*HEADER    IMMUNE SYSTEM                           02-JUL-13   2MAA              
*TITLE     NMR STRUCTURE OF TEMPORIN-1 TA IN LIPOPOLYSACCHARIDE MICELLES:        
*TITLE    2 MECHANISTIC INSIGHT INTO INACTIVATION BY OUTER MEMEBRANE             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TEMPORIN-A;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: RANA TEMPORARIA;                                
*SOURCE   3 ORGANISM_COMMON: EUROPEAN COMMON FROG;                               
*SOURCE   4 ORGANISM_TAXID: 8407;                                                
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    AMP/LPS, IMMUNE SYSTEM                                                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    H.MOHANRAM                                                            
*REVDAT   1   21-AUG-13 2MAA    0                                                


  8 VAL  H       8 VAL  HB      3.79 
  7 ARG  H       7 ARG  QD      4.26 
  7 ARG  QD      8 VAL  H       4.21 
 12 ILE  H      12 ILE  HB      3.95 
 12 ILE  H      12 ILE  HG23    4.23 
  4 LEU  H       4 LEU  QB      2.55 
  4 LEU  H       4 LEU  HG      5.50 
  4 LEU  H       4 LEU  QQD     3.10 
 11 GLY  H      12 ILE  HA      5.14 
 10 SER  HA     13 LEU  H       3.50 
  2 LEU  H       3 PRO  HD3     4.62 
  2 LEU  H       3 PRO  HD2     4.62 
  3 PRO  HD2     4 LEU  H       4.97 
  3 PRO  HD3     4 LEU  H       4.97 
  7 ARG  H       9 LEU  H       4.88 
  4 LEU  H       7 ARG  QD      5.31 
  7 ARG  QD     10 SER  H       4.94 
  5 ILE  H       7 ARG  QD      5.29 
  7 ARG  QD     12 ILE  H       5.50 
  8 VAL  HB      9 LEU  H       4.13 
  3 PRO  QG      4 LEU  H       4.14 
  7 ARG  H       8 VAL  HB      4.49 
  3 PRO  QG      5 ILE  H       5.50 
  5 ILE  H       8 VAL  HB      5.50 
 12 ILE  HG23   13 LEU  H       4.20 
  8 VAL  H       8 VAL  QQG     2.53 
  5 ILE  H       5 ILE  HG23    4.30 
  5 ILE  HG23    6 GLY  H       4.65 
  7 ARG  QD     11 GLY  H       5.05 
 12 ILE  H      13 LEU  HA      4.90 
  7 ARG  H       8 VAL  QQG     3.66 
 10 SER  QB     11 GLY  H       4.00 
 12 ILE  H      13 LEU  QB      4.48 
 12 ILE  H      12 ILE  HG21    4.51 
  2 LEU  HG      4 LEU  H       5.50 
  4 LEU  H       5 ILE  HG21    5.50 
 11 GLY  H      12 ILE  HG23    5.38 
  4 LEU  H       5 ILE  HG23    5.05 
  9 LEU  H       9 LEU  QQD     3.43 
  9 LEU  QQD    10 SER  H       3.65 
  7 ARG  QD     11 GLY  QA      4.31 
  5 ILE  HB      6 GLY  QA      4.00 
 11 GLY  QA     12 ILE  HB      5.10 
  7 ARG  QG     11 GLY  QA      2.67 
 12 ILE  HA     12 ILE  HG21    3.84 
  7 ARG  QD      8 VAL  HB      3.87 
  3 PRO  QG      4 LEU  HG      3.39 
 12 ILE  HG23   13 LEU  QB      4.50 
  5 ILE  HA      8 VAL  HB      3.53 
  1 PHE  QE      3 PRO  HD3     4.70 
  1 PHE  QE      3 PRO  HD2     4.70 
  1 PHE  QE      3 PRO  QG      3.84 
  5 ILE  H       6 GLY  QA      4.74 
  5 ILE  H       6 GLY  H       3.00 
  1 PHE  QB      2 LEU  H       4.33 
  5 ILE  H       5 ILE  QG1     2.83 
  5 ILE  QG1     6 GLY  H       3.00 
  2 LEU  HA      4 LEU  H       4.00 
  2 LEU  HA      5 ILE  H       4.00 
  4 LEU  H       5 ILE  H       3.00 
  5 ILE  HA      7 ARG  H       4.00 
  5 ILE  HA      8 VAL  H       3.50 
  5 ILE  HB      6 GLY  H       4.00 
