HG3  GLU  23           3HG      GLU  23  19.113   8.554 -16.999
  162    H    ASP  24           H        ASP  24  19.528   5.164 -19.354
  163    HA   ASP  24           HA       ASP  24  21.966   6.253 -18.318
  164    HB2  ASP  24           2HB      ASP  24  21.302   3.601 -19.604
  165    HB3  ASP  24           3HB      ASP  24  22.903   4.004 -18.990
  166    H    HIS  25           H        HIS  25  20.495   6.498 -21.280
  167    HA   HIS  25           HA       HIS  25  22.922   6.421 -22.874
  168    HB2  HIS  25           2HB      HIS  25  20.243   5.981 -23.442
  169    HB3  HIS  25           3HB      HIS  25  20.567   7.551 -24.173
  170    HD1  HIS  25           HD1      HIS  25  23.467   7.012 -25.137
  171    HD2  HIS  25           HD2      HIS  25  20.271   4.413 -25.677
  172    HE1  HIS  25           HE1      HIS  25  24.090   5.580 -27.109
  Start of MODEL   10
    1    H1   THR   1           H        THR   1   0.312   0.942   1.650
    2    HA   THR   1           HA       THR   1   1.528   1.729  -0.113
    3    HB   THR   1           HB       THR   1   2.896  -0.632  -0.953
    4    HG1  THR   1           HG1      THR   1   2.599  -0.350   1.870
    5   HG21  THR   1          3HG2      THR   1   3.468   1.951   0.328
    6   HG22  THR   1          1HG2      THR   1   4.305   1.129  -0.988
    7   HG23  THR   1          2HG2      THR   1   4.630   0.675   0.685
    8    H    GLY   2           H        GLY   2  -0.126  -1.313  -0.684
    9    HA2  GLY   2           2HA      GLY   2   0.066  -1.486  -3.454
   10    HA3  GLY   2           3HA      GLY   2  -1.287  -2.087  -2.507
   11    H    ASN   3           H        ASN   3  -1.953   0.588  -1.486
   12    HA   ASN   3           HA       ASN   3  -3.262   1.601  -3.916
   13    HB2  ASN   3           2HB      ASN   3  -4.046   1.847  -1.005
   14    HB3  ASN   3           3HB      ASN   3  -4.894   2.640  -2.328
   15   HD21  ASN   3          1HD2      ASN   3  -6.788   1.624  -2.389
   16   HD22  ASN   3          2HD2      ASN   3  -6.998  -0.082  -2.561
   17    H    VAL   4           H        VAL   4  -0.735   2.270  -1.888
   18    HA   VAL   4           HA       VAL   4  -1.029   5.174  -2.002
   19    HB   VAL   4           HB       VAL   4   1.247   3.602  -0.796
   20   HG11  VAL   4          1HG1      VAL   4   1.959   5.806  -1.068
   21   HG12  VAL   4          2HG1      VAL   4   0.370   6.467  -0.680
   22   HG13  VAL   4          3HG1      VAL   4   1.367   5.761   0.592
   23   HG21  VAL   4          3HG2      VAL   4  -0.352   4.635   1.250
   24   HG22  VAL   4          1HG2      VAL   4  -1.471   3.887   0.110
   25   HG23  VAL   4          2HG2      VAL   4  -0.154   2.940   0.802
   26    H    GLY   5           H        GLY   5   0.299   2.681  -3.834
   27    HA2  GLY   5           2HA      GLY   5   2.321   4.464  -5.025
   28    HA3  GLY   5           3HA      GLY   5   2.318   2.711  -5.157
   29    H    LEU   6           H        LEU   6  -0.657   4.439  -5.542
   30    HA   LEU   6           HA       LEU   6  -0.840   3.515  -8.283
   31    HB2  LEU   6           2HB      LEU   6  -2.732   3.284  -6.722
   32    HB3  LEU   6           3HB      LEU   6  -2.829   5.040  -6.607
   33    HG   LEU   6           HG       LEU   6  -3.019   4.000  -9.342
   34   HD11  LEU   6          1HD1      LEU   6  -4.806   3.015  -7.197
   35   HD12  LEU   6          2HD1      LEU   6  -4.331   2.258  -8.717
   36   HD13  LEU   6          3HD1      LEU   6  -5.557   3.525  -8.709
   37   HD21  LEU   6          3HD2      LEU   6  -4.126   5.914  -9.628
   38   HD22  LEU   6          1HD2      LEU   6  -3.627   6.323  -7.986
   39   HD23  LEU   6          2HD2      LEU   6  -5.205   5.588  -8.271
   40    H    SER   7           H        SER   7  -0.780   6.588  -6.534
   41    HA   SER   7           HA       SER   7  -0.957   8.128  -8.976
   42    HB2  SER   7           2HB      SER   7  -0.130   9.774  -6.818
   43    HB3  SER   7           3HB      SER   7  -1.732   9.669  -7.548
   44    HG   SER   7           HG       SER   7  -2.108   9.100  -5.501
   45    HA   PRO   8           HA       PRO   8   3.595   9.193  -7.752
   46    HB2  PRO   8           2HB      PRO   8   4.725   7.725  -5.767
   47    HB3  PRO   8           3HB      PRO   8   3.837   9.224  -5.468
   48    HG2  PRO   8           2HG      PRO   8   2.913   6.389  -5.199
   49    HG3  PRO   8           3HG      PRO   8   2.636   7.764  -4.114
   50    HD2  PRO   8           2HD      PRO   8   0.768   6.896  -5.872
   51    HD3  PRO   8           3HD      PRO   8   0.924   8.603  -5.409
   52    H    GLY   9           H        GLY   9   2.245   6.129  -8.205
   53    HA2  GLY   9           2HA      GLY   9   4.801   5.011  -9.159
   54    HA3  GLY   9           3HA      GLY   9   3.385   4.064  -8.729
   55    H    LEU  10           H        LEU  10   1.612   5.980 -10.168
   56    HA   LEU  10           HA       LEU  10   1.766   4.696 -12.736
   57    HB2  LEU  10           2HB      LEU  10  -0.392   5.044 -11.751
   58    HB3  LEU  10           3HB      LEU  10  -0.098   6.775 -11.608
   59    HG   LEU  10           HG       LEU  10   0.125   6.011 -14.355
   60   HD11  LEU  10          1HD1      LEU  10  -2.034   5.139 -14.819
   61   HD12  LEU  10          2HD1      LEU  10  -2.532   5.299 -13.135
   62   HD13  LEU  10          3HD1      LEU  10  -1.314   4.105 -13.584
   63   HD21  LEU  10          3HD2      LEU  10  -0.400   8.248 -13.415
   64   HD22  LEU  10          1HD2      LEU  10  -1.986   7.636 -12.945
   65   HD23  LEU  10          2HD2      LEU  10  -1.542   7.715 -14.650
   66    H    SER  11           H        SER  11   2.265   7.954 -11.471
   67    HA   SER  11           HA       SER  11   2.784   9.077 -14.070
   68    HB2  SER  11           2HB      SER  11   3.721  10.555 -11.692
   69    HB3  SER  11           3HB      SER  11   2.704  11.094 -13.028
   70    HG   SER  11           HG       SER  11   1.929  10.471 -10.610
   71    H    THR  12           H        THR  12   4.593   7.414 -11.696
   72    HA   THR  12           HA       THR  12   7.156   8.490 -12.523
   73    HB   THR  12           HB       THR  12   6.430   6.293 -10.581
   74    HG1  THR  12           HG1      THR  12   6.078   8.587 -10.034
   75   HG21  THR  12          3HG2      THR  12   8.836   6.404  -9.914
   76   HG22  THR  12          1HG2      THR  12   9.138   7.383 -11.349
   77   HG23  THR  12          2HG2      THR  12   8.568   5.722 -11.518
   78    H    ALA  13           H        ALA  13   5.092   5.838 -13.302
   79    HA   ALA  13           HA       ALA  13   7.225   4.340 -14.606
   80    HB1  ALA  13           1HB      ALA  13   5.803   2.853 -13.572
   81    HB2  ALA  13           2HB      ALA  13   4.361   3.790 -13.969
   82    HB3  ALA  13           3HB      ALA  13   5.176   2.852 -15.221
   83    H    LEU  14           H        LEU  14   4.421   6.302 -15.407
   84    HA   LEU  14           HA       LEU  14   4.532   5.752 -18.217
   85    HB2  LEU  14           2HB      LEU  14   2.842   7.216 -16.398
   86    HB3  LEU  14           3HB      LEU  14   3.186   8.172 -17.838
   87    HG   LEU  14           HG       LEU  14   1.105   6.957 -18.096
   88   HD11  LEU  14          1HD1      LEU  14   1.700   6.967 -20.235
   89   HD12  LEU  14          2HD1      LEU  14   2.274   5.315 -20.012
   90   HD13  LEU  14          3HD1      LEU  14   3.391   6.668 -19.832
   91   HD21  LEU  14          3HD2      LEU  14   2.741   4.726 -17.093
   92   HD22  LEU  14          1HD2      LEU  14   1.637   4.329 -18.410
   93   HD23  LEU  14          2HD2      LEU  14   1.013   5.039 -16.921
   94    H    THR  15           H        THR  15   6.367   7.661 -16.146
   95    HA   THR  15           HA       THR  15   7.085   9.588 -18.231
   96    HB   THR  15           HB       THR  15   7.868   9.489 -15.312
   97    HG1  THR  15           HG1      THR  15   6.219  10.809 -15.011
   98   HG21  THR  15          3HG2      THR  15   8.298  12.045 -16.416
   99   HG22  THR  15          1HG2      THR  15   9.042  10.891 -17.522
  100   HG23  THR  15          2HG2      THR  15   9.508  10.909 -15.821
  101    H    GLY  16           H        GLY  16   8.422   6.968 -16.299
  102    HA2  GLY  16           2HA      GLY  16  10.993   7.259 -17.704
  103    HA3  GLY  16           3HA      GLY  16  10.743   6.359 -16.215
  104    H    PHE  17           H        PHE  17   8.152   5.506 -17.895
  105    HA   PHE  17           HA       PHE  17   8.524   2.926 -18.283
  106    HB2  PHE  17           2HB      PHE  17   7.046   2.976 -20.248
  107    HB3  PHE  17           3HB      PHE  17   6.478   4.071 -18.991
  108    HD1  PHE  17           HD2      PHE  17   7.626   6.529 -19.250
  109    HD2  PHE  17           HD1      PHE  17   6.849   3.756 -22.384
  110    HE1  PHE  17           HE2      PHE  17   7.594   8.377 -20.874
  111    HE2  PHE  17           HE1      PHE  17   6.817   5.600 -24.013
  112    HZ   PHE  17           HZ       PHE  17   7.189   7.914 -23.258
  113    H    THR  18           H        THR  18   9.542   5.275 -20.763
  114    HA   THR  18           HA       THR  18  11.425   3.246 -21.776
  115    HB   THR  18           HB       THR  18  10.285   5.558 -23.351
  116    HG1  THR  18           HG1      THR  18   9.556   2.872 -23.786
  117   HG21  THR  18          3HG2      THR  18  11.109   4.204 -25.281
  118   HG22  THR  18          1HG2      THR  18  11.889   3.122 -24.128
  119   HG23  THR  18          2HG2      THR  18  12.392   4.809 -24.233
  120    H    LEU  19           H        LEU  19  11.115   6.280 -20.298
  121    HA   LEU  19           HA       LEU  19  13.597   7.381 -21.281
  122    HB2  LEU  19           2HB      LEU  19  11.477   8.231 -19.379
  123    HB3  LEU  19           3HB      LEU  19  13.074   8.959 -19.220
  124    HG   LEU  19           HG       LEU  19  11.668  10.406 -20.525
  125   HD11  LEU  19          1HD1      LEU  19  13.449  10.914 -21.738
  126   HD12  LEU  19          2HD1      LEU  19  13.086   9.592 -22.848
  127   HD13  LEU  19          3HD1      LEU  19  14.111   9.306 -21.441
  128   HD21  LEU  19          3HD2      LEU  19  11.361   8.386 -22.691
  129   HD22  LEU  19          1HD2      LEU  19  10.356   9.779 -22.294
  130   HD23  LEU  19          2HD2      LEU  19  10.271   8.321 -21.306
  131    H    VAL  20           H        VAL  20  12.681   5.173 -18.883
  132    HA   VAL  20           HA       VAL  20  14.761   5.731 -16.992
  133    HB   VAL  20           HB       VAL  20  12.859   3.436 -17.366
  134   HG11  VAL  20          1HG1      VAL  20  14.584   2.169 -16.567
  135   HG12  VAL  20          2HG1      VAL  20  15.343   3.526 -15.733
  136   HG13  VAL  20          3HG1      VAL  20  13.914   2.754 -15.045
  137   HG21  VAL  20          3HG2      VAL  20  12.815   5.877 -15.945
  138   HG22  VAL  20          1HG2      VAL  20  11.609   4.590 -15.940
  139   HG23  VAL  20          2HG2      VAL  20  12.914   4.581 -14.753
  140    HA   PRO  21           HA       PRO  21  16.818   1.863 -19.053
  141    HB2  PRO  21           2HB      PRO  21  15.801   1.055 -21.437
  142    HB3  PRO  21           3HB      PRO  21  15.221   0.436 -19.886
  143    HG2  PRO  21           2HG      PRO  21  14.047   2.562 -21.636
  144    HG3  PRO  21           3HG      PRO  21  13.229   1.249 -20.768
  145    HD2  PRO  21           2HD      PRO  21  13.289   3.792 -19.841
  146    HD3  PRO  21           3HD      PRO  21  13.266   2.383 -18.762
  147    H    VAL  22           H        VAL  22  15.645   4.569 -20.885
  148    HA   VAL  22           HA       VAL  22  17.990   4.510 -22.643
  149    HB   VAL  22           HB       VAL  22  15.600   6.355 -22.750
  150   HG11  VAL  22          1HG1      VAL  22  18.049   6.024 -24.418
  151   HG12  VAL  22          2HG1      VAL  22  16.538   6.508 -25.192
  152   HG13  VAL  22          3HG1      VAL  22  17.226   7.497 -23.903
  153   HG21  VAL  22          3HG2      VAL  22  15.065   3.946 -23.137
  154   HG22  VAL  22          1HG2      VAL  22  14.749   4.990 -24.523
  155   HG23  VAL  22          2HG2      VAL  22  16.186   3.969 -24.498
  156    H    GLU  23           H        GLU  23  16.934   5.896 -19.762
  157    HA   GLU  23           HA       GLU  23  17.954   8.490 -19.867
  158    HB2  GLU  23           2HB      GLU  23  16.904   8.362 -17.888
  159    HB3  GLU  23           3HB      GLU  23  17.109   6.619 -17.802
  160    HG2  GLU  23           2HG      GLU  23  19.312   6.866 -16.884
  161    HG3  GLU  23           3HG      GLU  23  19.250   8.613 -17.106
  162    H    ASP  24           H        ASP  24  19.575   5.468 -19.786
  163    HA   ASP  24           HA       ASP  24  22.114   6.744 -19.046
  164    HB2  ASP  24           2HB      ASP  24  21.291   3.841 -19.195
  165    HB3  ASP  24           3HB      ASP  24  22.951   4.364 -18.921
  166    H    HIS  25           H        HIS  25  20.349   5.985 -21.740
  167    HA   HIS  25           HA       HIS  25  22.753   5.557 -23.386
  168    HB2  HIS  25           2HB      HIS  25  20.392   4.111 -23.343
  169    HB3  HIS  25           3HB      HIS  25  20.193   5.168 -24.738
  170    HD1  HIS  25           HD1      HIS  25  22.975   5.180 -25.922
  171    HD2  HIS  25           HD2      HIS  25  21.161   1.754 -24.427
  172    HE1  HIS  25           HE1      HIS  25  24.134   3.257 -27.054
  Start of MODEL   11
    1    H1   THR   1           H        THR   1   1.260  -1.333   0.159
    2    HA   THR   1           HA       THR   1   2.133   1.323  -0.778
    3    HB   THR   1           HB       THR   1   3.674  -0.903  -1.849
    4    HG1  THR   1           HG1      THR   1   4.776  -1.225   0.227
    5   HG21  THR   1          3HG2      THR   1   5.517   0.510  -1.366
    6   HG22  THR   1          1HG2      THR   1   4.600   1.417  -0.164
    7   HG23  THR   1          2HG2      THR   1   4.207   1.574  -1.877
    8    H    GLY   2           H        GLY   2   0.934  -1.855  -1.724
    9    HA2  GLY   2           2HA      GLY   2   0.979  -1.557  -4.498
   10    HA3  GLY   2           3HA      GLY   2  -0.158  -2.563  -3.613
   11    H    ASN   3           H        ASN   3  -1.058  -0.047  -2.156
   12    HA   ASN   3           HA       ASN   3  -2.730   1.026  -4.333
   13    HB2  ASN   3           2HB      ASN   3  -3.834  -0.480  -2.547
   14    HB3  ASN   3           3HB      ASN   3  -3.625   0.891  -1.462
   15   HD21  ASN   3          1HD2      ASN   3  -5.332  -0.381  -4.177
   16   HD22  ASN   3          2HD2      ASN   3  -6.512   0.875  -4.293
   17    H    VAL   4           H        VAL   4  -0.344   1.748  -2.156
   18    HA   VAL   4           HA       VAL   4  -1.221   4.489  -1.657
   19    HB   VAL   4           HB       VAL   4   1.356   3.192  -0.771
   20   HG11  VAL   4          1HG1      VAL   4   0.802   5.038   1.089
   21   HG12  VAL   4          2HG1      VAL   4   1.752   5.383  -0.358
   22   HG13  VAL   4          3HG1      VAL   4   0.038   5.797  -0.307
   23   HG21  VAL   4          3HG2      VAL   4   0.089   1.898   0.540
   24   HG22  VAL   4          1HG2      VAL   4  -0.269   3.369   1.445
   25   HG23  VAL   4          2HG2      VAL   4  -1.371   2.820   0.182
   26    H    GLY   5           H        GLY   5   0.533   2.766  -3.956
   27    HA2  GLY   5           2HA      GLY   5   2.004   5.198  -4.763
   28    HA3  GLY   5           3HA      GLY   5   2.551   3.563  -5.104
   29    H    LEU   6           H        LEU   6  -0.742   4.786  -5.442
   30    HA   LEU   6           HA       LEU   6  -0.836   3.829  -8.161
   31    HB2  LEU   6           2HB      LEU   6  -2.745   3.534  -6.679
   32    HB3  LEU   6           3HB      LEU   6  -2.886   5.281  -6.493
   33    HG   LEU   6           HG       LEU   6  -3.027   4.471  -9.276
   34   HD11  LEU   6          1HD1      LEU   6  -4.962   3.184  -9.289
   35   HD12  LEU   6          2HD1      LEU   6  -5.337   3.552  -7.606
   36   HD13  LEU   6          3HD1      LEU   6  -4.005   2.464  -7.994
   37   HD21  LEU   6          3HD2      LEU   6  -5.024   5.871  -7.505
   38   HD22  LEU   6          1HD2      LEU   6  -4.942   5.914  -9.266
   39   HD23  LEU   6          2HD2      LEU   6  -3.670   6.669  -8.306
   40    H    SER   7           H        SER   7  -0.821   6.945  -6.512
   41    HA   SER   7           HA       SER   7  -1.076   8.402  -9.006
   42    HB2  SER   7           2HB      SER   7  -0.322  10.154  -6.911
   43    HB3  SER   7           3HB      SER   7  -1.920   9.952  -7.628
   44    HG   SER   7           HG       SER   7  -1.676   9.579  -5.268
   45    HA   PRO   8           HA       PRO   8   3.426   9.678  -7.806
   46    HB2  PRO   8           2HB      PRO   8   4.593   8.347  -5.748
   47    HB3  PRO   8           3HB      PRO   8   3.649   9.823  -5.524
   48    HG2  PRO   8           2HG      PRO   8   2.828   6.972  -5.130
   49    HG3  PRO   8           3HG      PRO   8   2.491   8.384  -4.112
   50    HD2  PRO   8           2HD      PRO   8   0.671   7.367  -5.839
   51    HD3  PRO   8           3HD      PRO   8   0.760   9.098  -5.455
   52    H    GLY   9           H        GLY   9   2.186   6.566  -8.161
   53    HA2  GLY   9           2HA      GLY   9   4.792   5.503  -9.047
   54    HA3  GLY   9           3HA      GLY   9   3.420   4.517  -8.561
   55    H    LEU  10           H        LEU  10   1.574   6.306 -10.091
   56    HA   LEU  10           HA       LEU  10   1.755   4.887 -12.585
   57    HB2  LEU  10           2HB      LEU  10  -0.411   5.222 -11.625
   58    HB3  LEU  10           3HB      LEU  10  -0.163   6.965 -11.551
   59    HG   LEU  10           HG       LEU  10  -0.079   5.701 -14.232
   60   HD11  LEU  10          1HD1      LEU  10  -2.274   5.181 -14.413
   61   HD12  LEU  10          2HD1      LEU  10  -2.772   6.376 -13.216
   62   HD13  LEU  10          3HD1      LEU  10  -2.082   4.840 -12.693
   63   HD21  LEU  10          3HD2      LEU  10   0.103   8.224 -13.442
   64   HD22  LEU  10          1HD2      LEU  10  -1.655   8.115 -13.525
   65   HD23  LEU  10          2HD2      LEU  10  -0.682   7.775 -14.956
   66    H    SER  11           H        SER  11   2.117   8.240 -11.522
   67    HA   SER  11           HA       SER  11   2.612   9.224 -14.175
   68    HB2  SER  11           2HB      SER  11   1.721  10.897 -12.847
   69    HB3  SER  11           3HB      SER  11   2.634  10.398 -11.423
   70    HG   SER  11           HG       SER  11   3.583  12.249 -12.150
   71    H    THR  12           H        THR  12   4.484   7.768 -11.709
   72    HA   THR  12           HA       THR  12   7.008   8.861 -12.632
   73    HB   THR  12           HB       THR  12   6.414   6.738 -10.561
   74    HG1  THR  12           HG1      THR  12   7.437   9.340 -10.102
   75   HG21  THR  12          3HG2      THR  12   8.981   7.914 -11.564
   76   HG22  THR  12          1HG2      THR  12   8.585   6.230 -11.224
   77   HG23  THR  12          2HG2      THR  12   8.844   7.361  -9.895
   78    H    ALA  13           H        ALA  13   5.015   6.111 -13.217
   79    HA   ALA  13           HA       ALA  13   7.183   4.577 -14.419
   80    HB1  ALA  13           1HB      ALA  13   4.429   4.007 -13.540
   81    HB2  ALA  13           2HB      ALA  13   4.984   3.120 -14.960
   82    HB3  ALA  13           3HB      ALA  13   5.882   3.013 -13.446
   83    H    LEU  14           H        LEU  14   4.347   6.431 -15.346
   84    HA   LEU  14           HA       LEU  14   4.462   5.684 -18.112
   85    HB2  LEU  14           2HB      LEU  14   2.732   7.206 -16.395
   86    HB3  LEU  14           3HB      LEU  14   3.076   8.112 -17.867
   87    HG   LEU  14           HG       LEU  14   1.011   6.827 -18.065
   88   HD11  LEU  14          1HD1      LEU  14   2.062   5.251 -20.016
   89   HD12  LEU  14          2HD1      LEU  14   3.339   6.448 -19.802
   90   HD13  LEU  14          3HD1      LEU  14   1.699   6.968 -20.191
   91   HD21  LEU  14          3HD2      LEU  14   2.700   4.713 -16.971
   92   HD22  LEU  14          1HD2      LEU  14   1.749   4.206 -18.367
   93   HD23  LEU  14          2HD2      LEU  14   0.944   4.889 -16.954
   94    H    THR  15           H        THR  15   6.265   7.763 -16.184
   95    HA   THR  15           HA       THR  15   6.945   9.552 -18.402
   96    HB   THR  15           HB       THR  15   7.731   9.684 -15.484
   97    HG1  THR  15           HG1      THR  15   5.678  10.807 -17.023
   98   HG21  THR  15          3HG2      THR  15   8.081  12.162 -16.796
   99   HG22  THR  15          1HG2      THR  15   8.876  10.939 -17.786
  100   HG23  THR  15          2HG2      THR  15   9.319  11.124 -16.089
  101    H    GLY  16           H        GLY  16   8.329   7.106 -16.284
  102    HA2  GLY  16           2HA      GLY  16  10.900   7.352 -17.695
  103    HA3  GLY  16           3HA      GLY  16  10.658   6.545 -16.153
  104    H    PHE  17           H        PHE  17   8.095   5.530 -17.780
  105    HA   PHE  17           HA       PHE  17   8.520   2.940 -18.001
  106    HB2  PHE  17           2HB      PHE  17   7.053   2.834 -19.973
  107    HB3  PHE  17           3HB      PHE  17   6.455   3.992 -18.790
  108    HD1  PHE  17           HD2      PHE  17   7.548   6.454 -19.198
  109    HD2  PHE  17           HD1      PHE  17   6.856   3.472 -22.155
  110    HE1  PHE  17           HE2      PHE  17   7.486   8.195 -20.935
  111    HE2  PHE  17           HE1      PHE  17   6.795   5.208 -23.897
  112    HZ   PHE  17           HZ       PHE  17   7.109   7.574 -23.288
  113    H    THR  18           H        THR  18   9.502   5.143 -20.625
  114    HA   THR  18           HA       THR  18  11.434   3.092 -21.494
  115    HB   THR  18           HB       THR  18  10.241   5.265 -23.223
  116    HG1  THR  18           HG1      THR  18   8.761   3.812 -23.871
  117   HG21  THR  18          3HG2      THR  18  11.119   3.820 -25.058
  118   HG22  THR  18          1HG2      THR  18  11.923   2.835 -23.836
  119   HG23  THR  18          2HG2      THR  18  12.377   4.526 -24.044
  120    H    LEU  19           H        LEU  19  11.047   6.214 -20.229
  121    HA   LEU  19           HA       LEU  19  13.509   7.301 -21.275
  122    HB2  LEU  19           2HB      LEU  19  11.363   8.230 -19.438
  123    HB3  LEU  19           3HB      LEU  19  12.943   9.004 -19.329
  124    HG   LEU  19           HG       LEU  19  11.496  10.320 -20.731
  125   HD11  LEU  19          1HD1      LEU  19  13.981   9.246 -21.551
  126   HD12  LEU  19          2HD1      LEU  19  13.265  10.802 -21.973
  127   HD13  LEU  19          3HD1      LEU  19  12.962   9.389 -22.984
  128   HD21  LEU  19          3HD2      LEU  19  10.168   8.149 -21.381
  129   HD22  LEU  19          1HD2      LEU  19  11.270   8.149 -22.758
  130   HD23  LEU  19          2HD2      LEU  19  10.221   9.537 -22.468
  131    H    VAL  20           H        VAL  20  12.635   5.234 -18.742
  132    HA   VAL  20           HA       VAL  20  14.688   5.967 -16.881
  133    HB   VAL  20           HB       VAL  20  12.850   3.602 -17.114
  134   HG11  VAL  20          1HG1      VAL  20  14.638   2.459 -16.238
  135   HG12  VAL  20          2HG1      VAL  20  15.298   3.887 -15.437
  136   HG13  VAL  20          3HG1      VAL  20  13.886   3.070 -14.765
  137   HG21  VAL  20          3HG2      VAL  20  12.722   6.130 -15.864
  138   HG22  VAL  20          1HG2      VAL  20  11.558   4.809 -15.773
  139   HG23  VAL  20          2HG2      VAL  20  12.855   4.925 -14.584
  140    HA   PRO  21           HA       PRO  21  16.854   2.029 -18.681
  141    HB2  PRO  21           2HB      PRO  21  15.877   1.050 -21.017
  142    HB3  PRO  21           3HB      PRO  21  15.299   0.515 -19.435
  143    HG2  PRO  21           2HG      PRO  21  14.089   2.500 -21.321
  144    HG3  PRO  21           3HG      PRO  21  13.296   1.223 -20.380
  145    HD2  PRO  21           2HD      PRO  21  13.287   3.819 -19.611
  146    HD3  PRO  21           3HD      PRO  21  13.289   2.479 -18.447
  147    H    VAL  22           H        VAL  22  15.629   4.582 -20.691
  148    HA   VAL  22           HA       VAL  22  17.991   4.475 -22.423
  149    HB   VAL  22           HB       VAL  22  15.559   6.251 -22.662
  150   HG11  VAL  22          1HG1      VAL  22  18.036   5.885 -24.275
  151   HG12  VAL  22          2HG1      VAL  22  16.524   6.251 -25.108
  152   HG13  VAL  22          3HG1      VAL  22  17.149   7.359 -23.886
  153   HG21  VAL  22          3HG2      VAL  22  16.213   3.770 -24.245
  154   HG22  VAL  22          1HG2      VAL  22  15.076   3.816 -22.898
  155   HG23  VAL  22          2HG2      VAL  22  14.755   4.756 -24.355
  156    H    GLU  23           H        GLU  23  16.877   6.010 -19.642
  157    HA   GLU  23           HA       GLU  23  17.818   8.619 -19.891
  158    HB2  GLU  23           2HB      GLU  23  16.790   8.569 -17.898
  159    HB3  GLU  23           3HB      GLU  23  17.043   6.838 -17.724
  160    HG2  GLU  23           2HG      GLU  23  19.249   7.197 -16.841
  161    HG3  GLU  23           3HG      GLU  23  19.127   8.929 -17.143
  162    H    ASP  24           H        ASP  24  19.542   5.659 -19.633
  163    HA   ASP  24           HA       ASP  24  22.059   7.152 -19.278
  164    HB2  ASP  24           2HB      ASP  24  21.350   4.349 -18.399
  165    HB3  ASP  24           3HB      ASP  24  22.993   4.982 -18.399
  166    H    HIS  25           H        HIS  25  20.192   5.487 -21.447
  167    HA   HIS  25           HA       HIS  25  22.517   4.533 -22.977
  168    HB2  HIS  25           2HB      HIS  25  20.532   2.978 -22.355
  169    HB3  HIS  25           3HB      HIS  25  19.668   3.834 -23.628
  170    HD1  HIS  25           HD1      HIS  25  19.563   2.104 -25.425
  171    HD2  HIS  25           HD2      HIS  25  23.393   2.542 -23.875
  172    HE1  HIS  25           HE1      HIS  25  21.046   0.696 -26.888
  Start of MODEL   12
    1    H1   THR   1           H        THR   1   2.217   0.869   0.073
    2    HA   THR   1           HA       THR   1   2.950   2.129  -1.726
    3    HB   THR   1           HB       THR   1   4.276  -0.476  -2.471
    4    HG1  THR   1           HG1      THR   1   5.884   0.225  -0.896
    5   HG21  THR   1          3HG2      THR   1   6.185   1.131  -2.934
    6   HG22  THR   1          1HG2      THR   1   5.008   2.431  -2.758
    7   HG23  THR   1          2HG2      THR   1   4.807   1.227  -4.030
    8    H    GLY   2           H        GLY   2   1.775  -1.056  -2.743
    9    HA2  GLY   2           2HA      GLY   2   1.507  -0.388  -5.493
   10    HA3  GLY   2           3HA      GLY   2   0.751  -1.751  -4.681
   11    H    ASN   3           H        ASN   3  -0.509   0.135  -2.715
   12    HA   ASN   3           HA       ASN   3  -2.633   1.150  -4.488
   13    HB2  ASN   3           2HB      ASN   3  -2.823  -0.107  -1.748
   14    HB3  ASN   3           3HB      ASN   3  -4.154   0.773  -2.493
   15   HD21  ASN   3          1HD2      ASN   3  -2.596  -2.189  -2.196
   16   HD22  ASN   3          2HD2      ASN   3  -3.441  -3.044  -3.437
   17    H    VAL   4           H        VAL   4  -0.202   2.050  -2.431
   18    HA   VAL   4           HA       VAL   4  -1.606   4.453  -1.488
   19    HB   VAL   4           HB       VAL   4   1.132   3.497  -0.651
   20   HG11  VAL   4          1HG1      VAL   4   0.414   4.939   1.389
   21   HG12  VAL   4          2HG1      VAL   4   1.014   5.731  -0.069
   22   HG13  VAL   4          3HG1      VAL   4  -0.719   5.664   0.250
   23   HG21  VAL   4          3HG2      VAL   4  -1.525   3.032   0.704
   24   HG22  VAL   4          1HG2      VAL   4  -0.532   1.805  -0.084
   25   HG23  VAL   4          2HG2      VAL   4   0.056   2.618   1.366
   26    H    GLY   5           H        GLY   5   0.485   3.392  -3.903
   27    HA2  GLY   5           2HA      GLY   5   1.459   6.150  -4.339
   28    HA3  GLY   5           3HA      GLY   5   2.394   4.723  -4.762
   29    H    LEU   6           H        LEU   6  -1.058   5.281  -5.292
   30    HA   LEU   6           HA       LEU   6  -0.934   4.379  -7.973
   31    HB2  LEU   6           2HB      LEU   6  -2.967   4.112  -6.775
   32    HB3  LEU   6           3HB      LEU   6  -3.049   5.834  -6.407
   33    HG   LEU   6           HG       LEU   6  -3.432   6.275  -8.824
   34   HD11  LEU   6          1HD1      LEU   6  -4.013   4.448 -10.296
   35   HD12  LEU   6          2HD1      LEU   6  -3.714   3.279  -9.011
   36   HD13  LEU   6          3HD1      LEU   6  -2.378   4.219  -9.675
   37   HD21  LEU   6          3HD2      LEU   6  -5.222   5.756  -6.967
   38   HD22  LEU   6          1HD2      LEU   6  -5.529   4.341  -7.974
   39   HD23  LEU   6          2HD2      LEU   6  -5.693   5.960  -8.655
   40    H    SER   7           H        SER   7  -0.909   7.565  -6.490
   41    HA   SER   7           HA       SER   7  -1.063   8.926  -9.038
   42    HB2  SER   7           2HB      SER   7  -1.991  10.385  -7.574
   43    HB3  SER   7           3HB      SER   7  -1.140   9.690  -6.195
   44    HG   SER   7           HG       SER   7  -0.497  11.865  -6.737
   45    HA   PRO   8           HA       PRO   8   3.503  10.009  -7.881
   46    HB2  PRO   8           2HB      PRO   8   4.607   8.670  -5.794
   47    HB3  PRO   8           3HB      PRO   8   3.742  10.200  -5.604
   48    HG2  PRO   8           2HG      PRO   8   2.775   7.406  -5.137
   49    HG3  PRO   8           3HG      PRO   8   2.517   8.858  -4.153
   50    HD2  PRO   8           2HD      PRO   8   0.639   7.895  -5.849
   51    HD3  PRO   8           3HD      PRO   8   0.820   9.628  -5.509
   52    H    GLY   9           H        GLY   9   2.112   6.932  -8.097
   53    HA2  GLY   9           2HA      GLY   9   4.651   5.720  -8.979
   54    HA3  GLY   9           3HA      GLY   9   3.228   4.823  -8.469
   55    H    LEU  10           H        LEU  10   1.485   6.676 -10.049
   56    HA   LEU  10           HA       LEU  10   1.581   5.180 -12.502
   57    HB2  LEU  10           2HB      LEU  10  -0.571   5.629 -11.642
   58    HB3  LEU  10           3HB      LEU  10  -0.217   7.344 -11.449
   59    HG   LEU  10           HG       LEU  10   0.017   6.630 -14.213
   60   HD11  LEU  10          1HD1      LEU  10  -2.397   5.612 -12.773
   61   HD12  LEU  10          2HD1      LEU  10  -1.458   4.857 -14.061
   62   HD13  LEU  10          3HD1      LEU  10  -2.529   6.209 -14.428
   63   HD21  LEU  10          3HD2      LEU  10  -0.375   8.870 -13.567
   64   HD22  LEU  10          1HD2      LEU  10  -1.778   8.423 -12.597
   65   HD23  LEU  10          2HD2      LEU  10  -1.855   8.323 -14.356
   66    H    SER  11           H        SER  11   2.145   8.534 -11.534
   67    HA   SER  11           HA       SER  11   2.693   9.415 -14.211
   68    HB2  SER  11           2HB      SER  11   1.905  10.756 -12.046
   69    HB3  SER  11           3HB      SER  11   3.645  10.979 -11.858
   70    HG   SER  11           HG       SER  11   2.791  12.655 -13.099
   71    H    THR  12           H        THR  12   4.484   7.916 -11.707
   72    HA   THR  12           HA       THR  12   7.066   8.815 -12.676
   73    HB   THR  12           HB       THR  12   6.347   6.807 -10.532
   74    HG1  THR  12           HG1      THR  12   5.953   9.163 -10.222
   75   HG21  THR  12          3HG2      THR  12   8.951   7.661 -11.690
   76   HG22  THR  12          1HG2      THR  12   8.461   6.094 -11.049
   77   HG23  THR  12          2HG2      THR  12   8.862   7.410  -9.946
   78    H    ALA  13           H        ALA  13   4.895   6.189 -13.175
   79    HA   ALA  13           HA       ALA  13   6.953   4.476 -14.329
   80    HB1  ALA  13           1HB      ALA  13   4.134   4.121 -13.494
   81    HB2  ALA  13           2HB      ALA  13   4.718   3.109 -14.815
   82    HB3  ALA  13           3HB      ALA  13   5.532   3.073 -13.251
   83    H    LEU  14           H        LEU  14   4.243   6.484 -15.310
   84    HA   LEU  14           HA       LEU  14   4.295   5.646 -18.051
   85    HB2  LEU  14           2HB      LEU  14   2.684   7.340 -16.380
   86    HB3  LEU  14           3HB      LEU  14   3.086   8.174 -17.879
   87    HG   LEU  14           HG       LEU  14   0.933   7.030 -18.028
   88   HD11  LEU  14          1HD1      LEU  14   1.811   5.360 -19.957
   89   HD12  LEU  14          2HD1      LEU  14   3.223   6.397 -19.761
   90   HD13  LEU  14          3HD1      LEU  14   1.658   7.106 -20.155
   91   HD21  LEU  14          3HD2      LEU  14   2.432   4.882 -16.806
   92   HD22  LEU  14          1HD2      LEU  14   1.598   4.342 -18.264
   93   HD23  LEU  14          2HD2      LEU  14   0.687   5.097 -16.955
   94    H    THR  15           H        THR  15   6.242   7.663 -16.192
   95    HA   THR  15           HA       THR  15   7.039   9.325 -18.469
   96    HB   THR  15           HB       THR  15   7.837   9.493 -15.557
   97    HG1  THR  15           HG1      THR  15   5.656  10.147 -16.112
   98   HG21  THR  15          3HG2      THR  15   8.382  11.894 -16.929
   99   HG22  THR  15          1HG2      THR  15   9.065  10.592 -17.901
  100   HG23  THR  15          2HG2      THR  15   9.538  10.773 -16.212
  101    H    GLY  16           H        GLY  16   8.256   6.854 -16.280
  102    HA2  GLY  16           2HA      GLY  16  10.830   6.872 -17.707
  103    HA3  GLY  16           3HA      GLY  16  10.543   6.139 -16.135
  104    H    PHE  17           H        PHE  17   7.905   5.254 -17.722
  105    HA   PHE  17           HA       PHE  17   8.143   2.633 -17.850
  106    HB2  PHE  17           2HB      PHE  17   6.663   2.561 -19.813
  107    HB3  PHE  17           3HB      PHE  17   6.155   3.800 -18.671
  108    HD1  PHE  17           HD2      PHE  17   7.418   6.162 -19.169
  109    HD2  PHE  17           HD1      PHE  17   6.502   3.133 -22.016
  110    HE1  PHE  17           HE2      PHE  17   7.472   7.841 -20.967
  111    HE2  PHE  17           HE1      PHE  17   6.556   4.807 -23.819
  112    HZ   PHE  17           HZ       PHE  17   7.041   7.164 -23.296
  113    H    THR  18           H        THR  18   9.265   4.664 -20.555
  114    HA   THR  18           HA       THR  18  11.043   2.452 -21.353
  115    HB   THR  18           HB       THR  18  10.008   4.643 -23.158
  116    HG1  THR  18           HG1      THR  18   9.005   2.076 -22.542
  117   HG21  THR  18          3HG2      THR  18  12.062   3.722 -23.977
  118   HG22  THR  18          1HG2      THR  18  10.750   3.036 -24.935
  119   HG23  THR  18          2HG2      THR  18  11.511   2.076 -23.665
  120    H    LEU  19           H        LEU  19  10.889   5.631 -20.193