  4 LEU  H       6 GLY  H       4.00 
  6 GLY  H       8 VAL  H       4.00 
  6 GLY  H       7 ARG  H       3.00 
  7 ARG  HA     11 GLY  H       4.00 
  7 ARG  H       8 VAL  H       3.00 
  7 ARG  HA     10 SER  H       3.50 
  8 VAL  HA     11 GLY  H       3.50 
  8 VAL  HA     10 SER  H       4.00 
  8 VAL  H       9 LEU  H       3.00 
  9 LEU  H      10 SER  H       3.00 
 10 SER  HA     12 ILE  H       4.00 
 11 GLY  QA     13 LEU  H       4.00 
 10 SER  H      12 ILE  H       4.00 
 11 GLY  H      12 ILE  H       3.00 
 12 ILE  H      13 LEU  H       3.00 
 12 ILE  HB     13 LEU  H       4.00 
 11 GLY  H      12 ILE  HB      5.00 
 11 GLY  H      13 LEU  H       4.00 
  1 PHE  QE      3 PRO  QB      4.46 
  1 PHE  QE      3 PRO  QD      4.12 
  2 LEU  H       3 PRO  QD      4.01 
  3 PRO  QB      4 LEU  HG      4.62 
  3 PRO  QB      4 LEU  QQD     3.50 
  3 PRO  QB      6 GLY  H       5.34 
  3 PRO  QD      4 LEU  H       4.37 
  3 PRO  QD      4 LEU  QB      4.42 
  3 PRO  QD      4 LEU  HG      3.56 
  3 PRO  QD      4 LEU  QQD     4.05 
  3 PRO  QD      5 ILE  H       5.17 
  1 PHE  QE      4 LEU  H       4.50
  1 PHE  QE      5 ILE  H       5.00
  1 PHE  QE      6 GLY  QA      4.00
  1 PHE  QE      5 ILE  HG23    4.00
  1 PHE  QE      5 ILE  HG12    4.00
  1 PHE  QD      4 LEU  H       5.00
  1 PHE  QD      5 ILE  H       5.00
  1 PHE  QD      6 GLY  QA      5.00
  1 PHE  QD      5 ILE  HG23    5.00
  1 PHE  QD      5 ILE  HG12    5.00
  2 LEU  HA      2 LEU  H       3.00
  2 LEU  QB      2 LEU  H       4.00
  6 GLY  QA      6 GLY  H       3.00
 10 SER  HA     10 SER  H       3.00
 10 SER  QB     10 SER  H       3.50
 11 GLY  QA     11 GLY  H       3.00
 13 LEU  HA     13 LEU  H       3.00
 13 LEU  QB     13 LEU  H       3.50
  
 
 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   PHE   1           H        PHE   1   1.807   0.001   0.856
    2    HA   PHE   1           HA       PHE   1   2.430   1.009  -1.423
    3    HB2  PHE   1           2HB      PHE   1   4.174  -0.418  -1.532
    4    HB3  PHE   1           3HB      PHE   1   3.490  -1.124  -0.071
    5    HD1  PHE   1           HD1      PHE   1   1.894  -3.080  -0.325
    6    HD2  PHE   1           HD2      PHE   1   4.371  -1.670  -3.487
    7    HE1  PHE   1           HE1      PHE   1   1.628  -5.232  -1.488
    8    HE2  PHE   1           HE2      PHE   1   4.108  -3.819  -4.655
    9    HZ   PHE   1           HZ       PHE   1   2.735  -5.603  -3.657
   10    H    LEU   2           H        LEU   2   2.696  -0.025  -3.701
   11    HA   LEU   2           HA       LEU   2   0.029  -0.940  -4.548
   12    HB2  LEU   2           2HB      LEU   2   1.977   0.967  -5.659
   13    HB3  LEU   2           3HB      LEU   2   1.197  -0.088  -6.836
   14    HG   LEU   2           HG       LEU   2   0.029   2.030  -6.678
   15   HD11  LEU   2          1HD1      LEU   2  -1.115  -0.450  -6.597
   16   HD12  LEU   2          2HD1      LEU   2  -1.968   1.058  -6.921
   17   HD13  LEU   2          3HD1      LEU   2  -1.947   0.391  -5.289
   18   HD21  LEU   2          3HD2      LEU   2  -0.972   1.548  -3.951
   19   HD22  LEU   2          1HD2      LEU   2  -0.564   3.059  -4.764
   20   HD23  LEU   2          2HD2      LEU   2   0.713   2.060  -4.069