  121    HA   LEU  19           HA       LEU  19  13.417   6.503 -21.283
  122    HB2  LEU  19           2HB      LEU  19  11.350   7.648 -19.479
  123    HB3  LEU  19           3HB      LEU  19  12.982   8.311 -19.400
  124    HG   LEU  19           HG       LEU  19  11.637   9.679 -20.847
  125   HD11  LEU  19          1HD1      LEU  19  14.018   8.374 -21.647
  126   HD12  LEU  19          2HD1      LEU  19  13.433   9.972 -22.107
  127   HD13  LEU  19          3HD1      LEU  19  13.000   8.562 -23.074
  128   HD21  LEU  19          3HD2      LEU  19  10.281   8.934 -22.535
  129   HD22  LEU  19          1HD2      LEU  19  10.142   7.587 -21.405
  130   HD23  LEU  19          2HD2      LEU  19  11.222   7.464 -22.794
  131    H    VAL  20           H        VAL  20  12.406   4.598 -18.675
  132    HA   VAL  20           HA       VAL  20  14.515   5.246 -16.846
  133    HB   VAL  20           HB       VAL  20  12.506   3.018 -16.988
  134   HG11  VAL  20          1HG1      VAL  20  13.518   2.500 -14.621
  135   HG12  VAL  20          2HG1      VAL  20  14.204   1.773 -16.075
  136   HG13  VAL  20          3HG1      VAL  20  14.981   3.174 -15.337
  137   HG21  VAL  20          3HG2      VAL  20  12.629   4.428 -14.507
  138   HG22  VAL  20          1HG2      VAL  20  12.572   5.590 -15.833
  139   HG23  VAL  20          2HG2      VAL  20  11.315   4.363 -15.681
  140    HA   PRO  21           HA       PRO  21  16.379   1.096 -18.501
  141    HB2  PRO  21           2HB      PRO  21  15.322   0.105 -20.797
  142    HB3  PRO  21           3HB      PRO  21  14.714  -0.327 -19.194
  143    HG2  PRO  21           2HG      PRO  21  13.643   1.668 -21.151
  144    HG3  PRO  21           3HG      PRO  21  12.763   0.489 -20.161
  145    HD2  PRO  21           2HD      PRO  21  12.947   3.106 -19.491
  146    HD3  PRO  21           3HD      PRO  21  12.857   1.814 -18.277
  147    H    VAL  22           H        VAL  22  15.335   3.656 -20.602
  148    HA   VAL  22           HA       VAL  22  17.672   3.311 -22.337
  149    HB   VAL  22           HB       VAL  22  15.376   5.253 -22.631
  150   HG11  VAL  22          1HG1      VAL  22  16.509   4.816 -25.106
  151   HG12  VAL  22          2HG1      VAL  22  16.760   6.233 -24.084
  152   HG13  VAL  22          3HG1      VAL  22  17.902   4.890 -24.028
  153   HG21  VAL  22          3HG2      VAL  22  14.715   2.851 -22.780
  154   HG22  VAL  22          1HG2      VAL  22  14.457   3.763 -24.267
  155   HG23  VAL  22          2HG2      VAL  22  15.838   2.676 -24.128
  156    H    GLU  23           H        GLU  23  16.693   5.024 -19.609
  157    HA   GLU  23           HA       GLU  23  17.837   7.543 -19.966
  158    HB2  GLU  23           2HB      GLU  23  16.794   7.660 -17.983
  159    HB3  GLU  23           3HB      GLU  23  16.910   5.925 -17.729
  160    HG2  GLU  23           2HG      GLU  23  19.130   6.149 -16.841
  161    HG3  GLU  23           3HG      GLU  23  19.151   7.869 -17.227
  162    H    ASP  24           H        ASP  24  19.312   4.469 -19.596
  163    HA   ASP  24           HA       ASP  24  21.830   5.396 -18.593
  164    HB2  ASP  24           2HB      ASP  24  20.882   3.035 -18.384
  165    HB3  ASP  24           3HB      ASP  24  21.352   2.808 -20.066
  166    H    HIS  25           H        HIS  25  20.335   5.742 -21.533
  167    HA   HIS  25           HA       HIS  25  21.017   6.355 -23.615
  168    HB2  HIS  25           2HB      HIS  25  23.275   7.253 -21.869
  169    HB3  HIS  25           3HB      HIS  25  23.448   7.368 -23.618
  170    HD1  HIS  25           HD1      HIS  25  21.636   8.864 -20.726
  171    HD2  HIS  25           HD2      HIS  25  21.801   9.287 -24.856
  172    HE1  HIS  25           HE1      HIS  25  20.431  11.013 -21.231
  Start of MODEL   13
    1    H1   THR   1           H        THR   1   1.357   0.296  -0.579
    2    HA   THR   1           HA       THR   1   2.856   2.048  -1.641
    3    HB   THR   1           HB       THR   1   4.602  -0.245  -2.425
    4    HG1  THR   1           HG1      THR   1   5.284  -0.466  -0.442
    5   HG21  THR   1          3HG2      THR   1   4.602   2.656  -2.592
    6   HG22  THR   1          1HG2      THR   1   5.534   1.475  -3.510
    7   HG23  THR   1          2HG2      THR   1   6.113   2.025  -1.938
    8    H    GLY   2           H        GLY   2   1.979  -1.275  -2.379
    9    HA2  GLY   2           2HA      GLY   2   1.881  -1.022  -5.193
   10    HA3  GLY   2           3HA      GLY   2   1.038  -2.235  -4.241
   11    H    ASN   3           H        ASN   3  -0.416  -0.222  -2.674
   12    HA   ASN   3           HA       ASN   3  -2.286   0.698  -4.758
   13    HB2  ASN   3           2HB      ASN   3  -2.905  -0.368  -1.996
   14    HB3  ASN   3           3HB      ASN   3  -4.096   0.354  -3.073
   15   HD21  ASN   3          1HD2      ASN   3  -5.170  -0.965  -4.352
   16   HD22  ASN   3          2HD2      ASN   3  -4.700  -2.572  -4.777
   17    H    VAL   4           H        VAL   4  -0.156   1.673  -2.421
   18    HA   VAL   4           HA       VAL   4  -1.672   4.058  -1.657
   19    HB   VAL   4           HB       VAL   4   1.078   3.248  -0.713
   20   HG11  VAL   4          1HG1      VAL   4  -0.623   5.537  -0.274
   21   HG12  VAL   4          2HG1      VAL   4  -0.265   4.709   1.243
   22   HG13  VAL   4          3HG1      VAL   4   1.051   5.271   0.211
   23   HG21  VAL   4          3HG2      VAL   4  -1.638   2.435   0.223
   24   HG22  VAL   4          1HG2      VAL   4  -0.169   1.473   0.063
   25   HG23  VAL   4          2HG2      VAL   4  -0.331   2.618   1.393
   26    H    GLY   5           H        GLY   5   0.550   3.057  -3.981
   27    HA2  GLY   5           2HA      GLY   5   1.462   5.837  -4.402
   28    HA3  GLY   5           3HA      GLY   5   2.401   4.422  -4.854
   29    H    LEU   6           H        LEU   6  -1.059   4.884  -5.360
   30    HA   LEU   6           HA       LEU   6  -0.908   4.084  -8.071
   31    HB2  LEU   6           2HB      LEU   6  -2.910   3.735  -6.763
   32    HB3  LEU   6           3HB      LEU   6  -3.102   5.473  -6.540
   33    HG   LEU   6           HG       LEU   6  -3.049   4.710  -9.347
   34   HD11  LEU   6          1HD1      LEU   6  -5.431   3.749  -7.797
   35   HD12  LEU   6          2HD1      LEU   6  -4.089   2.679  -8.205
   36   HD13  LEU   6          3HD1      LEU   6  -5.019   3.457  -9.487
   37   HD21  LEU   6          3HD2      LEU   6  -3.784   6.884  -8.234
   38   HD22  LEU   6          1HD2      LEU   6  -5.261   6.024  -7.799
   39   HD23  LEU   6          2HD2      LEU   6  -4.828   6.231  -9.496
   40    H    SER   7           H        SER   7  -0.886   7.196  -6.473
   41    HA   SER   7           HA       SER   7  -1.144   8.644  -8.977
   42    HB2  SER   7           2HB      SER   7  -0.376  10.398  -6.886
   43    HB3  SER   7           3HB      SER   7  -1.972  10.214  -7.614
   44    HG   SER   7           HG       SER   7  -2.327   9.729  -5.537
   45    HA   PRO   8           HA       PRO   8   3.367   9.883  -7.774
   46    HB2  PRO   8           2HB      PRO   8   4.514   8.560  -5.700
   47    HB3  PRO   8           3HB      PRO   8   3.583  10.048  -5.493
   48    HG2  PRO   8           2HG      PRO   8   2.733   7.208  -5.075
   49    HG3  PRO   8           3HG      PRO   8   2.407   8.633  -4.071
   50    HD2  PRO   8           2HD      PRO   8   0.583   7.618  -5.795
   51    HD3  PRO   8           3HD      PRO   8   0.688   9.351  -5.427
   52    H    GLY   9           H        GLY   9   2.102   6.770  -8.084
   53    HA2  GLY   9           2HA      GLY   9   4.698   5.678  -8.960
   54    HA3  GLY   9           3HA      GLY   9   3.318   4.710  -8.465
   55    H    LEU  10           H        LEU  10   1.500   6.518 -10.023
   56    HA   LEU  10           HA       LEU  10   1.667   5.062 -12.499
   57    HB2  LEU  10           2HB      LEU  10  -0.494   5.443 -11.527
   58    HB3  LEU  10           3HB      LEU  10  -0.228   7.185 -11.512
   59    HG   LEU  10           HG       LEU  10  -0.044   6.066 -14.188
   60   HD11  LEU  10          1HD1      LEU  10  -2.148   5.206 -14.502
   61   HD12  LEU  10          2HD1      LEU  10  -2.808   6.003 -13.074
   62   HD13  LEU  10          3HD1      LEU  10  -1.769   4.589 -12.893
   63   HD21  LEU  10          3HD2      LEU  10  -1.501   8.280 -12.794
   64   HD22  LEU  10          1HD2      LEU  10  -1.884   7.853 -14.461
   65   HD23  LEU  10          2HD2      LEU  10  -0.253   8.375 -14.037
   66    H    SER  11           H        SER  11   2.085   8.416 -11.465
   67    HA   SER  11           HA       SER  11   2.590   9.367 -14.131
   68    HB2  SER  11           2HB      SER  11   1.612  10.913 -12.569
   69    HB3  SER  11           3HB      SER  11   2.920  10.655 -11.414
   70    HG   SER  11           HG       SER  11   3.277  11.739 -14.012
   71    H    THR  12           H        THR  12   4.437   7.917 -11.642
   72    HA   THR  12           HA       THR  12   6.976   8.970 -12.570
   73    HB   THR  12           HB       THR  12   6.352   6.881 -10.475
   74    HG1  THR  12           HG1      THR  12   7.233   9.583 -10.226
   75   HG21  THR  12          3HG2      THR  12   8.548   6.450 -11.363
   76   HG22  THR  12          1HG2      THR  12   8.724   7.226  -9.790
   77   HG23  THR  12          2HG2      THR  12   8.970   8.159 -11.266
   78    H    ALA  13           H        ALA  13   4.950   6.244 -13.138
   79    HA   ALA  13           HA       ALA  13   7.104   4.666 -14.309
   80    HB1  ALA  13           1HB      ALA  13   5.662   3.291 -13.119
   81    HB2  ALA  13           2HB      ALA  13   4.223   4.131 -13.697
   82    HB3  ALA  13           3HB      ALA  13   5.126   3.079 -14.786
   83    H    LEU  14           H        LEU  14   4.291   6.538 -15.271
   84    HA   LEU  14           HA       LEU  14   4.407   5.759 -18.026
   85    HB2  LEU  14           2HB      LEU  14   2.698   7.337 -16.334
   86    HB3  LEU  14           3HB      LEU  14   3.055   8.207 -17.824
   87    HG   LEU  14           HG       LEU  14   0.981   6.972 -18.033
   88   HD11  LEU  14          1HD1      LEU  14   1.601   6.856 -20.162
   89   HD12  LEU  14          2HD1      LEU  14   2.176   5.221 -19.833
   90   HD13  LEU  14          3HD1      LEU  14   3.288   6.585 -19.723
   91   HD21  LEU  14          3HD2      LEU  14   2.613   4.808 -16.883
   92   HD22  LEU  14          1HD2      LEU  14   1.519   4.332 -18.182
   93   HD23  LEU  14          2HD2      LEU  14   0.883   5.129 -16.742
   94    H    THR  15           H        THR  15   6.224   7.848 -16.114
   95    HA   THR  15           HA       THR  15   6.941   9.595 -18.353
   96    HB   THR  15           HB       THR  15   7.715   9.748 -15.434
   97    HG1  THR  15           HG1      THR  15   6.202  11.355 -15.330
   98   HG21  THR  15          3HG2      THR  15   9.342  11.137 -16.054
   99   HG22  THR  15          1HG2      THR  15   8.128  12.205 -16.754
  100   HG23  THR  15          2HG2      THR  15   8.888  10.963 -17.749
  101    H    GLY  16           H        GLY  16   8.282   7.151 -16.207
  102    HA2  GLY  16           2HA      GLY  16  10.858   7.341 -17.618
  103    HA3  GLY  16           3HA      GLY  16  10.605   6.564 -16.062
  104    H    PHE  17           H        PHE  17   8.028   5.564 -17.682
  105    HA   PHE  17           HA       PHE  17   8.412   2.962 -17.856
  106    HB2  PHE  17           2HB      PHE  17   6.948   2.846 -19.829
  107    HB3  PHE  17           3HB      PHE  17   6.366   4.034 -18.668
  108    HD1  PHE  17           HD2      PHE  17   7.500   6.471 -19.116
  109    HD2  PHE  17           HD1      PHE  17   6.766   3.449 -22.022
  110    HE1  PHE  17           HE2      PHE  17   7.471   8.182 -20.883
  111    HE2  PHE  17           HE1      PHE  17   6.736   5.156 -23.794
  112    HZ   PHE  17           HZ       PHE  17   7.088   7.526 -23.226
  113    H    THR  18           H        THR  18   9.436   5.105 -20.514
  114    HA   THR  18           HA       THR  18  11.337   3.010 -21.343
  115    HB   THR  18           HB       THR  18  10.192   5.174 -23.114
  116    HG1  THR  18           HG1      THR  18   9.449   2.427 -22.904
  117   HG21  THR  18          3HG2      THR  18  12.296   4.382 -23.938
  118   HG22  THR  18          1HG2      THR  18  11.029   3.641 -24.915
  119   HG23  THR  18          2HG2      THR  18  11.835   2.703 -23.658
  120    H    LEU  19           H        LEU  19  10.999   6.153 -20.125
  121    HA   LEU  19           HA       LEU  19  13.480   7.185 -21.184
  122    HB2  LEU  19           2HB      LEU  19  11.343   8.180 -19.373
  123    HB3  LEU  19           3HB      LEU  19  12.934   8.930 -19.269
  124    HG   LEU  19           HG       LEU  19  11.527  10.250 -20.699
  125   HD11  LEU  19          1HD1      LEU  19  13.311  10.663 -21.945
  126   HD12  LEU  19          2HD1      LEU  19  12.963   9.248 -22.937
  127   HD13  LEU  19          3HD1      LEU  19  13.981   9.092 -21.506
  128   HD21  LEU  19          3HD2      LEU  19  10.144   8.102 -21.305
  129   HD22  LEU  19          1HD2      LEU  19  11.244   8.045 -22.683
  130   HD23  LEU  19          2HD2      LEU  19  10.232   9.466 -22.421
  131    H    VAL  20           H        VAL  20  12.563   5.180 -18.615
  132    HA   VAL  20           HA       VAL  20  14.624   5.911 -16.763
  133    HB   VAL  20           HB       VAL  20  12.738   3.581 -16.956
  134   HG11  VAL  20          1HG1      VAL  20  14.627   2.489 -16.115
  135   HG12  VAL  20          2HG1      VAL  20  15.121   3.886 -15.157
  136   HG13  VAL  20          3HG1      VAL  20  13.713   2.938 -14.676
  137   HG21  VAL  20          3HG2      VAL  20  12.659   6.130 -15.755
  138   HG22  VAL  20          1HG2      VAL  20  11.476   4.829 -15.622
  139   HG23  VAL  20          2HG2      VAL  20  12.786   4.953 -14.447
  140    HA   PRO  21           HA       PRO  21  16.721   1.899 -18.479
  141    HB2  PRO  21           2HB      PRO  21  15.730   0.890 -20.796
  142    HB3  PRO  21           3HB      PRO  21  15.140   0.398 -19.204
  143    HG2  PRO  21           2HG      PRO  21  13.968   2.364 -21.133
  144    HG3  PRO  21           3HG      PRO  21  13.151   1.122 -20.166
  145    HD2  PRO  21           2HD      PRO  21  13.188   3.733 -19.452
  146    HD3  PRO  21           3HD      PRO  21  13.164   2.418 -18.260
  147    H    VAL  22           H        VAL  22  15.549   4.437 -20.536
  148    HA   VAL  22           HA       VAL  22  17.912   4.251 -22.262
  149    HB   VAL  22           HB       VAL  22  15.510   6.060 -22.549
  150   HG11  VAL  22          1HG1      VAL  22  17.975   5.599 -24.163
  151   HG12  VAL  22          2HG1      VAL  22  16.469   6.010 -24.986
  152   HG13  VAL  22          3HG1      VAL  22  17.144   7.107 -23.781
  153   HG21  VAL  22          3HG2      VAL  22  16.127   3.532 -24.071
  154   HG22  VAL  22          1HG2      VAL  22  14.986   3.629 -22.730
  155   HG23  VAL  22          2HG2      VAL  22  14.687   4.541 -24.210
  156    H    GLU  23           H        GLU  23  16.814   5.863 -19.518
  157    HA   GLU  23           HA       GLU  23  17.795   8.451 -19.820
  158    HB2  GLU  23           2HB      GLU  23  16.765   8.460 -17.828
  159    HB3  GLU  23           3HB      GLU  23  16.989   6.729 -17.618
  160    HG2  GLU  23           2HG      GLU  23  19.190   7.062 -16.729
  161    HG3  GLU  23           3HG      GLU  23  19.116   8.788 -17.083
  162    H    ASP  24           H        ASP  24  19.476   5.475 -19.509
  163    HA   ASP  24           HA       ASP  24  22.014   6.938 -19.188
  164    HB2  ASP  24           2HB      ASP  24  21.306   5.356 -17.297
  165    HB3  ASP  24           3HB      ASP  24  21.625   4.047 -18.432
  166    H    HIS  25           H        HIS  25  20.121   5.240 -21.305
  167    HA   HIS  25           HA       HIS  25  22.411   4.140 -22.781
  168    HB2  HIS  25           2HB      HIS  25  20.413   2.671 -22.223
  169    HB3  HIS  25           3HB      HIS  25  19.491   3.647 -23.363
  170    HD1  HIS  25           HD1      HIS  25  20.191   3.470 -25.894
  171    HD2  HIS  25           HD2      HIS  25  22.065   0.769 -23.354
  172    HE1  HIS  25           HE1      HIS  25  21.207   1.728 -27.397
  Start of MODEL   14
    1    H1   THR   1           H        THR   1   1.225   0.521   1.512
    2    HA   THR   1           HA       THR   1   1.594   2.178  -0.210
    3    HB   THR   1           HB       THR   1   3.945   0.500  -0.815
    4    HG1  THR   1           HG1      THR   1   3.758   1.429   1.832
    5   HG21  THR   1          3HG2      THR   1   5.115   2.476  -0.504
    6   HG22  THR   1          1HG2      THR   1   3.938   3.114   0.643
    7   HG23  THR   1          2HG2      THR   1   3.556   3.064  -1.078
    8    H    GLY   2           H        GLY   2   1.415  -1.135  -1.267
    9    HA2  GLY   2           2HA      GLY   2   2.050  -0.836  -3.976
   10    HA3  GLY   2           3HA      GLY   2   0.982  -2.067  -3.318
   11    H    ASN   3           H        ASN   3  -0.953  -0.206  -2.252
   12    HA   ASN   3           HA       ASN   3  -2.225   0.566  -4.784
   13    HB2  ASN   3           2HB      ASN   3  -3.412  -0.014  -2.063
   14    HB3  ASN   3           3HB      ASN   3  -4.343   0.548  -3.448