   21    HA   PRO   3           HA       PRO   3   2.206  -4.737  -5.497
   22    HB2  PRO   3           2HB      PRO   3  -0.016  -6.112  -6.232
   23    HB3  PRO   3           3HB      PRO   3   0.424  -5.831  -4.544
   24    HG2  PRO   3           2HG      PRO   3  -1.554  -4.373  -6.253
   25    HG3  PRO   3           3HG      PRO   3  -1.707  -4.901  -4.567
   26    HD2  PRO   3           2HD      PRO   3  -1.115  -2.348  -5.246
   27    HD3  PRO   3           3HD      PRO   3  -0.500  -3.108  -3.765
   28    H    LEU   4           H        LEU   4   0.840  -2.486  -7.510
   29    HA   LEU   4           HA       LEU   4   1.013  -4.099  -9.935
   30    HB2  LEU   4           2HB      LEU   4   0.292  -1.191  -9.607
   31    HB3  LEU   4           3HB      LEU   4   0.125  -2.151 -11.076
   32    HG   LEU   4           HG       LEU   4  -1.455  -2.447  -8.524
   33   HD11  LEU   4          1HD1      LEU   4  -3.348  -1.945 -10.099
   34   HD12  LEU   4          2HD1      LEU   4  -2.135  -1.495 -11.296
   35   HD13  LEU   4          3HD1      LEU   4  -2.251  -0.601  -9.781
   36   HD21  LEU   4          3HD2      LEU   4  -2.689  -4.202  -9.710
   37   HD22  LEU   4          1HD2      LEU   4  -0.997  -4.639  -9.473
   38   HD23  LEU   4          2HD2      LEU   4  -1.552  -4.089 -11.054
   39    H    ILE   5           H        ILE   5   2.813  -1.746  -8.150
   40    HA   ILE   5           HA       ILE   5   4.479  -0.830 -10.258
   41    HB   ILE   5           HB       ILE   5   5.705   0.309  -8.663
   42   HG12  ILE   5          2HG1      ILE   5   4.974  -1.899  -6.734
   43   HG13  ILE   5          3HG1      ILE   5   6.565  -1.547  -7.399
   44   HG21  ILE   5          1HG2      ILE   5   4.126   1.462  -7.520
   45   HG22  ILE   5          2HG2      ILE   5   3.042   0.488  -8.512
   46   HG23  ILE   5          3HG2      ILE   5   3.389   0.006  -6.851
   47   HD11  ILE   5          3HD1      ILE   5   5.009   0.084  -5.413
   48   HD12  ILE   5          1HD1      ILE   5   6.524  -0.782  -5.154
   49   HD13  ILE   5          2HD1      ILE   5   6.487   0.640  -6.199
   50    H    GLY   6           H        GLY   6   4.690  -3.496  -7.962
   51    HA2  GLY   6           2HA      GLY   6   7.361  -4.223  -8.793
   52    HA3  GLY   6           3HA      GLY   6   6.335  -5.111  -7.675
   53    H    ARG   7           H        ARG   7   4.242  -4.777  -9.998
   54    HA   ARG   7           HA       ARG   7   5.033  -7.277 -11.308
   55    HB2  ARG   7           2HB      ARG   7   2.919  -7.662 -10.503
   56    HB3  ARG   7           3HB      ARG   7   2.433  -5.980 -10.667
   57    HG2  ARG   7           2HG      ARG   7   2.942  -7.490 -13.162
   58    HG3  ARG   7           3HG      ARG   7   1.497  -7.904 -12.238
   59    HD2  ARG   7           2HD      ARG   7   1.437  -5.165 -12.238
   60    HD3  ARG   7           3HD      ARG   7   2.097  -5.528 -13.831
   61    HE   ARG   7           HE       ARG   7  -0.242  -7.062 -13.154
   62   HH11  ARG   7          1HH1      ARG   7   0.951  -4.095 -14.530
   63   HH12  ARG   7          2HH1      ARG   7  -0.475  -3.804 -15.469
   64   HH21  ARG   7          1HH2      ARG   7  -2.125  -6.691 -14.387
   65   HH22  ARG   7          2HH2      ARG   7  -2.225  -5.281 -15.386