   15   HD21  ASN   3          1HD2      ASN   3  -3.962  -2.051  -1.755
   16   HD22  ASN   3          2HD2      ASN   3  -3.988  -3.284  -2.965
   17    H    VAL   4           H        VAL   4  -0.551   1.909  -2.267
   18    HA   VAL   4           HA       VAL   4  -2.090   4.387  -2.167
   19    HB   VAL   4           HB       VAL   4   0.493   3.764  -0.737
   20   HG11  VAL   4          1HG1      VAL   4   0.167   6.078  -0.688
   21   HG12  VAL   4          2HG1      VAL   4  -1.580   5.920  -0.494
   22   HG13  VAL   4          3HG1      VAL   4  -0.503   5.518   0.844
   23   HG21  VAL   4          3HG2      VAL   4  -2.277   2.926  -0.183
   24   HG22  VAL   4          1HG2      VAL   4  -0.748   2.202   0.315
   25   HG23  VAL   4          2HG2      VAL   4  -1.391   3.593   1.188
   26    H    GLY   5           H        GLY   5   0.409   3.035  -3.972
   27    HA2  GLY   5           2HA      GLY   5   1.619   5.647  -4.566
   28    HA3  GLY   5           3HA      GLY   5   2.302   4.083  -4.984
   29    H    LEU   6           H        LEU   6  -1.059   4.862  -5.533
   30    HA   LEU   6           HA       LEU   6  -0.904   4.159  -8.274
   31    HB2  LEU   6           2HB      LEU   6  -2.928   3.885  -6.913
   32    HB3  LEU   6           3HB      LEU   6  -3.077   5.637  -6.795
   33    HG   LEU   6           HG       LEU   6  -2.974   4.758  -9.554
   34   HD11  LEU   6          1HD1      LEU   6  -4.857   3.425  -9.716
   35   HD12  LEU   6          2HD1      LEU   6  -5.429   3.855  -8.105
   36   HD13  LEU   6          3HD1      LEU   6  -4.049   2.773  -8.290
   37   HD21  LEU   6          3HD2      LEU   6  -3.851   6.920  -8.300
   38   HD22  LEU   6          1HD2      LEU   6  -5.360   6.007  -8.303
   39   HD23  LEU   6          2HD2      LEU   6  -4.552   6.379  -9.826
   40    H    SER   7           H        SER   7  -0.665   7.173  -6.549
   41    HA   SER   7           HA       SER   7  -0.882   8.752  -8.982
   42    HB2  SER   7           2HB      SER   7  -1.766  10.128  -7.422
   43    HB3  SER   7           3HB      SER   7  -0.971   9.283  -6.094
   44    HG   SER   7           HG       SER   7   0.309  11.111  -7.849
   45    HA   PRO   8           HA       PRO   8   3.696   9.697  -7.780
   46    HB2  PRO   8           2HB      PRO   8   4.782   8.262  -5.747
   47    HB3  PRO   8           3HB      PRO   8   3.933   9.792  -5.497
   48    HG2  PRO   8           2HG      PRO   8   2.934   6.992  -5.146
   49    HG3  PRO   8           3HG      PRO   8   2.690   8.405  -4.103
   50    HD2  PRO   8           2HD      PRO   8   0.805   7.533  -5.841
   51    HD3  PRO   8           3HD      PRO   8   1.004   9.249  -5.430
   52    H    GLY   9           H        GLY   9   2.267   6.660  -8.150
   53    HA2  GLY   9           2HA      GLY   9   4.796   5.453  -9.068
   54    HA3  GLY   9           3HA      GLY   9   3.363   4.551  -8.599
   55    H    LEU  10           H        LEU  10   1.642   6.487 -10.101
   56    HA   LEU  10           HA       LEU  10   1.729   5.096 -12.616
   57    HB2  LEU  10           2HB      LEU  10  -0.406   5.578 -11.622
   58    HB3  LEU  10           3HB      LEU  10  -0.041   7.302 -11.578
   59    HG   LEU  10           HG       LEU  10   0.160   6.579 -14.270
   60   HD11  LEU  10          1HD1      LEU  10  -1.129   4.499 -13.339
   61   HD12  LEU  10          2HD1      LEU  10  -1.633   5.269 -14.843
   62   HD13  LEU  10          3HD1      LEU  10  -2.501   5.608 -13.346
   63   HD21  LEU  10          3HD2      LEU  10  -0.774   8.646 -13.039
   64   HD22  LEU  10          1HD2      LEU  10  -2.304   7.770 -13.053
   65   HD23  LEU  10          2HD2      LEU  10  -1.505   8.172 -14.573
   66    H    SER  11           H        SER  11   2.314   8.402 -11.503
   67    HA   SER  11           HA       SER  11   2.874   9.393 -14.139
   68    HB2  SER  11           2HB      SER  11   1.995  10.759 -12.168
   69    HB3  SER  11           3HB      SER  11   3.642  10.722 -11.540
   70    HG   SER  11           HG       SER  11   4.334  11.888 -13.264
   71    H    THR  12           H        THR  12   4.649   7.780 -11.693
   72    HA   THR  12           HA       THR  12   7.239   8.702 -12.620
   73    HB   THR  12           HB       THR  12   6.512   6.607 -10.564
   74    HG1  THR  12           HG1      THR  12   7.427   9.298 -10.341
   75   HG21  THR  12          3HG2      THR  12   9.063   7.347 -11.798
   76   HG22  THR  12          1HG2      THR  12   8.627   5.910 -10.875
   77   HG23  THR  12          2HG2      THR  12   9.079   7.393 -10.035
   78    H    ALA  13           H        ALA  13   5.052   6.118 -13.237
   79    HA   ALA  13           HA       ALA  13   7.102   4.437 -14.449
   80    HB1  ALA  13           1HB      ALA  13   4.159   4.049 -13.969
   81    HB2  ALA  13           2HB      ALA  13   5.136   2.915 -14.900
   82    HB3  ALA  13           3HB      ALA  13   5.510   3.214 -13.203
   83    H    LEU  14           H        LEU  14   4.407   6.499 -15.359
   84    HA   LEU  14           HA       LEU  14   4.465   5.773 -18.130
   85    HB2  LEU  14           2HB      LEU  14   2.864   7.419 -16.397
   86    HB3  LEU  14           3HB      LEU  14   3.267   8.294 -17.873
   87    HG   LEU  14           HG       LEU  14   1.108   7.168 -18.052
   88   HD11  LEU  14          1HD1      LEU  14   3.393   6.566 -19.805
   89   HD12  LEU  14          2HD1      LEU  14   1.833   7.299 -20.177
   90   HD13  LEU  14          3HD1      LEU  14   1.970   5.547 -20.028
   91   HD21  LEU  14          3HD2      LEU  14   2.601   4.971 -16.904
   92   HD22  LEU  14          1HD2      LEU  14   1.740   4.486 -18.365
   93   HD23  LEU  14          2HD2      LEU  14   0.858   5.212 -17.022
   94    H    THR  15           H        THR  15   6.422   7.694 -16.186
   95    HA   THR  15           HA       THR  15   7.234   9.447 -18.388
   96    HB   THR  15           HB       THR  15   8.027   9.484 -15.470
   97    HG1  THR  15           HG1      THR  15   5.899  10.205 -15.828
   98   HG21  THR  15          3HG2      THR  15   9.271  10.671 -17.762
   99   HG22  THR  15          1HG2      THR  15   9.741  10.777 -16.066
  100   HG23  THR  15          2HG2      THR  15   8.596  11.938 -16.738
  101    H    GLY  16           H        GLY  16   8.430   6.877 -16.304
  102    HA2  GLY  16           2HA      GLY  16  11.006   6.936 -17.727
  103    HA3  GLY  16           3HA      GLY  16  10.713   6.142 -16.187
  104    H    PHE  17           H        PHE  17   8.070   5.340 -17.810
  105    HA   PHE  17           HA       PHE  17   8.290   2.725 -18.043
  106    HB2  PHE  17           2HB      PHE  17   6.811   2.743 -20.009
  107    HB3  PHE  17           3HB      PHE  17   6.310   3.939 -18.818
  108    HD1  PHE  17           HD2      PHE  17   7.592   6.309 -19.219
  109    HD2  PHE  17           HD1      PHE  17   6.654   3.406 -22.187
  110    HE1  PHE  17           HE2      PHE  17   7.660   8.059 -20.948
  111    HE2  PHE  17           HE1      PHE  17   6.721   5.151 -23.920
  112    HZ   PHE  17           HZ       PHE  17   7.223   7.481 -23.302
  113    H    THR  18           H        THR  18   9.429   4.856 -20.663
  114    HA   THR  18           HA       THR  18  11.191   2.665 -21.550
  115    HB   THR  18           HB       THR  18  10.180   4.938 -23.265
  116    HG1  THR  18           HG1      THR  18   9.226   2.268 -22.976
  117   HG21  THR  18          3HG2      THR  18  12.232   4.011 -24.103
  118   HG22  THR  18          1HG2      THR  18  10.911   3.416 -25.107
  119   HG23  THR  18          2HG2      THR  18  11.633   2.367 -23.887
  120    H    LEU  19           H        LEU  19  11.060   5.795 -20.260
  121    HA   LEU  19           HA       LEU  19  13.596   6.691 -21.311
  122    HB2  LEU  19           2HB      LEU  19  11.537   7.777 -19.463
  123    HB3  LEU  19           3HB      LEU  19  13.173   8.423 -19.354
  124    HG   LEU  19           HG       LEU  19  11.844   9.861 -20.745
  125   HD11  LEU  19          1HD1      LEU  19  13.200   8.821 -23.015
  126   HD12  LEU  19          2HD1      LEU  19  14.215   8.569 -21.595
  127   HD13  LEU  19          3HD1      LEU  19  13.643  10.189 -21.993
  128   HD21  LEU  19          3HD2      LEU  19  10.328   7.811 -21.390
  129   HD22  LEU  19          1HD2      LEU  19  11.410   7.732 -22.780
  130   HD23  LEU  19          2HD2      LEU  19  10.485   9.201 -22.466
  131    H    VAL  20           H        VAL  20  12.569   4.685 -18.788
  132    HA   VAL  20           HA       VAL  20  14.682   5.241 -16.931
  133    HB   VAL  20           HB       VAL  20  12.652   3.039 -17.164
  134   HG11  VAL  20          1HG1      VAL  20  15.040   3.168 -15.347
  135   HG12  VAL  20          2HG1      VAL  20  13.584   2.268 -14.919
  136   HG13  VAL  20          3HG1      VAL  20  14.499   1.831 -16.362
  137   HG21  VAL  20          3HG2      VAL  20  12.785   4.347 -14.628
  138   HG22  VAL  20          1HG2      VAL  20  12.742   5.562 -15.906
  139   HG23  VAL  20          2HG2      VAL  20  11.472   4.343 -15.806
  140    HA   PRO  21           HA       PRO  21  16.508   1.144 -18.752
  141    HB2  PRO  21           2HB      PRO  21  15.441   0.254 -21.084
  142    HB3  PRO  21           3HB      PRO  21  14.829  -0.236 -19.500
  143    HG2  PRO  21           2HG      PRO  21  13.776   1.845 -21.376
  144    HG3  PRO  21           3HG      PRO  21  12.886   0.636 -20.432
  145    HD2  PRO  21           2HD      PRO  21  13.094   3.223 -19.659
  146    HD3  PRO  21           3HD      PRO  21  12.992   1.884 -18.497
  147    H    VAL  22           H        VAL  22  15.489   3.797 -20.745
  148    HA   VAL  22           HA       VAL  22  17.819   3.498 -22.497
  149    HB   VAL  22           HB       VAL  22  15.542   5.473 -22.703
  150   HG11  VAL  22          1HG1      VAL  22  16.430   5.557 -25.112
  151   HG12  VAL  22          2HG1      VAL  22  17.340   6.409 -23.862
  152   HG13  VAL  22          3HG1      VAL  22  17.898   4.841 -24.447
  153   HG21  VAL  22          3HG2      VAL  22  14.608   4.066 -24.403
  154   HG22  VAL  22          1HG2      VAL  22  15.985   2.967 -24.318
  155   HG23  VAL  22          2HG2      VAL  22  14.865   3.083 -22.961
  156    H    GLU  23           H        GLU  23  16.858   5.114 -19.702
  157    HA   GLU  23           HA       GLU  23  18.041   7.627 -19.958
  158    HB2  GLU  23           2HB      GLU  23  16.992   7.686 -17.976
  159    HB3  GLU  23           3HB      GLU  23  17.080   5.940 -17.789
  160    HG2  GLU  23           2HG      GLU  23  19.299   6.094 -16.884
  161    HG3  GLU  23           3HG      GLU  23  19.349   7.827 -17.205
  162    H    ASP  24           H        ASP  24  19.467   4.520 -19.705
  163    HA   ASP  24           HA       ASP  24  21.999   5.383 -18.668
  164    HB2  ASP  24           2HB      ASP  24  21.014   3.033 -18.509
  165    HB3  ASP  24           3HB      ASP  24  21.479   2.835 -20.196
  166    H    HIS  25           H        HIS  25  20.512   5.840 -21.589
  167    HA   HIS  25           HA       HIS  25  22.462   5.336 -23.506
  168    HB2  HIS  25           2HB      HIS  25  21.299   6.879 -24.920
  169    HB3  HIS  25           3HB      HIS  25  20.091   6.063 -23.932
  170    HD1  HIS  25           HD1      HIS  25  19.588   8.835 -25.256
  171    HD2  HIS  25           HD2      HIS  25  20.842   8.261 -21.337
  172    HE1  HIS  25           HE1      HIS  25  18.901  10.914 -24.019
  Start of MODEL   15
    1    H1   THR   1           H        THR   1  -0.237  -0.116   0.528
    2    HA   THR   1           HA       THR   1   1.320   1.111  -0.632
    3    HB   THR   1           HB       THR   1   2.771  -1.343  -1.551
    4    HG1  THR   1           HG1      THR   1   3.421  -1.801   0.416
    5   HG21  THR   1          3HG2      THR   1   4.698   0.085  -1.425
    6   HG22  THR   1          1HG2      THR   1   3.776   1.338  -0.597
    7   HG23  THR   1          2HG2      THR   1   3.427   0.954  -2.283
    8    H    GLY   2           H        GLY   2  -0.002  -1.824  -2.021
    9    HA2  GLY   2           2HA      GLY   2   0.402  -1.333  -4.732
   10    HA3  GLY   2           3HA      GLY   2  -0.950  -2.239  -4.069
   11    H    ASN   3           H        ASN   3  -2.190  -0.180  -2.612
   12    HA   ASN   3           HA       ASN   3  -3.415   1.273  -4.814
   13    HB2  ASN   3           2HB      ASN   3  -4.704   0.028  -2.975
   14    HB3  ASN   3           3HB      ASN   3  -4.274   1.377  -1.928
   15   HD21  ASN   3          1HD2      ASN   3  -6.221   2.290  -1.641
   16   HD22  ASN   3          2HD2      ASN   3  -7.195   2.939  -2.911
   17    H    VAL   4           H        VAL   4  -0.930   1.800  -2.696
   18    HA   VAL   4           HA       VAL   4  -1.435   4.673  -2.420
   19    HB   VAL   4           HB       VAL   4   0.867   3.097  -1.269
   20   HG11  VAL   4          1HG1      VAL   4   1.518   5.294  -1.127
   21   HG12  VAL   4          2HG1      VAL   4  -0.138   5.889  -0.989
   22   HG13  VAL   4          3HG1      VAL   4   0.640   5.115   0.392
   23   HG21  VAL   4          3HG2      VAL   4  -0.748   2.094  -0.052
   24   HG22  VAL   4          1HG2      VAL   4  -0.712   3.606   0.855
   25   HG23  VAL   4          2HG2      VAL   4  -1.935   3.354  -0.390
   26    H    GLY   5           H        GLY   5   0.151   2.511  -4.455
   27    HA2  GLY   5           2HA      GLY   5   2.140   4.523  -5.273
   28    HA3  GLY   5           3HA      GLY   5   2.214   2.809  -5.655
   29    H    LEU   6           H        LEU   6  -0.847   4.336  -5.967
   30    HA   LEU   6           HA       LEU   6  -0.737   3.958  -8.849
   31    HB2  LEU   6           2HB      LEU   6  -2.649   3.179  -7.402
   32    HB3  LEU   6           3HB      LEU   6  -3.076   4.876  -7.191
   33    HG   LEU   6           HG       LEU   6  -2.824   3.990  -9.986
   34   HD11  LEU   6          1HD1      LEU   6  -3.914   2.046  -9.535
   35   HD12  LEU   6          2HD1      LEU   6  -5.305   3.123  -9.652
   36   HD13  LEU   6          3HD1      LEU   6  -4.668   2.675  -8.070
   37   HD21  LEU   6          3HD2      LEU   6  -5.270   5.245  -8.927
   38   HD22  LEU   6          1HD2      LEU   6  -4.305   5.650 -10.347
   39   HD23  LEU   6          2HD2      LEU   6  -3.785   6.182  -8.747
   40    H    SER   7           H        SER   7  -0.046   6.414  -6.746
   41    HA   SER   7           HA       SER   7  -0.711   8.467  -8.755
   42    HB2  SER   7           2HB      SER   7  -1.192   8.390  -5.880
   43    HB3  SER   7           3HB      SER   7  -0.300   9.831  -6.369
   44    HG   SER   7           HG       SER   7  -2.909   9.163  -6.807
   45    HA   PRO   8           HA       PRO   8   3.544   9.808  -6.964
   46    HB2  PRO   8           2HB      PRO   8   4.601   8.346  -4.935
   47    HB3  PRO   8           3HB      PRO   8   3.514   9.714  -4.669
   48    HG2  PRO   8           2HG      PRO   8   2.905   6.783  -4.666
   49    HG3  PRO   8           3HG      PRO   8   2.344   8.044  -3.552
   50    HD2  PRO   8           2HD      PRO   8   0.808   7.094  -5.569
   51    HD3  PRO   8           3HD      PRO   8   0.707   8.773  -5.002
   52    H    GLY   9           H        GLY   9   2.629   6.642  -7.726
   53    HA2  GLY   9           2HA      GLY   9   5.373   6.026  -8.637
   54    HA3  GLY   9           3HA      GLY   9   4.259   4.794  -8.061
   55    H    LEU  10           H        LEU  10   2.132   6.525  -9.553
   56    HA   LEU  10           HA       LEU  10   2.230   4.951 -11.963
   57    HB2  LEU  10           2HB      LEU  10   0.114   5.310 -10.845
   58    HB3  LEU  10           3HB      LEU  10   0.290   7.055 -11.017
   59    HG   LEU  10           HG       LEU  10   0.414   6.140 -13.620
   60   HD11  LEU  10          1HD1      LEU  10  -1.748   4.789 -13.718
   61   HD12  LEU  10          2HD1      LEU  10  -1.477   4.456 -12.008
   62   HD13  LEU  10          3HD1      LEU  10  -0.286   3.946 -13.205
   63   HD21  LEU  10          3HD2      LEU  10  -1.423   7.467 -13.919
   64   HD22  LEU  10          1HD2      LEU  10  -0.882   8.048 -12.344
   65   HD23  LEU  10          2HD2      LEU  10  -2.215   6.897 -12.449
   66    H    SER  11           H        SER  11   2.550   8.363 -11.101
   67    HA   SER  11           HA       SER  11   2.855   9.216 -13.830
   68    HB2  SER  11           2HB      SER  11   2.106  10.522 -11.593
   69    HB3  SER  11           3HB      SER  11   3.812  10.967 -11.633
   70    HG   SER  11           HG       SER  11   2.428  12.419 -12.804
   71    H    THR  12           H        THR  12   4.910   7.957 -11.399
   72    HA   THR  12           HA       THR  12   7.342   9.070 -12.520
   73    HB   THR  12           HB       THR  12   6.971   7.005 -10.341
   74    HG1  THR  12           HG1      THR  12   7.326   8.743  -8.956
   75   HG21  THR  12          3HG2      THR  12   9.154   6.782 -11.371
   76   HG22  THR  12          1HG2      THR  12   9.324   7.528  -9.783
   77   HG23  THR  12          2HG2      THR  12   9.425   8.519 -11.238
   78    H    ALA  13           H        ALA  13   5.407   6.242 -12.864
   79    HA   ALA  13           HA       ALA  13   7.553   4.714 -14.112
   80    HB1  ALA  13           1HB      ALA  13   4.705   4.058 -13.411
   81    HB2  ALA  13           2HB      ALA  13   5.722   2.980 -14.368
   82    HB3  ALA  13           3HB      ALA  13   6.186   3.395 -12.718
   83    H    LEU  14           H        LEU  14   4.599   6.419 -14.960
   84    HA   LEU  14           HA       LEU  14   4.586   5.545 -17.689
   85    HB2  LEU  14           2HB      LEU  14   2.908   7.101 -15.949
   86    HB3  LEU  14           3HB      LEU  14   3.135   7.937 -17.484
   87    HG   LEU  14           HG       LEU  14   1.112   6.600 -17.527
   88   HD11  LEU  14          1HD1      LEU  14   2.276   4.852 -19.348
   89   HD12  LEU  14          2HD1      LEU  14   3.330   6.266 -19.344
   90   HD13  LEU  14          3HD1      LEU  14   1.610   6.450 -19.686
   91   HD21  LEU  14          3HD2      LEU  14   1.766   3.985 -17.633
   92   HD22  LEU  14          1HD2      LEU  14   1.185   4.797 -16.179
   93   HD23  LEU  14          2HD2      LEU  14   2.915   4.552 -16.419
   94    H    THR  15           H        THR  15   6.416   7.782 -15.968
   95    HA   THR  15           HA       THR  15   6.911   9.474 -18.308
   96    HB   THR  15           HB       THR  15   7.850   9.777 -15.448
   97    HG1  THR  15           HG1      THR  15   6.239  11.245 -15.273
   98   HG21  THR  15          3HG2      THR  15   9.364  11.219 -16.214
   99   HG22  THR  15          1HG2      THR  15   8.059  12.197 -16.885
  100   HG23  THR  15          2HG2      THR  15   8.825  10.951 -17.872
  101    H    GLY  16           H        GLY  16   8.494   7.182 -16.159
  102    HA2  GLY  16           2HA      GLY  16  10.971   7.435 -17.729
  103    HA3  GLY  16           3HA      GLY  16  10.847   6.706 -16.135
  104    H    PHE  17           H        PHE  17   8.231   5.528 -17.562
  105    HA   PHE  17           HA       PHE  17   8.730   2.943 -17.670
  106    HB2  PHE  17           2HB      PHE  17   7.159   2.686 -19.546
  107    HB3  PHE  17           3HB      PHE  17   6.590   3.888 -18.392
  108    HD1  PHE  17           HD2      PHE  17   7.574   6.356 -18.990
  109    HD2  PHE  17           HD1      PHE  17   6.819   3.199 -21.743
  110    HE1  PHE  17           HE2      PHE  17   7.358   7.999 -20.809
  111    HE2  PHE  17           HE1      PHE  17   6.602   4.836 -23.567
  112    HZ   PHE  17           HZ       PHE  17   6.870   7.240 -23.101
  113    H    THR  18           H        THR  18   9.491   5.033 -20.455
  114    HA   THR  18           HA       THR  18  11.440   2.999 -21.326
  115    HB   THR  18           HB       THR  18  10.087   5.037 -23.099
  116    HG1  THR  18           HG1      THR  18   9.447   2.321 -22.547
  117   HG21  THR  18          3HG2      THR  18  10.896   3.505 -24.897
  118   HG22  THR  18          1HG2      THR  18  11.793   2.613 -23.669
  119   HG23  THR  18          2HG2      THR  18  12.190   4.299 -24.001
  120    H    LEU  19           H        LEU  19  11.017   6.170 -20.206
  121    HA   LEU  19           HA       LEU  19  13.379   7.274 -21.447
  122    HB2  LEU  19           2HB      LEU  19  11.307   8.239 -19.545
  123    HB3  LEU  19           3HB      LEU  19  12.861   9.069 -19.574
  124    HG   LEU  19           HG       LEU  19  11.296  10.255 -20.962
  125   HD11  LEU  19          1HD1      LEU  19  13.756   9.189 -21.878
  126   HD12  LEU  19          2HD1      LEU  19  12.981  10.709 -22.324
  127   HD13  LEU  19          3HD1      LEU  19  12.645   9.245 -23.247
  128   HD21  LEU  19          3HD2      LEU  19   9.997   8.016 -21.398
  129   HD22  LEU  19          1HD2      LEU  19  11.016   7.956 -22.836
  130   HD23  LEU  19          2HD2      LEU  19   9.947   9.333 -22.571
  131    H    VAL  20           H        VAL  20  12.710   5.333 -18.756
  132    HA   VAL  20           HA       VAL  20  14.842   6.233 -17.062
  133    HB   VAL  20           HB       VAL  20  13.039   3.833 -17.041
  134   HG11  VAL  20          1HG1      VAL  20  14.958   2.787 -16.273
  135   HG12  VAL  20          2HG1      VAL  20  15.566   4.248 -15.492
  136   HG13  VAL  20          3HG1      VAL  20  14.216   3.363 -14.781
  137   HG21  VAL  20          3HG2      VAL  20  11.874   4.979 -15.517
  138   HG22  VAL  20          1HG2      VAL  20  13.328   5.436 -14.630
  139   HG23  VAL  20          2HG2      VAL  20  12.812   6.384 -16.025
  140    HA   PRO  21           HA       PRO  21  17.009   2.240 -18.735
  141    HB2  PRO  21           2HB      PRO  21  15.925   1.086 -20.940
  142    HB3  PRO  21           3HB      PRO  21  15.456   0.642 -19.294
  143    HG2  PRO  21           2HG      PRO  21  14.082   2.468 -21.228
  144    HG3  PRO  21           3HG      PRO  21  13.381   1.237 -20.161
  145    HD2  PRO  21           2HD      PRO  21  13.344   3.878 -19.562
  146    HD3  PRO  21           3HD      PRO  21  13.452   2.618 -18.316
  147    H    VAL  22           H        VAL  22  15.611   4.643 -20.806
  148    HA   VAL  22           HA       VAL  22  17.869   4.475 -22.671
  149    HB   VAL  22           HB       VAL  22  15.370   6.159 -22.888
  150   HG11  VAL  22          1HG1      VAL  22  17.840   5.984 -24.435
  151   HG12  VAL  22          2HG1      VAL  22  16.380   5.801 -25.410
  152   HG13  VAL  22          3HG1      VAL  22  16.602   7.239 -24.412
  153   HG21  VAL  22          3HG2      VAL  22  14.955   3.701 -22.941
  154   HG22  VAL  22          1HG2      VAL  22  14.533   4.533 -24.438
  155   HG23  VAL  22          2HG2      VAL  22  16.025   3.598 -24.339
  156    H    GLU  23           H        GLU  23  16.862   6.161 -19.937
  157    HA   GLU  23           HA       GLU  23  17.697   8.774 -20.407
  158    HB2  GLU  23           2HB      GLU  23  16.792   8.820 -18.354
  159    HB3  GLU  23           3HB      GLU  23  17.119   7.114 -18.087
  160    HG2  GLU  23           2HG      GLU  23  19.350   7.594 -17.355
  161    HG3  GLU  23           3HG      GLU  23  19.168   9.295 -17.781
  162    H    ASP  24           H        ASP  24  19.537   5.894 -20.076
  163    HA   ASP  24           HA       ASP  24  22.016   7.486 -19.986
  164    HB2  ASP  24           2HB      ASP  24  21.503   5.960 -17.987
  165    HB3  ASP  24           3HB      ASP  24  21.821   4.618 -19.083
  166    H    HIS  25           H        HIS  25  20.079   5.594 -21.894
  167    HA   HIS  25           HA       HIS  25  22.348   4.661 -23.525
  168    HB2  HIS  25           2HB      HIS  25  20.511   3.040 -22.566
  169    HB3  HIS  25           3HB      HIS  25  19.561   3.641 -23.922
  170    HD1  HIS  25           HD1      HIS  25  22.453   3.789 -25.603
  171    HD2  HIS  25           HD2      HIS  25  20.498   0.521 -23.942
  172    HE1  HIS  25           HE1      HIS  25  23.302   1.786 -26.863
  Start of MODEL   16
    1    H1   THR   1           H        THR   1   0.865   0.841  -0.357
    2    HA   THR   1           HA       THR   1   2.254   1.862  -1.884
    3    HB   THR   1           HB       THR   1   3.785  -0.598  -2.541
    4    HG1  THR   1           HG1      THR   1   4.311  -0.947  -0.529
    5   HG21  THR   1          3HG2      THR   1   4.757   2.159  -1.816
    6   HG22  THR   1          1HG2      THR   1   4.221   1.733  -3.441
    7   HG23  THR   1          2HG2      THR   1   5.606   0.909  -2.724
    8    H    GLY   2           H        GLY   2   1.183  -1.440  -2.543
    9    HA2  GLY   2           2HA      GLY   2   1.183  -1.293  -5.352
   10    HA3  GLY   2           3HA      GLY   2   0.194  -2.380  -4.388
   11    H    ASN   3           H        ASN   3  -1.193  -0.263  -2.975
   12    HA   ASN   3           HA       ASN   3  -2.905   0.686  -5.176
   13    HB2  ASN   3           2HB      ASN   3  -3.606  -0.054  -2.329
   14    HB3  ASN   3           3HB      ASN   3  -4.727   0.727  -3.441
   15   HD21  ASN   3          1HD2      ASN   3  -4.274  -2.064  -2.100
   16   HD22  ASN   3          2HD2      ASN   3  -4.664  -3.153  -3.384
   17    H    VAL   4           H        VAL   4  -0.694   1.707  -2.936
   18    HA   VAL   4           HA       VAL   4  -1.969   4.320  -2.535
   19    HB   VAL   4           HB       VAL   4   0.574   3.314  -1.260
   20   HG11  VAL   4          1HG1      VAL   4   0.539   5.642  -1.079
   21   HG12  VAL   4          2HG1      VAL   4  -1.206   5.689  -0.822
   22   HG13  VAL   4          3HG1      VAL   4  -0.141   5.088   0.450
   23   HG21  VAL   4          3HG2      VAL   4  -0.888   2.965   0.760
   24   HG22  VAL   4          1HG2      VAL   4  -2.277   3.130  -0.313
   25   HG23  VAL   4          2HG2      VAL   4  -1.129   1.814  -0.554
   26    H    GLY   5           H        GLY   5   0.267   2.770  -4.518
   27    HA2  GLY   5           2HA      GLY   5   1.777   5.236  -5.039
   28    HA3  GLY   5           3HA      GLY   5   2.226   3.625  -5.578
   29    H    LEU   6           H        LEU   6  -1.063   4.606  -5.936
   30    HA   LEU   6           HA       LEU   6  -0.895   4.328  -8.787
   31    HB2  LEU   6           2HB      LEU   6  -2.833   3.565  -7.454
   32    HB3  LEU   6           3HB      LEU   6  -3.207   5.247  -7.084
   33    HG   LEU   6           HG       LEU   6  -3.029   4.709  -9.948
   34   HD11  LEU   6          1HD1      LEU   6  -3.907   2.536  -9.182
   35   HD12  LEU   6          2HD1      LEU   6  -5.079   3.450 -10.130
   36   HD13  LEU   6          3HD1      LEU   6  -5.230   3.379  -8.375
   37   HD21  LEU   6          3HD2      LEU   6  -5.551   5.640  -8.838
   38   HD22  LEU   6          1HD2      LEU   6  -4.471   6.409 -10.001
   39   HD23  LEU   6          2HD2      LEU   6  -4.167   6.576  -8.272
   40    H    SER   7           H        SER   7  -0.195   6.834  -6.747
   41    HA   SER   7           HA       SER   7  -0.812   8.836  -8.821
   42    HB2  SER   7           2HB      SER   7  -1.323   8.849  -5.949
   43    HB3  SER   7           3HB      SER   7  -0.412  10.265  -6.473
   44    HG   SER   7           HG       SER   7  -2.813   9.362  -7.686
   45    HA   PRO   8           HA       PRO   8   3.440  10.176  -7.019
   46    HB2  PRO   8           2HB      PRO   8   4.454   8.759  -4.937
   47    HB3  PRO   8           3HB      PRO   8   3.382  10.148  -4.723
   48    HG2  PRO   8           2HG      PRO   8   2.736   7.227  -4.643
   49    HG3  PRO   8           3HG      PRO   8   2.178   8.525  -3.572
   50    HD2  PRO   8           2HD      PRO   8   0.654   7.537  -5.580
   51    HD3  PRO   8           3HD      PRO   8   0.568   9.233  -5.061
   52    H    GLY   9           H        GLY   9   2.493   7.002  -7.701
   53    HA2  GLY   9           2HA      GLY   9   5.239   6.325  -8.562
   54    HA3  GLY   9           3HA      GLY   9   4.103   5.125  -7.964
   55    H    LEU  10           H        LEU  10   2.015   6.837  -9.530
   56    HA   LEU  10           HA       LEU  10   2.119   5.194 -11.892
   57    HB2  LEU  10           2HB      LEU  10   0.016   5.727 -10.687
   58    HB3  LEU  10           3HB      LEU  10   0.196   7.407 -11.189
   59    HG   LEU  10           HG       LEU  10   0.175   5.387 -13.349
   60   HD11  LEU  10          1HD1      LEU  10  -2.330   5.370 -13.306
   61   HD12  LEU  10          2HD1      LEU  10  -2.242   6.019 -11.669
   62   HD13  LEU  10          3HD1      LEU  10  -1.557   4.434 -12.027
   63   HD21  LEU  10          3HD2      LEU  10  -0.956   8.137 -12.897
   64   HD22  LEU  10          1HD2      LEU  10  -1.334   7.170 -14.323
   65   HD23  LEU  10          2HD2      LEU  10   0.332   7.651 -14.001
   66    H    SER  11           H        SER  11   2.472   8.626 -11.128
   67    HA   SER  11           HA       SER  11   2.823   9.394 -13.875
   68    HB2  SER  11           2HB      SER  11   2.010  10.798 -11.771
   69    HB3  SER  11           3HB      SER  11   3.733  11.151 -11.639
   70    HG   SER  11           HG       SER  11   1.979  12.276 -13.249
   71    H    THR  12           H        THR  12   4.832   8.180 -11.384
   72    HA   THR  12           HA       THR  12   7.291   9.228 -12.508
   73    HB   THR  12           HB       THR  12   6.891   7.214 -10.287
   74    HG1  THR  12           HG1      THR  12   7.521   9.991 -10.139
   75   HG21  THR  12          3HG2      THR  12   9.081   6.840 -10.669
   76   HG22  THR  12          1HG2      THR  12   9.307   8.388  -9.856
   77   HG23  THR  12          2HG2      THR  12   9.270   8.314 -11.618
   78    H    ALA  13           H        ALA  13   5.322   6.416 -12.793
   79    HA   ALA  13           HA       ALA  13   7.462   4.825 -13.971
   80    HB1  ALA  13           1HB      ALA  13   6.210   3.371 -12.754
   81    HB2  ALA  13           2HB      ALA  13   4.717   4.278 -12.997
   82    HB3  ALA  13           3HB      ALA  13   5.344   3.249 -14.285
   83    H    LEU  14           H        LEU  14   4.541   6.542 -14.903
   84    HA   LEU  14           HA       LEU  14   4.548   5.589 -17.605
   85    HB2  LEU  14           2HB      LEU  14   2.868   7.211 -15.931
   86    HB3  LEU  14           3HB      LEU  14   3.127   8.007 -17.482
   87    HG   LEU  14           HG       LEU  14   1.080   6.675 -17.478
   88   HD11  LEU  14          1HD1      LEU  14   3.338   6.163 -19.292
   89   HD12  LEU  14          2HD1      LEU  14   1.700   6.715 -19.639
   90   HD13  LEU  14          3HD1      LEU  14   2.015   5.000 -19.375
   91   HD21  LEU  14          3HD2      LEU  14   2.817   4.724 -16.241
   92   HD22  LEU  14          1HD2      LEU  14   1.971   4.047 -17.633
   93   HD23  LEU  14          2HD2      LEU  14   1.055   4.779 -16.316
   94    H    THR  15           H        THR  15   6.388   7.851 -15.929
   95    HA   THR  15           HA       THR  15   6.932   9.469 -18.309
   96    HB   THR  15           HB       THR  15   7.844   9.839 -15.449
   97    HG1  THR  15           HG1      THR  15   6.406  11.743 -15.744
   98   HG21  THR  15          3HG2      THR  15   9.386  11.239 -16.238
   99   HG22  THR  15          1HG2      THR  15   8.103  12.214 -16.951
  100   HG23  THR  15          2HG2      THR  15   8.862  10.931 -17.894
  101    H    GLY  16           H        GLY  16   8.461   7.218 -16.079
  102    HA2  GLY  16           2HA      GLY  16  10.957   7.393 -17.629
  103    HA3  GLY  16           3HA      GLY  16  10.806   6.712 -16.016
  104    H    PHE  17           H        PHE  17   8.189   5.528 -17.435
  105    HA   PHE  17           HA       PHE  17   8.654   2.934 -17.463
  106    HB2  PHE  17           2HB      PHE  17   7.100   2.643 -19.347
  107    HB3  PHE  17           3HB      PHE  17   6.535   3.886 -18.235
  108    HD1  PHE  17           HD1      PHE  17   7.560   6.322 -18.893
  109    HD2  PHE  17           HD2      PHE  17   6.789   3.097 -21.562
  110    HE1  PHE  17           HE1      PHE  17   7.385   7.914 -20.761
  111    HE2  PHE  17           HE2      PHE  17   6.614   4.684 -23.434
  112    HZ   PHE  17           HZ       PHE  17   6.912   7.096 -23.035
  113    H    THR  18           H        THR  18   9.470   4.929 -20.301
  114    HA   THR  18           HA       THR  18  11.400   2.845 -21.092
  115    HB   THR  18           HB       THR  18  10.095   4.852 -22.935
  116    HG1  THR  18           HG1      THR  18   8.618   3.319 -23.410
  117   HG21  THR  18          3HG2      THR  18  12.196   4.062 -23.794
  118   HG22  THR  18          1HG2      THR  18  10.902   3.258 -24.682
  119   HG23  THR  18          2HG2      THR  18  11.776   2.392 -23.418
  120    H    LEU  19           H        LEU  19  11.015   6.049 -20.061
  121    HA   LEU  19           HA       LEU  19  13.404   7.086 -21.308
  122    HB2  LEU  19           2HB      LEU  19  11.327   8.130 -19.455
  123    HB3  LEU  19           3HB      LEU  19  12.894   8.934 -19.483
  124    HG   LEU  19           HG       LEU  19  11.369  10.112 -20.919
  125   HD11  LEU  19          1HD1      LEU  19  12.727   9.019 -23.161
  126   HD12  LEU  19          2HD1      LEU  19  13.821   8.983 -21.778
  127   HD13  LEU  19          3HD1      LEU  19  13.076  10.503 -22.273
  128   HD21  LEU  19          3HD2      LEU  19  11.069   7.775 -22.742
  129   HD22  LEU  19          1HD2      LEU  19  10.019   9.175 -22.516
  130   HD23  LEU  19          2HD2      LEU  19  10.037   7.883 -21.315
  131    H    VAL  20           H        VAL  20  12.684   5.224 -18.575
  132    HA   VAL  20           HA       VAL  20  14.808   6.137 -16.881
  133    HB   VAL  20           HB       VAL  20  12.996   3.741 -16.828
  134   HG11  VAL  20          1HG1      VAL  20  15.408   4.261 -15.107
  135   HG12  VAL  20          2HG1      VAL  20  14.082   3.211 -14.607
  136   HG13  VAL  20          3HG1      VAL  20  15.026   2.817 -16.043
  137   HG21  VAL  20          3HG2      VAL  20  13.116   5.276 -14.419
  138   HG22  VAL  20          1HG2      VAL  20  12.888   6.360 -15.791
  139   HG23  VAL  20          2HG2      VAL  20  11.756   5.036 -15.515
  140    HA   PRO  21           HA       PRO  21  16.953   2.088 -18.445
  141    HB2  PRO  21           2HB      PRO  21  15.883   0.901 -20.640
  142    HB3  PRO  21           3HB      PRO  21  15.389   0.495 -18.992
  143    HG2  PRO  21           2HG      PRO  21  14.058   2.296 -20.978
  144    HG3  PRO  21           3HG      PRO  21  13.332   1.095 -19.895
  145    HD2  PRO  21           2HD      PRO  21  13.316   3.747 -19.349
  146    HD3  PRO  21           3HD      PRO  21  13.395   2.511 -18.078