   66    H    VAL   8           H        VAL   8   4.177  -3.944 -11.958
   67    HA   VAL   8           HA       VAL   8   3.681  -3.915 -14.643
   68    HB   VAL   8           HB       VAL   8   3.720  -1.909 -13.161
   69   HG11  VAL   8          1HG1      VAL   8   5.604  -1.005 -12.314
   70   HG12  VAL   8          2HG1      VAL   8   6.241  -2.636 -12.530
   71   HG13  VAL   8          3HG1      VAL   8   6.561  -1.395 -13.742
   72   HG21  VAL   8          3HG2      VAL   8   5.292  -1.655 -15.725
   73   HG22  VAL   8          1HG2      VAL   8   3.534  -1.693 -15.589
   74   HG23  VAL   8          2HG2      VAL   8   4.443  -0.349 -14.898
   75    H    LEU   9           H        LEU   9   6.735  -4.481 -13.047
   76    HA   LEU   9           HA       LEU   9   8.540  -4.028 -15.089
   77    HB2  LEU   9           2HB      LEU   9   8.556  -6.203 -13.004
   78    HB3  LEU   9           3HB      LEU   9   9.937  -5.775 -14.011
   79    HG   LEU   9           HG       LEU   9   9.245  -3.376 -12.842
   80   HD11  LEU   9          1HD1      LEU   9   7.685  -4.505 -11.341
   81   HD12  LEU   9          2HD1      LEU   9   9.056  -3.836 -10.456
   82   HD13  LEU   9          3HD1      LEU   9   8.980  -5.567 -10.787
   83   HD21  LEU   9          3HD2      LEU   9  11.231  -4.064 -11.280
   84   HD22  LEU   9          1HD2      LEU   9  11.490  -3.829 -13.009
   85   HD23  LEU   9          2HD2      LEU   9  11.323  -5.459 -12.356
   86    H    SER  10           H        SER  10   6.578  -6.910 -14.468
   87    HA   SER  10           HA       SER  10   7.502  -8.055 -17.008
   88    HB2  SER  10           2HB      SER  10   7.752  -9.699 -15.366
   89    HB3  SER  10           3HB      SER  10   6.265  -9.236 -14.538
   90    HG   SER  10           HG       SER  10   6.447 -11.214 -16.095
   91    H    GLY  11           H        GLY  11   4.693  -6.831 -15.343
   92    HA2  GLY  11           2HA      GLY  11   2.714  -7.840 -17.097
   93    HA3  GLY  11           3HA      GLY  11   2.533  -6.456 -16.029
   94    H    ILE  12           H        ILE  12   4.908  -5.164 -17.345
   95    HA   ILE  12           HA       ILE  12   3.407  -3.821 -19.411
   96    HB   ILE  12           HB       ILE  12   4.963  -2.666 -17.774
   97   HG12  ILE  12          2HG1      ILE  12   6.069  -1.397 -19.923
   98   HG13  ILE  12          3HG1      ILE  12   4.734  -2.255 -20.684
   99   HG21  ILE  12          1HG2      ILE  12   7.209  -3.281 -19.620
  100   HG22  ILE  12          2HG2      ILE  12   7.234  -2.841 -17.913
  101   HG23  ILE  12          3HG2      ILE  12   6.783  -4.476 -18.395
  102   HD11  ILE  12          3HD1      ILE  12   3.193  -1.224 -19.065
  103   HD12  ILE  12          1HD1      ILE  12   4.546  -0.312 -18.396
  104   HD13  ILE  12          2HD1      ILE  12   4.037  -0.041 -20.063
  105    H    LEU  13           H        LEU  13   5.961  -6.180 -19.215
  106    HA   LEU  13           HA       LEU  13   7.158  -7.315 -20.786
  107    HB2  LEU  13           2HB      LEU  13   4.581  -7.675 -21.325
  108    HB3  LEU  13           3HB      LEU  13   5.038  -6.849 -22.813
  109    HG   LEU  13           HG       LEU  13   6.965  -8.820 -22.524
  110   HD11  LEU  13          1HD1      LEU  13   4.497 -10.387 -22.305
  111   HD12  LEU  13          2HD1      LEU  13   5.015  -9.609 -20.810