  147    H    VAL  22           H        VAL  22  15.595   4.451 -20.595
  148    HA   VAL  22           HA       VAL  22  17.875   4.225 -22.425
  149    HB   VAL  22           HB       VAL  22  15.403   5.938 -22.702
  150   HG11  VAL  22          1HG1      VAL  22  17.022   6.933 -24.040
  151   HG12  VAL  22          2HG1      VAL  22  17.757   5.387 -24.470
  152   HG13  VAL  22          3HG1      VAL  22  16.197   5.845 -25.155
  153   HG21  VAL  22          3HG2      VAL  22  14.951   3.486 -22.704
  154   HG22  VAL  22          1HG2      VAL  22  14.553   4.291 -24.222
  155   HG23  VAL  22          2HG2      VAL  22  16.030   3.337 -24.091
  156    H    GLU  23           H        GLU  23  16.859   5.978 -19.737
  157    HA   GLU  23           HA       GLU  23  17.737   8.570 -20.251
  158    HB2  GLU  23           2HB      GLU  23  16.806   8.674 -18.213
  159    HB3  GLU  23           3HB      GLU  23  17.101   6.969 -17.905
  160    HG2  GLU  23           2HG      GLU  23  19.331   7.430 -17.154
  161    HG3  GLU  23           3HG      GLU  23  19.177   9.126 -17.612
  162    H    ASP  24           H        ASP  24  19.530   5.671 -19.837
  163    HA   ASP  24           HA       ASP  24  22.031   7.229 -19.740
  164    HB2  ASP  24           2HB      ASP  24  21.466   5.748 -17.720
  165    HB3  ASP  24           3HB      ASP  24  21.780   4.382 -18.787
  166    H    HIS  25           H        HIS  25  20.094   5.335 -21.644
  167    HA   HIS  25           HA       HIS  25  22.236   3.977 -23.065
  168    HB2  HIS  25           2HB      HIS  25  19.966   2.937 -22.649
  169    HB3  HIS  25           3HB      HIS  25  19.311   4.087 -23.811
  170    HD1  HIS  25           HD1      HIS  25  18.678   1.687 -24.994
  171    HD2  HIS  25           HD2      HIS  25  22.661   2.869 -25.065
  172    HE1  HIS  25           HE1      HIS  25  19.751   0.326 -26.816
  Start of MODEL   17
    1    H1   THR   1           H        THR   1   0.891  -0.842  -0.100
    2    HA   THR   1           HA       THR   1   1.649   1.734  -1.209
    3    HB   THR   1           HB       THR   1   3.025  -0.915  -1.658
    4    HG1  THR   1           HG1      THR   1   4.392  -0.135   0.115
    5   HG21  THR   1          3HG2      THR   1   3.800   0.739  -3.185
    6   HG22  THR   1          1HG2      THR   1   5.014   0.617  -1.912
    7   HG23  THR   1          2HG2      THR   1   3.877   1.965  -1.919
    8    H    GLY   2           H        GLY   2   0.381  -1.364  -2.289
    9    HA2  GLY   2           2HA      GLY   2   0.703  -0.910  -5.072
   10    HA3  GLY   2           3HA      GLY   2  -0.385  -2.077  -4.336
   11    H    ASN   3           H        ASN   3  -1.652   0.171  -2.772
   12    HA   ASN   3           HA       ASN   3  -3.351   1.159  -4.963
   13    HB2  ASN   3           2HB      ASN   3  -3.988   0.612  -2.059
   14    HB3  ASN   3           3HB      ASN   3  -5.092   1.432  -3.159
   15   HD21  ASN   3          1HD2      ASN   3  -6.551   0.188  -4.060
   16   HD22  ASN   3          2HD2      ASN   3  -6.404  -1.506  -4.365
   17    H    VAL   4           H        VAL   4  -0.987   2.132  -2.863
   18    HA   VAL   4           HA       VAL   4  -2.050   4.860  -2.604
   19    HB   VAL   4           HB       VAL   4   0.405   3.727  -1.262
   20   HG11  VAL   4          1HG1      VAL   4  -0.434   5.707   0.332
   21   HG12  VAL   4          2HG1      VAL   4   0.695   5.959  -1.001
   22   HG13  VAL   4          3HG1      VAL   4  -1.019   6.318  -1.215
   23   HG21  VAL   4          3HG2      VAL   4  -2.454   3.482  -0.591
   24   HG22  VAL   4          1HG2      VAL   4  -1.089   2.461  -0.141
   25   HG23  VAL   4          2HG2      VAL   4  -1.395   3.961   0.735
   26    H    GLY   5           H        GLY   5   0.040   3.002  -4.478
   27    HA2  GLY   5           2HA      GLY   5   1.783   5.268  -5.134
   28    HA3  GLY   5           3HA      GLY   5   2.036   3.599  -5.620
   29    H    LEU   6           H        LEU   6  -1.126   4.936  -5.966
   30    HA   LEU   6           HA       LEU   6  -0.986   4.599  -8.828
   31    HB2  LEU   6           2HB      LEU   6  -3.136   5.207  -6.853
   32    HB3  LEU   6           3HB      LEU   6  -3.417   5.546  -8.559
   33    HG   LEU   6           HG       LEU   6  -4.354   3.391  -7.910
   34   HD11  LEU   6          1HD1      LEU   6  -3.380   3.795 -10.191
   35   HD12  LEU   6          2HD1      LEU   6  -3.492   2.104  -9.704
   36   HD13  LEU   6          3HD1      LEU   6  -1.939   2.937  -9.646
   37   HD21  LEU   6          3HD2      LEU   6  -2.631   2.991  -6.102
   38   HD22  LEU   6          1HD2      LEU   6  -1.545   2.454  -7.384
   39   HD23  LEU   6          2HD2      LEU   6  -3.057   1.594  -7.092
   40    H    SER   7           H        SER   7  -0.170   7.059  -6.775
   41    HA   SER   7           HA       SER   7  -0.694   9.099  -8.838
   42    HB2  SER   7           2HB      SER   7  -1.206   9.119  -5.968
   43    HB3  SER   7           3HB      SER   7  -0.226  10.493  -6.480
   44    HG   SER   7           HG       SER   7  -2.821  10.217  -6.722
   45    HA   PRO   8           HA       PRO   8   3.616  10.230  -7.032
   46    HB2  PRO   8           2HB      PRO   8   4.564   8.758  -4.958
   47    HB3  PRO   8           3HB      PRO   8   3.558  10.194  -4.735
   48    HG2  PRO   8           2HG      PRO   8   2.777   7.305  -4.670
   49    HG3  PRO   8           3HG      PRO   8   2.280   8.622  -3.593
   50    HD2  PRO   8           2HD      PRO   8   0.711   7.716  -5.605
   51    HD3  PRO   8           3HD      PRO   8   0.704   9.411  -5.078
   52    H    GLY   9           H        GLY   9   2.523   7.107  -7.729
   53    HA2  GLY   9           2HA      GLY   9   5.235   6.309  -8.595
   54    HA3  GLY   9           3HA      GLY   9   4.045   5.159  -8.003
   55    H    LEU  10           H        LEU  10   2.038   6.975  -9.559
   56    HA   LEU  10           HA       LEU  10   2.066   5.341 -11.930
   57    HB2  LEU  10           2HB      LEU  10  -0.027   5.885 -10.802
   58    HB3  LEU  10           3HB      LEU  10   0.246   7.600 -11.107
   59    HG   LEU  10           HG       LEU  10   0.283   6.721 -13.629
   60   HD11  LEU  10          1HD1      LEU  10  -0.286   4.385 -12.434
   61   HD12  LEU  10          2HD1      LEU  10  -0.837   4.811 -14.054
   62   HD13  LEU  10          3HD1      LEU  10  -1.919   5.008 -12.675
   63   HD21  LEU  10          3HD2      LEU  10  -1.926   7.606 -11.838
   64   HD22  LEU  10          1HD2      LEU  10  -2.312   7.111 -13.487
   65   HD23  LEU  10          2HD2      LEU  10  -1.179   8.433 -13.206
   66    H    SER  11           H        SER  11   2.579   8.748 -11.146
   67    HA   SER  11           HA       SER  11   2.961   9.515 -13.890
   68    HB2  SER  11           2HB      SER  11   2.173  10.967 -11.854
   69    HB3  SER  11           3HB      SER  11   3.902  11.178 -11.577
   70    HG   SER  11           HG       SER  11   2.348  11.973 -13.789
   71    H    THR  12           H        THR  12   4.914   8.196 -11.407
   72    HA   THR  12           HA       THR  12   7.418   9.137 -12.526
   73    HB   THR  12           HB       THR  12   6.936   7.125 -10.320
   74    HG1  THR  12           HG1      THR  12   6.371   9.578 -10.184
   75   HG21  THR  12          3HG2      THR  12   9.387   8.192  -9.865
   76   HG22  THR  12          1HG2      THR  12   9.357   8.173 -11.627
   77   HG23  THR  12          2HG2      THR  12   9.112   6.677 -10.725
   78    H    ALA  13           H        ALA  13   5.322   6.420 -12.826
   79    HA   ALA  13           HA       ALA  13   7.387   4.739 -14.013
   80    HB1  ALA  13           1HB      ALA  13   6.043   3.385 -12.747
   81    HB2  ALA  13           2HB      ALA  13   4.583   4.307 -13.109
   82    HB3  ALA  13           3HB      ALA  13   5.264   3.221 -14.321
   83    H    LEU  14           H        LEU  14   4.548   6.593 -14.934
   84    HA   LEU  14           HA       LEU  14   4.509   5.655 -17.641
   85    HB2  LEU  14           2HB      LEU  14   2.909   7.348 -15.958
   86    HB3  LEU  14           3HB      LEU  14   3.200   8.133 -17.509
   87    HG   LEU  14           HG       LEU  14   1.103   6.917 -17.545
   88   HD11  LEU  14          1HD1      LEU  14   1.611   6.684 -19.693
   89   HD12  LEU  14          2HD1      LEU  14   2.183   5.060 -19.310
   90   HD13  LEU  14          3HD1      LEU  14   3.315   6.413 -19.328
   91   HD21  LEU  14          3HD2      LEU  14   2.771   4.791 -16.374
   92   HD22  LEU  14          1HD2      LEU  14   1.598   4.267 -17.582
   93   HD23  LEU  14          2HD2      LEU  14   1.057   5.146 -16.152
   94    H    THR  15           H        THR  15   6.451   7.823 -15.953
   95    HA   THR  15           HA       THR  15   7.068   9.426 -18.326
   96    HB   THR  15           HB       THR  15   7.995   9.741 -15.465
   97    HG1  THR  15           HG1      THR  15   5.974  10.942 -17.034
   98   HG21  THR  15          3HG2      THR  15   9.061  10.798 -17.904
   99   HG22  THR  15          1HG2      THR  15   9.600  11.073 -16.248
  100   HG23  THR  15          2HG2      THR  15   8.360  12.109 -16.955
  101    H    GLY  16           H        GLY  16   8.493   7.097 -16.107
  102    HA2  GLY  16           2HA      GLY  16  10.995   7.167 -17.655
  103    HA3  GLY  16           3HA      GLY  16  10.812   6.484 -16.046
  104    H    PHE  17           H        PHE  17   8.145   5.428 -17.472
  105    HA   PHE  17           HA       PHE  17   8.492   2.816 -17.514
  106    HB2  PHE  17           2HB      PHE  17   6.928   2.607 -19.401
  107    HB3  PHE  17           3HB      PHE  17   6.419   3.867 -18.283
  108    HD1  PHE  17           HD2      PHE  17   7.553   6.259 -18.927
  109    HD2  PHE  17           HD1      PHE  17   6.641   3.086 -21.614
  110    HE1  PHE  17           HE2      PHE  17   7.452   7.867 -20.786
  111    HE2  PHE  17           HE1      PHE  17   6.540   4.690 -23.478
  112    HZ   PHE  17           HZ       PHE  17   6.944   7.084 -23.065
  113    H    THR  18           H        THR  18   9.400   4.787 -20.342
  114    HA   THR  18           HA       THR  18  11.233   2.621 -21.142
  115    HB   THR  18           HB       THR  18  10.023   4.695 -22.976
  116    HG1  THR  18           HG1      THR  18   9.264   1.974 -22.576
  117   HG21  THR  18          3HG2      THR  18  10.757   3.074 -24.729
  118   HG22  THR  18          1HG2      THR  18  11.592   2.165 -23.470
  119   HG23  THR  18          2HG2      THR  18  12.086   3.817 -23.839
  120    H    LEU  19           H        LEU  19  10.994   5.833 -20.093
  121    HA   LEU  19           HA       LEU  19  13.429   6.768 -21.333
  122    HB2  LEU  19           2HB      LEU  19  11.399   7.894 -19.476
  123    HB3  LEU  19           3HB      LEU  19  13.002   8.627 -19.498
  124    HG   LEU  19           HG       LEU  19  11.534   9.881 -20.929
  125   HD11  LEU  19          1HD1      LEU  19  13.932   8.646 -21.793
  126   HD12  LEU  19          2HD1      LEU  19  13.258  10.201 -22.281
  127   HD13  LEU  19          3HD1      LEU  19  12.842   8.739 -23.177
  128   HD21  LEU  19          3HD2      LEU  19  10.141   9.016 -22.528
  129   HD22  LEU  19          1HD2      LEU  19  10.106   7.713 -21.339
  130   HD23  LEU  19          2HD2      LEU  19  11.129   7.574 -22.769
  131    H    VAL  20           H        VAL  20  12.623   4.924 -18.612
  132    HA   VAL  20           HA       VAL  20  14.783   5.731 -16.910
  133    HB   VAL  20           HB       VAL  20  12.870   3.415 -16.876
  134   HG11  VAL  20          1HG1      VAL  20  14.598   2.250 -15.960
  135   HG12  VAL  20          2HG1      VAL  20  15.435   3.705 -15.414
  136   HG13  VAL  20          3HG1      VAL  20  14.044   3.096 -14.515
  137   HG21  VAL  20          3HG2      VAL  20  12.878   6.032 -15.816
  138   HG22  VAL  20          1HG2      VAL  20  11.681   4.759 -15.569
  139   HG23  VAL  20          2HG2      VAL  20  13.040   4.921 -14.456
  140    HA   PRO  21           HA       PRO  21  16.750   1.602 -18.500
  141    HB2  PRO  21           2HB      PRO  21  15.633   0.480 -20.706
  142    HB3  PRO  21           3HB      PRO  21  15.119   0.084 -19.062
  143    HG2  PRO  21           2HG      PRO  21  13.873   1.957 -21.037
  144    HG3  PRO  21           3HG      PRO  21  13.092   0.781 -19.964
  145    HD2  PRO  21           2HD      PRO  21  13.192   3.427 -19.398
  146    HD3  PRO  21           3HD      PRO  21  13.214   2.179 -18.136
  147    H    VAL  22           H        VAL  22  15.499   4.033 -20.641
  148    HA   VAL  22           HA       VAL  22  17.768   3.721 -22.470
  149    HB   VAL  22           HB       VAL  22  15.379   5.552 -22.727
  150   HG11  VAL  22          1HG1      VAL  22  16.724   6.538 -24.228
  151   HG12  VAL  22          2HG1      VAL  22  17.836   5.168 -24.278
  152   HG13  VAL  22          3HG1      VAL  22  16.354   5.138 -25.235
  153   HG21  VAL  22          3HG2      VAL  22  14.450   3.962 -24.261
  154   HG22  VAL  22          1HG2      VAL  22  15.884   2.942 -24.147
  155   HG23  VAL  22          2HG2      VAL  22  14.816   3.121 -22.755
  156    H    GLU  23           H        GLU  23  16.840   5.494 -19.763
  157    HA   GLU  23           HA       GLU  23  17.856   8.043 -20.265
  158    HB2  GLU  23           2HB      GLU  23  16.898   8.192 -18.242
  159    HB3  GLU  23           3HB      GLU  23  17.104   6.474 -17.930
  160    HG2  GLU  23           2HG      GLU  23  19.347   6.827 -17.153
  161    HG3  GLU  23           3HG      GLU  23  19.277   8.529 -17.606
  162    H    ASP  24           H        ASP  24  19.479   5.049 -19.849
  163    HA   ASP  24           HA       ASP  24  22.049   6.398 -19.406
  164    HB2  ASP  24           2HB      ASP  24  21.223   3.506 -19.118
  165    HB3  ASP  24           3HB      ASP  24  22.892   4.056 -18.987
  166    H    HIS  25           H        HIS  25  20.161   5.278 -21.885
  167    HA   HIS  25           HA       HIS  25  20.518   4.731 -24.067
  168    HB2  HIS  25           2HB      HIS  25  22.207   6.867 -23.421
  169    HB3  HIS  25           3HB      HIS  25  23.220   5.747 -24.329
  170    HD1  HIS  25           HD1      HIS  25  21.724   4.824 -26.607
  171    HD2  HIS  25           HD2      HIS  25  21.076   8.640 -25.097
  172    HE1  HIS  25           HE1      HIS  25  20.680   6.124 -28.489
  Start of MODEL   18
    1    H1   THR   1           H        THR   1   0.632   0.060  -0.213
    2    HA   THR   1           HA       THR   1   1.765   1.330  -1.734
    3    HB   THR   1           HB       THR   1   3.154  -0.962  -3.012
    4    HG1  THR   1           HG1      THR   1   4.636  -0.808  -1.066
    5   HG21  THR   1          3HG2      THR   1   4.251   0.854  -3.740
    6   HG22  THR   1          1HG2      THR   1   5.007   0.874  -2.147
    7   HG23  THR   1          2HG2      THR   1   3.590   1.874  -2.462
    8    H    GLY   2           H        GLY   2   0.191  -1.605  -2.721
    9    HA2  GLY   2           2HA      GLY   2   0.081  -1.158  -5.500
   10    HA3  GLY   2           3HA      GLY   2  -1.044  -2.145  -4.579
   11    H    ASN   3           H        ASN   3  -1.799   0.149  -2.864
   12    HA   ASN   3           HA       ASN   3  -3.505   1.544  -4.819
   13    HB2  ASN   3           2HB      ASN   3  -4.580  -0.033  -3.100
   14    HB3  ASN   3           3HB      ASN   3  -4.169   1.190  -1.901
   15   HD21  ASN   3          1HD2      ASN   3  -6.054   2.063  -1.369
   16   HD22  ASN   3          2HD2      ASN   3  -7.190   2.744  -2.479
   17    H    VAL   4           H        VAL   4  -0.920   1.960  -2.797
   18    HA   VAL   4           HA       VAL   4  -1.584   4.753  -2.172
   19    HB   VAL   4           HB       VAL   4   0.782   3.173  -1.165
   20   HG11  VAL   4          1HG1      VAL   4   1.385   5.303  -0.689
   21   HG12  VAL   4          2HG1      VAL   4  -0.276   5.899  -0.724
   22   HG13  VAL   4          3HG1      VAL   4   0.325   5.042   0.696
   23   HG21  VAL   4          3HG2      VAL   4  -2.032   3.288  -0.231
   24   HG22  VAL   4          1HG2      VAL   4  -0.858   1.974  -0.139
   25   HG23  VAL   4          2HG2      VAL   4  -0.764   3.322   0.995
   26    H    GLY   5           H        GLY   5   0.108   2.881  -4.400
   27    HA2  GLY   5           2HA      GLY   5   1.939   5.108  -5.033
   28    HA3  GLY   5           3HA      GLY   5   2.218   3.430  -5.474
   29    H    LEU   6           H        LEU   6  -0.961   4.755  -5.818
   30    HA   LEU   6           HA       LEU   6  -0.847   4.323  -8.674
   31    HB2  LEU   6           2HB      LEU   6  -2.787   3.649  -7.269
   32    HB3  LEU   6           3HB      LEU   6  -3.127   5.357  -6.995
   33    HG   LEU   6           HG       LEU   6  -2.969   4.596  -9.824
   34   HD11  LEU   6          1HD1      LEU   6  -3.977   2.559  -8.921
   35   HD12  LEU   6          2HD1      LEU   6  -5.135   3.492  -9.868
   36   HD13  LEU   6          3HD1      LEU   6  -5.206   3.528  -8.107
   37   HD21  LEU   6          3HD2      LEU   6  -4.366   6.334 -10.045
   38   HD22  LEU   6          1HD2      LEU   6  -3.924   6.700  -8.377
   39   HD23  LEU   6          2HD2      LEU   6  -5.401   5.798  -8.720
   40    H    SER   7           H        SER   7  -0.063   6.849  -6.689
   41    HA   SER   7           HA       SER   7  -0.653   8.827  -8.794
   42    HB2  SER   7           2HB      SER   7  -1.134   8.905  -5.919
   43    HB3  SER   7           3HB      SER   7  -0.190  10.287  -6.476
   44    HG   SER   7           HG       SER   7  -2.443   9.535  -7.952
   45    HA   PRO   8           HA       PRO   8   3.650  10.093  -7.064
   46    HB2  PRO   8           2HB      PRO   8   4.653   8.691  -4.967
   47    HB3  PRO   8           3HB      PRO   8   3.618  10.110  -4.767
   48    HG2  PRO   8           2HG      PRO   8   2.900   7.207  -4.625
   49    HG3  PRO   8           3HG      PRO   8   2.387   8.539  -3.573
   50    HD2  PRO   8           2HD      PRO   8   0.816   7.552  -5.545
   51    HD3  PRO   8           3HD      PRO   8   0.778   9.259  -5.058
   52    H    GLY   9           H        GLY   9   2.617   6.931  -7.675
   53    HA2  GLY   9           2HA      GLY   9   5.336   6.171  -8.553
   54    HA3  GLY   9           3HA      GLY   9   4.178   5.010  -7.920
   55    H    LEU  10           H        LEU  10   2.115   6.745  -9.495
   56    HA   LEU  10           HA       LEU  10   2.152   5.056 -11.828
   57    HB2  LEU  10           2HB      LEU  10   0.042   5.505 -10.788
   58    HB3  LEU  10           3HB      LEU  10   0.294   7.245 -10.920
   59    HG   LEU  10           HG       LEU  10   0.341   5.918 -13.508
   60   HD11  LEU  10          1HD1      LEU  10  -1.222   4.404 -12.351
   61   HD12  LEU  10          2HD1      LEU  10  -2.003   5.351 -13.616
   62   HD13  LEU  10          3HD1      LEU  10  -2.220   5.794 -11.923
   63   HD21  LEU  10          3HD2      LEU  10  -0.563   7.865 -14.162
   64   HD22  LEU  10          1HD2      LEU  10  -0.103   8.421 -12.552
   65   HD23  LEU  10          2HD2      LEU  10  -1.751   7.870 -12.857
   66    H    SER  11           H        SER  11   2.599   8.491 -11.131
   67    HA   SER  11           HA       SER  11   2.937   9.200 -13.896
   68    HB2  SER  11           2HB      SER  11   2.206  10.651 -11.773
   69    HB3  SER  11           3HB      SER  11   3.936  10.993 -11.738
   70    HG   SER  11           HG       SER  11   2.737  12.486 -13.028
   71    H    THR  12           H        THR  12   4.944   7.983 -11.405
   72    HA   THR  12           HA       THR  12   7.415   8.948 -12.575
   73    HB   THR  12           HB       THR  12   6.972   7.002 -10.302
   74    HG1  THR  12           HG1      THR  12   6.318   8.974  -9.589
   75   HG21  THR  12          3HG2      THR  12   9.382   7.699  -9.782
   76   HG22  THR  12          1HG2      THR  12   9.446   8.267 -11.450
   77   HG23  THR  12          2HG2      THR  12   9.135   6.565 -11.110
   78    H    ALA  13           H        ALA  13   5.374   6.182 -12.786
   79    HA   ALA  13           HA       ALA  13   7.461   4.516 -13.956
   80    HB1  ALA  13           1HB      ALA  13   4.724   4.058 -12.925
   81    HB2  ALA  13           2HB      ALA  13   5.285   2.998 -14.220
   82    HB3  ALA  13           3HB      ALA  13   6.193   3.105 -12.712
   83    H    LEU  14           H        LEU  14   4.573   6.288 -14.889
   84    HA   LEU  14           HA       LEU  14   4.525   5.284 -17.572
   85    HB2  LEU  14           2HB      LEU  14   2.907   6.983 -15.911
   86    HB3  LEU  14           3HB      LEU  14   3.165   7.737 -17.483
   87    HG   LEU  14           HG       LEU  14   1.094   6.477 -17.467
   88   HD11  LEU  14          1HD1      LEU  14   2.192   4.602 -19.200
   89   HD12  LEU  14          2HD1      LEU  14   3.297   5.974 -19.262
   90   HD13  LEU  14          3HD1      LEU  14   1.585   6.205 -19.615
   91   HD21  LEU  14          3HD2      LEU  14   1.647   3.837 -17.447
   92   HD22  LEU  14          1HD2      LEU  14   1.100   4.739 -16.033
   93   HD23  LEU  14          2HD2      LEU  14   2.819   4.416 -16.262
   94    H    THR  15           H        THR  15   6.439   7.532 -15.959
   95    HA   THR  15           HA       THR  15   6.996   9.090 -18.376
   96    HB   THR  15           HB       THR  15   7.947   9.494 -15.534
   97    HG1  THR  15           HG1      THR  15   6.492  11.250 -15.598
   98   HG21  THR  15          3HG2      THR  15   9.514  10.840 -16.366
   99   HG22  THR  15          1HG2      THR  15   8.246  11.833 -17.084
  100   HG23  THR  15          2HG2      THR  15   8.963  10.514 -18.009
  101    H    GLY  16           H        GLY  16   8.493   6.846 -16.118
  102    HA2  GLY  16           2HA      GLY  16  10.977   6.930 -17.696
  103    HA3  GLY  16           3HA      GLY  16  10.826   6.283 -16.069
  104    H    PHE  17           H        PHE  17   8.167   5.138 -17.439
  105    HA   PHE  17           HA       PHE  17   8.568   2.533 -17.423
  106    HB2  PHE  17           2HB      PHE  17   6.989   2.246 -19.287
  107    HB3  PHE  17           3HB      PHE  17   6.465   3.522 -18.193
  108    HD1  PHE  17           HD2      PHE  17   7.541   5.920 -18.906
  109    HD2  PHE  17           HD1      PHE  17   6.668   2.666 -21.507
  110    HE1  PHE  17           HE2      PHE  17   7.386   7.481 -20.802
  111    HE2  PHE  17           HE1      PHE  17   6.512   4.221 -23.407
  112    HZ   PHE  17           HZ       PHE  17   6.870   6.632 -23.056
  113    H    THR  18           H        THR  18   9.403   4.453 -20.307
  114    HA   THR  18           HA       THR  18  11.273   2.308 -21.076
  115    HB   THR  18           HB       THR  18   9.999   4.312 -22.945
  116    HG1  THR  18           HG1      THR  18   8.632   2.584 -23.538
  117   HG21  THR  18          3HG2      THR  18  10.749   2.665 -24.667
  118   HG22  THR  18          1HG2      THR  18  11.615   1.803 -23.397
  119   HG23  THR  18          2HG2      THR  18  12.071   3.456 -23.810
  120    H    LEU  19           H        LEU  19  10.977   5.540 -20.102
  121    HA   LEU  19           HA       LEU  19  13.378   6.494 -21.392
  122    HB2  LEU  19           2HB      LEU  19  11.346   7.623 -19.539
  123    HB3  LEU  19           3HB      LEU  19  12.932   8.389 -19.598
  124    HG   LEU  19           HG       LEU  19  11.421   9.576 -21.041
  125   HD11  LEU  19          1HD1      LEU  19  13.122   9.899 -22.420
  126   HD12  LEU  19          2HD1      LEU  19  12.730   8.407 -23.275
  127   HD13  LEU  19          3HD1      LEU  19  13.836   8.371 -21.902
  128   HD21  LEU  19          3HD2      LEU  19  10.031   7.375 -21.382
  129   HD22  LEU  19          1HD2      LEU  19  11.046   7.212 -22.815
  130   HD23  LEU  19          2HD2      LEU  19  10.034   8.642 -22.610
  131    H    VAL  20           H        VAL  20  12.641   4.701 -18.618
  132    HA   VAL  20           HA       VAL  20  14.802   5.594 -16.961
  133    HB   VAL  20           HB       VAL  20  12.938   3.240 -16.849
  134   HG11  VAL  20          1HG1      VAL  20  15.388   3.734 -15.177
  135   HG12  VAL  20          2HG1      VAL  20  14.037   2.747 -14.615
  136   HG13  VAL  20          3HG1      VAL  20  14.937   2.273 -16.056
  137   HG21  VAL  20          3HG2      VAL  20  12.902   5.881 -15.853
  138   HG22  VAL  20          1HG2      VAL  20  11.737   4.590 -15.559
  139   HG23  VAL  20          2HG2      VAL  20  13.106   4.809 -14.467
  140    HA   PRO  21           HA       PRO  21  16.838   1.470 -18.473
  141    HB2  PRO  21           2HB      PRO  21  15.722   0.271 -20.638
  142    HB3  PRO  21           3HB      PRO  21  15.234  -0.095 -18.979
  143    HG2  PRO  21           2HG      PRO  21  13.927   1.702 -20.985
  144    HG3  PRO  21           3HG      PRO  21  13.183   0.536 -19.875
  145    HD2  PRO  21           2HD      PRO  21  13.233   3.197 -19.374
  146    HD3  PRO  21           3HD      PRO  21  13.295   1.981 -18.082
  147    H    VAL  22           H        VAL  22  15.513   3.821 -20.658
  148    HA   VAL  22           HA       VAL  22  17.768   3.512 -22.505
  149    HB   VAL  22           HB       VAL  22  15.337   5.285 -22.778
  150   HG11  VAL  22          1HG1      VAL  22  17.746   4.799 -24.432
  151   HG12  VAL  22          2HG1      VAL  22  16.204   4.952 -25.277
  152   HG13  VAL  22          3HG1      VAL  22  16.776   6.259 -24.240
  153   HG21  VAL  22          3HG2      VAL  22  14.426   3.639 -24.263
  154   HG22  VAL  22          1HG2      VAL  22  15.883   2.653 -24.140
  155   HG23  VAL  22          2HG2      VAL  22  14.826   2.843 -22.741
  156    H    GLU  23           H        GLU  23  16.832   5.331 -19.831
  157    HA   GLU  23           HA       GLU  23  17.787   7.888 -20.405
  158    HB2  GLU  23           2HB      GLU  23  16.851   8.066 -18.374
  159    HB3  GLU  23           3HB      GLU  23  17.094   6.361 -18.025
  160    HG2  GLU  23           2HG      GLU  23  19.341   6.777 -17.286
  161    HG3  GLU  23           3HG      GLU  23  19.227   8.467 -17.773
  162    H    ASP  24           H        ASP  24  19.479   4.941 -19.943
  163    HA   ASP  24           HA       ASP  24  21.983   6.084 -19.149
  164    HB2  ASP  24           2HB      ASP  24  21.194   3.683 -18.753
  165    HB3  ASP  24           3HB      ASP  24  21.608   3.385 -20.439
  166    H    HIS  25           H        HIS  25  20.306   6.150 -22.009
  167    HA   HIS  25           HA       HIS  25  20.831   6.606 -24.178
  168    HB2  HIS  25           2HB      HIS  25  22.290   8.318 -22.567
  169    HB3  HIS  25           3HB      HIS  25  23.503   7.672 -23.669
  170    HD1  HIS  25           HD1      HIS  25  20.052   9.263 -23.905
  171    HD2  HIS  25           HD2      HIS  25  23.626   9.018 -26.009
  172    HE1  HIS  25           HE1      HIS  25  19.770  10.783 -25.888
  Start of MODEL   19
    1    H1   THR   1           H        THR   1  -0.349   0.066  -0.043
    2    HA   THR   1           HA       THR   1   1.345   2.001  -0.751
    3    HB   THR   1           HB       THR   1   2.955  -0.558  -0.846
    4    HG1  THR   1           HG1      THR   1   3.192   1.760   0.799
    5   HG21  THR   1          3HG2      THR   1   3.832   0.594  -2.607
    6   HG22  THR   1          1HG2      THR   1   4.741   1.368  -1.310
    7   HG23  THR   1          2HG2      THR   1   3.316   2.160  -1.983
    8    H    GLY   2           H        GLY   2   0.258  -1.222  -1.560
    9    HA2  GLY   2           2HA      GLY   2   0.682  -1.180  -4.331
   10    HA3  GLY   2           3HA      GLY   2  -0.554  -2.120  -3.508
   11    H    ASN   3           H        ASN   3  -1.875   0.223  -2.380
   12    HA   ASN   3           HA       ASN   3  -3.231   1.123  -4.826
   13    HB2  ASN   3           2HB      ASN   3  -4.193   0.941  -1.966
   14    HB3  ASN   3           3HB      ASN   3  -5.123   1.683  -3.264
   15   HD21  ASN   3          1HD2      ASN   3  -6.046   0.400  -4.836
   16   HD22  ASN   3          2HD2      ASN   3  -6.176  -1.316  -4.678
   17    H    VAL   4           H        VAL   4  -1.025   2.172  -2.595
   18    HA   VAL   4           HA       VAL   4  -1.940   4.952  -2.599
   19    HB   VAL   4           HB       VAL   4   0.491   3.821  -1.214
   20   HG11  VAL   4          1HG1      VAL   4  -0.031   5.882   0.260
   21   HG12  VAL   4          2HG1      VAL   4   0.765   6.124  -1.296
   22   HG13  VAL   4          3HG1      VAL   4  -0.964   6.435  -1.130
   23   HG21  VAL   4          3HG2      VAL   4  -1.505   2.673  -0.414
   24   HG22  VAL   4          1HG2      VAL   4  -0.871   3.761   0.821
   25   HG23  VAL   4          2HG2      VAL   4  -2.291   4.223  -0.117
   26    H    GLY   5           H        GLY   5   0.057   2.902  -4.372
   27    HA2  GLY   5           2HA      GLY   5   1.899   5.033  -5.175
   28    HA3  GLY   5           3HA      GLY   5   2.031   3.334  -5.604
   29    H    LEU   6           H        LEU   6  -1.064   4.796  -5.933
   30    HA   LEU   6           HA       LEU   6  -0.956   4.423  -8.799
   31    HB2  LEU   6           2HB      LEU   6  -2.961   4.399  -6.805
   32    HB3  LEU   6           3HB      LEU   6  -3.374   5.677  -7.946
   33    HG   LEU   6           HG       LEU   6  -4.488   3.609  -8.542
   34   HD11  LEU   6          1HD1      LEU   6  -2.859   3.364 -10.789
   35   HD12  LEU   6          2HD1      LEU   6  -2.660   5.032 -10.254
   36   HD13  LEU   6          3HD1      LEU   6  -4.271   4.405 -10.602
   37   HD21  LEU   6          3HD2      LEU   6  -2.702   1.844  -9.500
   38   HD22  LEU   6          1HD2      LEU   6  -3.365   1.770  -7.868
   39   HD23  LEU   6          2HD2      LEU   6  -1.783   2.498  -8.144
   40    H    SER   7           H        SER   7  -0.141   6.889  -6.745
   41    HA   SER   7           HA       SER   7  -0.674   8.924  -8.810
   42    HB2  SER   7           2HB      SER   7  -1.184   8.946  -5.940
   43    HB3  SER   7           3HB      SER   7  -0.211  10.324  -6.455
   44    HG   SER   7           HG       SER   7  -2.611   9.546  -7.746
   45    HA   PRO   8           HA       PRO   8   3.632  10.075  -7.007
   46    HB2  PRO   8           2HB      PRO   8   4.587   8.609  -4.932
   47    HB3  PRO   8           3HB      PRO   8   3.575  10.041  -4.710
   48    HG2  PRO   8           2HG      PRO   8   2.805   7.149  -4.642
   49    HG3  PRO   8           3HG      PRO   8   2.304   8.465  -3.566
   50    HD2  PRO   8           2HD      PRO   8   0.737   7.551  -5.576
   51    HD3  PRO   8           3HD      PRO   8   0.724   9.247  -5.051
   52    H    GLY   9           H        GLY   9   2.551   6.947  -7.701
   53    HA2  GLY   9           2HA      GLY   9   5.266   6.158  -8.566
   54    HA3  GLY   9           3HA      GLY   9   4.080   5.005  -7.973
   55    H    LEU  10           H        LEU  10   2.066   6.810  -9.530
   56    HA   LEU  10           HA       LEU  10   2.099   5.174 -11.899
   57    HB2  LEU  10           2HB      LEU  10  -0.011   5.651 -10.851
   58    HB3  LEU  10           3HB      LEU  10   0.269   7.386 -10.985
   59    HG   LEU  10           HG       LEU  10   0.257   5.926 -13.539
   60   HD11  LEU  10          1HD1      LEU  10  -1.514   4.773 -12.184
   61   HD12  LEU  10          2HD1      LEU  10  -2.087   5.572 -13.647
   62   HD13  LEU  10          3HD1      LEU  10  -2.341   6.327 -12.073
   63   HD21  LEU  10          3HD2      LEU  10  -1.022   8.448 -12.495
   64   HD22  LEU  10          1HD2      LEU  10  -1.157   7.874 -14.157
   65   HD23  LEU  10          2HD2      LEU  10   0.419   8.320 -13.504
   66    H    SER  11           H        SER  11   2.598   8.584 -11.120
   67    HA   SER  11           HA       SER  11   2.978   9.349 -13.865
   68    HB2  SER  11           2HB      SER  11   2.193  10.796 -11.814
   69    HB3  SER  11           3HB      SER  11   3.924  11.026 -11.568
   70    HG   SER  11           HG       SER  11   2.301  11.844 -13.708
   71    H    THR  12           H        THR  12   4.936   8.041 -11.380
   72    HA   THR  12           HA       THR  12   7.436   8.989 -12.502
   73    HB   THR  12           HB       THR  12   6.935   7.000 -10.279
   74    HG1  THR  12           HG1      THR  12   7.876   9.663 -10.019
   75   HG21  THR  12          3HG2      THR  12   9.429   8.192 -11.435
   76   HG22  THR  12          1HG2      THR  12   9.095   6.518 -10.994
   77   HG23  THR  12          2HG2      THR  12   9.367   7.723  -9.736
   78    H    ALA  13           H        ALA  13   5.350   6.264 -12.798
   79    HA   ALA  13           HA       ALA  13   7.421   4.589 -13.983
   80    HB1  ALA  13           1HB      ALA  13   4.551   4.122 -13.242
   81    HB2  ALA  13           2HB      ALA  13   5.451   2.977 -14.238
   82    HB3  ALA  13           3HB      ALA  13   6.000   3.346 -12.603
   83    H    LEU  14           H        LEU  14   4.574   6.432 -14.906
   84    HA   LEU  14           HA       LEU  14   4.538   5.491 -17.612
   85    HB2  LEU  14           2HB      LEU  14   2.932   7.179 -15.930
   86    HB3  LEU  14           3HB      LEU  14   3.220   7.964 -17.481
   87    HG   LEU  14           HG       LEU  14   1.127   6.741 -17.516
   88   HD11  LEU  14          1HD1      LEU  14   3.341   6.240 -19.299
   89   HD12  LEU  14          2HD1      LEU  14   1.638   6.511 -19.664
   90   HD13  LEU  14          3HD1      LEU  14   2.209   4.887 -19.281
   91   HD21  LEU  14          3HD2      LEU  14   1.635   4.092 -17.552
   92   HD22  LEU  14          1HD2      LEU  14   1.087   4.970 -16.124
   93   HD23  LEU  14          2HD2      LEU  14   2.803   4.623 -16.341
   94    H    THR  15           H        THR  15   6.473   7.667 -15.928
   95    HA   THR  15           HA       THR  15   7.083   9.270 -18.302
   96    HB   THR  15           HB       THR  15   8.010   9.592 -15.442
   97    HG1  THR  15           HG1      THR  15   6.306  10.832 -15.240
   98   HG21  THR  15          3HG2      THR  15   8.366  11.959 -16.936
   99   HG22  THR  15          1HG2      THR  15   9.071  10.650 -17.883
  100   HG23  THR  15          2HG2      THR  15   9.609  10.929 -16.226
  101    H    GLY  16           H        GLY  16   8.517   6.949 -16.081
  102    HA2  GLY  16           2HA      GLY  16  11.018   7.026 -17.630
  103    HA3  GLY  16           3HA      GLY  16  10.839   6.344 -16.020
  104    H    PHE  17           H        PHE  17   8.175   5.277 -17.444
  105    HA   PHE  17           HA       PHE  17   8.531   2.666 -17.483
  106    HB2  PHE  17           2HB      PHE  17   6.967   2.449 -19.370