  112   HD13  LEU  13          3HD1      LEU  13   6.108 -10.702 -21.659
  113   HD21  LEU  13          3HD2      LEU  13   6.264  -8.484 -24.665
  114   HD22  LEU  13          1HD2      LEU  13   4.564  -8.364 -24.209
  115   HD23  LEU  13          2HD2      LEU  13   5.344  -9.943 -24.296
  Start of MODEL    2
    1    H1   PHE   1           H        PHE   1   1.136  -0.852   0.751
    2    HA   PHE   1           HA       PHE   1   2.154   0.886  -1.277
    3    HB2  PHE   1           2HB      PHE   1   3.879  -0.564  -1.368
    4    HB3  PHE   1           3HB      PHE   1   3.150  -1.285   0.062
    5    HD1  PHE   1           HD1      PHE   1   1.534  -3.213  -0.266
    6    HD2  PHE   1           HD2      PHE   1   4.107  -1.784  -3.340
    7    HE1  PHE   1           HE1      PHE   1   1.267  -5.340  -1.473
    8    HE2  PHE   1           HE2      PHE   1   3.844  -3.908  -4.553
    9    HZ   PHE   1           HZ       PHE   1   2.421  -5.689  -3.620
   10    H    LEU   2           H        LEU   2   2.461  -0.111  -3.567
   11    HA   LEU   2           HA       LEU   2  -0.196  -0.973  -4.494
   12    HB2  LEU   2           2HB      LEU   2   1.804   0.926  -5.524
   13    HB3  LEU   2           3HB      LEU   2   1.040  -0.098  -6.738
   14    HG   LEU   2           HG       LEU   2  -1.116   0.818  -5.323
   15   HD11  LEU   2          1HD1      LEU   2   0.765   2.372  -4.274
   16   HD12  LEU   2          2HD1      LEU   2  -0.867   2.955  -4.598
   17   HD13  LEU   2          3HD1      LEU   2   0.436   3.310  -5.732
   18   HD21  LEU   2          3HD2      LEU   2  -1.268   2.485  -7.270
   19   HD22  LEU   2          1HD2      LEU   2  -1.203   0.765  -7.653
   20   HD23  LEU   2          2HD2      LEU   2   0.242   1.761  -7.826
   21    HA   PRO   3           HA       PRO   3   1.950  -4.783  -5.457
   22    HB2  PRO   3           2HB      PRO   3  -0.272  -6.114  -6.271
   23    HB3  PRO   3           3HB      PRO   3   0.131  -5.869  -4.568
   24    HG2  PRO   3           2HG      PRO   3  -1.784  -4.353  -6.299
   25    HG3  PRO   3           3HG      PRO   3  -1.986  -4.908  -4.626
   26    HD2  PRO   3           2HD      PRO   3  -1.342  -2.352  -5.246
   27    HD3  PRO   3           3HD      PRO   3  -0.775  -3.147  -3.763
   28    H    LEU   4           H        LEU   4   0.667  -2.478  -7.462
   29    HA   LEU   4           HA       LEU   4   0.877  -4.051  -9.911
   30    HB2  LEU   4           2HB      LEU   4   0.192  -1.137  -9.555
   31    HB3  LEU   4           3HB      LEU   4   0.040  -2.076 -11.039
   32    HG   LEU   4           HG       LEU   4  -1.597  -2.376  -8.524
   33   HD11  LEU   4          1HD1      LEU   4  -2.293  -1.484 -11.317
   34   HD12  LEU   4          2HD1      LEU   4  -2.246  -0.477  -9.870
   35   HD13  LEU   4          3HD1      LEU   4  -3.453  -1.755 -10.016
   36   HD21  LEU   4          3HD2      LEU   4  -1.185  -4.568  -9.454
   37   HD22  LEU   4          1HD2      LEU   4  -1.626  -4.000 -11.065
   38   HD23  LEU   4          2HD2      LEU   4  -2.847  -4.083  -9.795
   39    H    ILE   5           H        ILE   5   2.664  -1.756  -8.041
   40    HA   ILE   5           HA       ILE   5   4.395  -0.826 -10.091
   41    HB   ILE   5           HB       ILE   5   5.596   0.267  -8.446