  107    HB3  PHE  17           3HB      PHE  17   6.454   3.709 -18.252
  108    HD1  PHE  17           HD2      PHE  17   7.579   6.104 -18.900
  109    HD2  PHE  17           HD1      PHE  17   6.678   2.925 -21.583
  110    HE1  PHE  17           HE2      PHE  17   7.472   7.710 -20.760
  111    HE2  PHE  17           HE1      PHE  17   6.570   4.526 -23.448
  112    HZ   PHE  17           HZ       PHE  17   6.966   6.922 -23.038
  113    H    THR  18           H        THR  18   9.430   4.637 -20.314
  114    HA   THR  18           HA       THR  18  11.272   2.477 -21.112
  115    HB   THR  18           HB       THR  18  10.053   4.545 -22.948
  116    HG1  THR  18           HG1      THR  18   8.625   2.911 -23.564
  117   HG21  THR  18          3HG2      THR  18  12.119   3.672 -23.810
  118   HG22  THR  18          1HG2      THR  18  10.793   2.925 -24.700
  119   HG23  THR  18          2HG2      THR  18  11.630   2.019 -23.440
  120    H    LEU  19           H        LEU  19  11.021   5.690 -20.067
  121    HA   LEU  19           HA       LEU  19  13.452   6.632 -21.310
  122    HB2  LEU  19           2HB      LEU  19  11.419   7.753 -19.453
  123    HB3  LEU  19           3HB      LEU  19  13.019   8.492 -19.477
  124    HG   LEU  19           HG       LEU  19  11.545   9.738 -20.909
  125   HD11  LEU  19          1HD1      LEU  19  13.267  10.063 -22.262
  126   HD12  LEU  19          2HD1      LEU  19  12.858   8.598 -23.155
  127   HD13  LEU  19          3HD1      LEU  19  13.948   8.511 -21.771
  128   HD21  LEU  19          3HD2      LEU  19  10.159   8.864 -22.512
  129   HD22  LEU  19          1HD2      LEU  19  10.122   7.569 -21.315
  130   HD23  LEU  19          2HD2      LEU  19  11.149   7.422 -22.741
  131    H    VAL  20           H        VAL  20  12.654   4.789 -18.585
  132    HA   VAL  20           HA       VAL  20  14.812   5.606 -16.886
  133    HB   VAL  20           HB       VAL  20  12.906   3.284 -16.847
  134   HG11  VAL  20          1HG1      VAL  20  14.051   2.912 -14.511
  135   HG12  VAL  20          2HG1      VAL  20  14.698   2.153 -15.968
  136   HG13  VAL  20          3HG1      VAL  20  15.446   3.617 -15.327
  137   HG21  VAL  20          3HG2      VAL  20  11.715   4.625 -15.535
  138   HG22  VAL  20          1HG2      VAL  20  13.079   4.797 -14.430
  139   HG23  VAL  20          2HG2      VAL  20  12.903   5.902 -15.794
  140    HA   PRO  21           HA       PRO  21  16.792   1.481 -18.470
  141    HB2  PRO  21           2HB      PRO  21  15.678   0.352 -20.673
  142    HB3  PRO  21           3HB      PRO  21  15.166  -0.043 -19.028
  143    HG2  PRO  21           2HG      PRO  21  13.912   1.822 -21.006
  144    HG3  PRO  21           3HG      PRO  21  13.136   0.645 -19.931
  145    HD2  PRO  21           2HD      PRO  21  13.227   3.292 -19.369
  146    HD3  PRO  21           3HD      PRO  21  13.254   2.047 -18.105
  147    H    VAL  22           H        VAL  22  15.532   3.905 -20.614
  148    HA   VAL  22           HA       VAL  22  17.801   3.597 -22.444
  149    HB   VAL  22           HB       VAL  22  15.405   5.419 -22.702
  150   HG11  VAL  22          1HG1      VAL  22  17.877   5.110 -24.206
  151   HG12  VAL  22          2HG1      VAL  22  16.436   4.942 -25.210
  152   HG13  VAL  22          3HG1      VAL  22  16.678   6.402 -24.251
  153   HG21  VAL  22          3HG2      VAL  22  14.851   2.986 -22.727
  154   HG22  VAL  22          1HG2      VAL  22  14.482   3.825 -24.234
  155   HG23  VAL  22          2HG2      VAL  22  15.918   2.808 -24.119
  156    H    GLU  23           H        GLU  23  16.868   5.372 -19.739
  157    HA   GLU  23           HA       GLU  23  17.873   7.924 -20.245
  158    HB2  GLU  23           2HB      GLU  23  16.919   8.073 -18.220
  159    HB3  GLU  23           3HB      GLU  23  17.129   6.356 -17.908
  160    HG2  GLU  23           2HG      GLU  23  19.374   6.716 -17.137
  161    HG3  GLU  23           3HG      GLU  23  19.295   8.419 -17.586
  162    H    ASP  24           H        ASP  24  19.509   4.938 -19.833
  163    HA   ASP  24           HA       ASP  24  22.023   6.019 -18.987
  164    HB2  ASP  24           2HB      ASP  24  21.247   3.333 -20.134
  165    HB3  ASP  24           3HB      ASP  24  22.882   3.732 -19.614
  166    H    HIS  25           H        HIS  25  20.379   6.180 -21.862
  167    HA   HIS  25           HA       HIS  25  22.316   5.704 -23.815
  168    HB2  HIS  25           2HB      HIS  25  19.893   6.115 -24.251
  169    HB3  HIS  25           3HB      HIS  25  20.156   7.821 -23.898
  170    HD1  HIS  25           HD1      HIS  25  20.443   9.177 -25.932
  171    HD2  HIS  25           HD2      HIS  25  21.803   5.290 -26.479
  172    HE1  HIS  25           HE1      HIS  25  21.224   9.068 -28.320
  Start of MODEL   20
    1    H1   THR   1           H        THR   1   1.977  -0.262  -0.325
    2    HA   THR   1           HA       THR   1   1.998   2.021  -1.963
    3    HB   THR   1           HB       THR   1   3.610  -0.300  -2.855
    4    HG1  THR   1           HG1      THR   1   4.008   0.943  -0.318
    5   HG21  THR   1          3HG2      THR   1   3.687   2.460  -3.143
    6   HG22  THR   1          1HG2      THR   1   4.958   1.324  -3.592
    7   HG23  THR   1          2HG2      THR   1   4.993   2.107  -2.012
    8    H    GLY   2           H        GLY   2   0.726  -1.179  -2.452
    9    HA2  GLY   2           2HA      GLY   2   0.621  -1.206  -5.267
   10    HA3  GLY   2           3HA      GLY   2  -0.421  -2.132  -4.197
   11    H    ASN   3           H        ASN   3  -1.662   0.023  -2.860
   12    HA   ASN   3           HA       ASN   3  -3.298   1.100  -5.056
   13    HB2  ASN   3           2HB      ASN   3  -4.014   0.453  -2.192
   14    HB3  ASN   3           3HB      ASN   3  -5.084   1.319  -3.290
   15   HD21  ASN   3          1HD2      ASN   3  -4.902   0.038  -5.603
   16   HD22  ASN   3          2HD2      ASN   3  -5.384  -1.614  -5.450
   17    H    VAL   4           H        VAL   4  -0.984   1.981  -2.862
   18    HA   VAL   4           HA       VAL   4  -2.046   4.693  -2.489
   19    HB   VAL   4           HB       VAL   4   0.432   3.512  -1.235
   20   HG11  VAL   4          1HG1      VAL   4  -0.482   5.426   0.452
   21   HG12  VAL   4          2HG1      VAL   4   0.739   5.697  -0.793
   22   HG13  VAL   4          3HG1      VAL   4  -0.949   6.103  -1.107
   23   HG21  VAL   4          3HG2      VAL   4  -2.434   3.427  -0.378
   24   HG22  VAL   4          1HG2      VAL   4  -1.219   2.148  -0.353
   25   HG23  VAL   4          2HG2      VAL   4  -1.145   3.459   0.825
   26    H    GLY   5           H        GLY   5   0.031   2.942  -4.478
   27    HA2  GLY   5           2HA      GLY   5   1.708   5.283  -5.069
   28    HA3  GLY   5           3HA      GLY   5   2.042   3.632  -5.570
   29    H    LEU   6           H        LEU   6  -1.151   4.964  -5.908
   30    HA   LEU   6           HA       LEU   6  -1.017   4.587  -8.770
   31    HB2  LEU   6           2HB      LEU   6  -3.156   5.138  -6.779
   32    HB3  LEU   6           3HB      LEU   6  -3.458   5.556  -8.464
   33    HG   LEU   6           HG       LEU   6  -4.362   3.346  -7.806
   34   HD11  LEU   6          1HD1      LEU   6  -4.174   3.075 -10.004
   35   HD12  LEU   6          2HD1      LEU   6  -2.667   2.216  -9.686
   36   HD13  LEU   6          3HD1      LEU   6  -2.638   3.940 -10.052
   37   HD21  LEU   6          3HD2      LEU   6  -2.957   1.521  -7.276
   38   HD22  LEU   6          1HD2      LEU   6  -2.450   2.849  -6.230
   39   HD23  LEU   6          2HD2      LEU   6  -1.498   2.438  -7.657
   40    H    SER   7           H        SER   7  -0.217   7.065  -6.732
   41    HA   SER   7           HA       SER   7  -0.760   9.089  -8.807
   42    HB2  SER   7           2HB      SER   7  -1.267   9.122  -5.936
   43    HB3  SER   7           3HB      SER   7  -0.300  10.501  -6.458
   44    HG   SER   7           HG       SER   7  -2.371  11.128  -6.753
   45    HA   PRO   8           HA       PRO   8   3.543  10.264  -7.013
   46    HB2  PRO   8           2HB      PRO   8   4.506   8.811  -4.932
   47    HB3  PRO   8           3HB      PRO   8   3.489  10.241  -4.716
   48    HG2  PRO   8           2HG      PRO   8   2.730   7.346  -4.633
   49    HG3  PRO   8           3HG      PRO   8   2.225   8.666  -3.563
   50    HD2  PRO   8           2HD      PRO   8   0.660   7.736  -5.567
   51    HD3  PRO   8           3HD      PRO   8   0.640   9.434  -5.050
   52    H    GLY   9           H        GLY   9   2.473   7.128  -7.691
   53    HA2  GLY   9           2HA      GLY   9   5.190   6.346  -8.555
   54    HA3  GLY   9           3HA      GLY   9   4.010   5.191  -7.955
   55    H    LEU  10           H        LEU  10   1.987   6.982  -9.519
   56    HA   LEU  10           HA       LEU  10   2.025   5.334 -11.881
   57    HB2  LEU  10           2HB      LEU  10  -0.066   5.893 -10.726
   58    HB3  LEU  10           3HB      LEU  10   0.188   7.596 -11.102
   59    HG   LEU  10           HG       LEU  10   0.250   6.453 -13.585
   60   HD11  LEU  10          1HD1      LEU  10  -0.486   4.312 -12.348
   61   HD12  LEU  10          2HD1      LEU  10  -1.351   4.790 -13.808
   62   HD13  LEU  10          3HD1      LEU  10  -2.053   5.112 -12.222
   63   HD21  LEU  10          3HD2      LEU  10  -2.334   7.315 -12.339
   64   HD22  LEU  10          1HD2      LEU  10  -1.719   7.624 -13.963
   65   HD23  LEU  10          2HD2      LEU  10  -1.017   8.464 -12.580
   66    H    SER  11           H        SER  11   2.512   8.750 -11.117
   67    HA   SER  11           HA       SER  11   2.885   9.504 -13.866
   68    HB2  SER  11           2HB      SER  11   2.760  10.856 -11.271
   69    HB3  SER  11           3HB      SER  11   3.962  11.551 -12.358
   70    HG   SER  11           HG       SER  11   1.378  11.952 -12.402
   71    H    THR  12           H        THR  12   4.851   8.215 -11.378
   72    HA   THR  12           HA       THR  12   7.346   9.168 -12.506
   73    HB   THR  12           HB       THR  12   6.913   7.142 -10.303
   74    HG1  THR  12           HG1      THR  12   7.044   8.843  -8.911
   75   HG21  THR  12          3HG2      THR  12   9.114   6.824 -10.468
   76   HG22  THR  12          1HG2      THR  12   9.333   8.499  -9.964
   77   HG23  THR  12          2HG2      THR  12   9.264   8.096 -11.680
   78    H    ALA  13           H        ALA  13   5.271   6.434 -12.787
   79    HA   ALA  13           HA       ALA  13   7.348   4.762 -13.967
   80    HB1  ALA  13           1HB      ALA  13   4.477   4.284 -13.233
   81    HB2  ALA  13           2HB      ALA  13   5.394   3.135 -14.208
   82    HB3  ALA  13           3HB      ALA  13   5.927   3.527 -12.573
   83    H    LEU  14           H        LEU  14   4.493   6.589 -14.895
   84    HA   LEU  14           HA       LEU  14   4.458   5.635 -17.597
   85    HB2  LEU  14           2HB      LEU  14   2.846   7.325 -15.921
   86    HB3  LEU  14           3HB      LEU  14   3.129   8.103 -17.477
   87    HG   LEU  14           HG       LEU  14   1.042   6.871 -17.503
   88   HD11  LEU  14          1HD1      LEU  14   1.549   6.629 -19.651
   89   HD12  LEU  14          2HD1      LEU  14   2.134   5.013 -19.259
   90   HD13  LEU  14          3HD1      LEU  14   3.256   6.373 -19.286
   91   HD21  LEU  14          3HD2      LEU  14   2.728   4.764 -16.322
   92   HD22  LEU  14          1HD2      LEU  14   1.558   4.225 -17.526
   93   HD23  LEU  14          2HD2      LEU  14   1.012   5.107 -16.100
   94    H    THR  15           H        THR  15   6.385   7.827 -15.924
   95    HA   THR  15           HA       THR  15   6.986   9.422 -18.307
   96    HB   THR  15           HB       THR  15   7.915   9.761 -15.449
   97    HG1  THR  15           HG1      THR  15   6.255  11.080 -15.258
   98   HG21  THR  15          3HG2      THR  15   8.259  12.122 -16.954
   99   HG22  THR  15          1HG2      THR  15   8.969  10.812 -17.895
  100   HG23  THR  15          2HG2      THR  15   9.508  11.101 -16.241
  101    H    GLY  16           H        GLY  16   8.432   7.116 -16.076
  102    HA2  GLY  16           2HA      GLY  16  10.932   7.197 -17.628
  103    HA3  GLY  16           3HA      GLY  16  10.756   6.522 -16.015
  104    H    PHE  17           H        PHE  17   8.096   5.437 -17.432
  105    HA   PHE  17           HA       PHE  17   8.462   2.828 -17.460
  106    HB2  PHE  17           2HB      PHE  17   6.898   2.596 -19.343
  107    HB3  PHE  17           3HB      PHE  17   6.380   3.859 -18.231
  108    HD1  PHE  17           HD1      PHE  17   7.496   6.255 -18.891
  109    HD2  PHE  17           HD2      PHE  17   6.604   3.060 -21.558
  110    HE1  PHE  17           HE1      PHE  17   7.380   7.852 -20.759
  111    HE2  PHE  17           HE2      PHE  17   6.487   4.652 -23.431
  112    HZ   PHE  17           HZ       PHE  17   6.876   7.051 -23.033
  113    H    THR  18           H        THR  18   9.351   4.790 -20.299
  114    HA   THR  18           HA       THR  18  11.201   2.634 -21.090
  115    HB   THR  18           HB       THR  18   9.972   4.689 -22.934
  116    HG1  THR  18           HG1      THR  18   8.490   3.135 -23.480
  117   HG21  THR  18          3HG2      THR  18  11.560   2.168 -23.416
  118   HG22  THR  18          1HG2      THR  18  12.041   3.821 -23.795
  119   HG23  THR  18          2HG2      THR  18  10.716   3.064 -24.679
  120    H    LEU  19           H        LEU  19  10.938   5.850 -20.059
  121    HA   LEU  19           HA       LEU  19  13.364   6.797 -21.308
  122    HB2  LEU  19           2HB      LEU  19  11.328   7.918 -19.454
  123    HB3  LEU  19           3HB      LEU  19  12.925   8.663 -19.483
  124    HG   LEU  19           HG       LEU  19  11.444   9.897 -20.918
  125   HD11  LEU  19          1HD1      LEU  19  12.759   8.754 -23.160
  126   HD12  LEU  19          2HD1      LEU  19  13.851   8.676 -21.778
  127   HD13  LEU  19          3HD1      LEU  19  13.165  10.224 -22.273
  128   HD21  LEU  19          3HD2      LEU  19  10.028   7.722 -21.314
  129   HD22  LEU  19          1HD2      LEU  19  11.056   7.571 -22.740
  130   HD23  LEU  19          2HD2      LEU  19  10.062   9.011 -22.518
  131    H    VAL  20           H        VAL  20  12.575   4.962 -18.575
  132    HA   VAL  20           HA       VAL  20  14.732   5.795 -16.880
  133    HB   VAL  20           HB       VAL  20  12.835   3.466 -16.830
  134   HG11  VAL  20          1HG1      VAL  20  14.584   2.324 -15.918
  135   HG12  VAL  20          2HG1      VAL  20  15.397   3.789 -15.362
  136   HG13  VAL  20          3HG1      VAL  20  14.010   3.157 -14.474
  137   HG21  VAL  20          3HG2      VAL  20  12.825   6.088 -15.786
  138   HG22  VAL  20          1HG2      VAL  20  11.640   4.808 -15.526
  139   HG23  VAL  20          2HG2      VAL  20  13.001   4.989 -14.419
  140    HA   PRO  21           HA       PRO  21  16.727   1.672 -18.449
  141    HB2  PRO  21           2HB      PRO  21  15.616   0.529 -20.646
  142    HB3  PRO  21           3HB      PRO  21  15.107   0.139 -18.999
  143    HG2  PRO  21           2HG      PRO  21  13.844   1.990 -20.984
  144    HG3  PRO  21           3HG      PRO  21  13.073   0.815 -19.902
  145    HD2  PRO  21           2HD      PRO  21  13.154   3.465 -19.353
  146    HD3  PRO  21           3HD      PRO  21  13.187   2.225 -18.083
  147    H    VAL  22           H        VAL  22  15.455   4.082 -20.602
  148    HA   VAL  22           HA       VAL  22  17.724   3.775 -22.433
  149    HB   VAL  22           HB       VAL  22  15.320   5.586 -22.697
  150   HG11  VAL  22          1HG1      VAL  22  17.665   4.974 -24.450
  151   HG12  VAL  22          2HG1      VAL  22  16.120   5.446 -25.161
  152   HG13  VAL  22          3HG1      VAL  22  16.947   6.533 -24.044
  153   HG21  VAL  22          3HG2      VAL  22  15.843   2.971 -24.103
  154   HG22  VAL  22          1HG2      VAL  22  14.777   3.152 -22.710
  155   HG23  VAL  22          2HG2      VAL  22  14.402   3.980 -24.221
  156    H    GLU  23           H        GLU  23  16.786   5.558 -19.735
  157    HA   GLU  23           HA       GLU  23  17.781   8.111 -20.253
  158    HB2  GLU  23           2HB      GLU  23  16.828   8.265 -18.228
  159    HB3  GLU  23           3HB      GLU  23  17.045   6.550 -17.908
  160    HG2  GLU  23           2HG      GLU  23  19.289   6.922 -17.140
  161    HG3  GLU  23           3HG      GLU  23  19.203   8.622 -17.597
  162    H    ASP  24           H        ASP  24  19.429   5.134 -19.829
  163    HA   ASP  24           HA       ASP  24  21.940   6.228 -18.990
  164    HB2  ASP  24           2HB      ASP  24  21.114   3.830 -18.648
  165    HB3  ASP  24           3HB      ASP  24  21.543   3.559 -20.335
  166    H    HIS  25           H        HIS  25  20.292   6.370 -21.865
  167    HA   HIS  25           HA       HIS  25  22.762   6.496 -23.460
  168    HB2  HIS  25           2HB      HIS  25  20.063   5.529 -24.018
  169    HB3  HIS  25           3HB      HIS  25  20.655   6.640 -25.249
  170    HD1  HIS  25           HD1      HIS  25  21.826   3.484 -23.476
  171    HD2  HIS  25           HD2      HIS  25  22.215   5.450 -27.116
  172    HE1  HIS  25           HE1      HIS  25  23.164   1.935 -24.938