   42   HG12  ILE   5          2HG1      ILE   5   4.787  -1.964  -6.575
   43   HG13  ILE   5          3HG1      ILE   5   6.399  -1.623  -7.195
   44   HG21  ILE   5          1HG2      ILE   5   4.006   1.422  -7.322
   45   HG22  ILE   5          2HG2      ILE   5   2.933   0.481  -8.357
   46   HG23  ILE   5          3HG2      ILE   5   3.232  -0.034  -6.697
   47   HD11  ILE   5          3HD1      ILE   5   6.642  -0.684  -5.166
   48   HD12  ILE   5          1HD1      ILE   5   5.902   0.700  -5.970
   49   HD13  ILE   5          2HD1      ILE   5   4.915  -0.375  -4.979
   50    H    GLY   6           H        GLY   6   4.512  -3.535  -7.837
   51    HA2  GLY   6           2HA      GLY   6   7.192  -4.285  -8.616
   52    HA3  GLY   6           3HA      GLY   6   6.128  -5.177  -7.539
   53    H    ARG   7           H        ARG   7   4.097  -4.774  -9.906
   54    HA   ARG   7           HA       ARG   7   4.884  -7.263 -11.238
   55    HB2  ARG   7           2HB      ARG   7   2.746  -7.633 -10.494
   56    HB3  ARG   7           3HB      ARG   7   2.289  -5.941 -10.635
   57    HG2  ARG   7           2HG      ARG   7   2.834  -7.409 -13.147
   58    HG3  ARG   7           3HG      ARG   7   1.361  -7.816 -12.266
   59    HD2  ARG   7           2HD      ARG   7   1.219  -5.134 -12.186
   60    HD3  ARG   7           3HD      ARG   7   2.100  -5.342 -13.699
   61    HE   ARG   7           HE       ARG   7   0.151  -6.024 -14.653
   62   HH11  ARG   7          1HH1      ARG   7  -0.074  -6.531 -11.217
   63   HH12  ARG   7          2HH1      ARG   7  -1.722  -7.064 -11.272
   64   HH21  ARG   7          1HH2      ARG   7  -2.018  -6.723 -14.739
   65   HH22  ARG   7          2HH2      ARG   7  -2.826  -7.174 -13.276
   66    H    VAL   8           H        VAL   8   4.091  -3.907 -11.851
   67    HA   VAL   8           HA       VAL   8   3.661  -3.826 -14.547
   68    HB   VAL   8           HB       VAL   8   3.693  -1.846 -13.030
   69   HG11  VAL   8          1HG1      VAL   8   5.568  -0.983 -12.123
   70   HG12  VAL   8          2HG1      VAL   8   6.187  -2.620 -12.351
   71   HG13  VAL   8          3HG1      VAL   8   6.554  -1.363 -13.534
   72   HG21  VAL   8          3HG2      VAL   8   3.594  -1.623 -15.482
   73   HG22  VAL   8          1HG2      VAL   8   4.429  -0.270 -14.719
   74   HG23  VAL   8          2HG2      VAL   8   5.355  -1.534 -15.530
   75    H    LEU   9           H        LEU   9   6.667  -4.463 -12.887
   76    HA   LEU   9           HA       LEU   9   8.527  -4.001 -14.878
   77    HB2  LEU   9           2HB      LEU   9   8.689  -4.936 -12.396
   78    HB3  LEU   9           3HB      LEU   9   8.820  -6.470 -13.254
   79    HG   LEU   9           HG       LEU   9  11.024  -5.704 -12.760
   80   HD11  LEU   9          1HD1      LEU   9  11.977  -5.927 -14.839
   81   HD12  LEU   9          2HD1      LEU   9  10.762  -4.920 -15.626
   82   HD13  LEU   9          3HD1      LEU   9  10.359  -6.565 -15.132
   83   HD21  LEU   9          3HD2      LEU   9  11.765  -3.574 -12.896
   84   HD22  LEU   9          1HD2      LEU   9  10.044  -3.205 -12.778
   85   HD23  LEU   9          2HD2      LEU   9  10.835  -3.226 -14.355
   86    H    SER  10           H        SER  10   6.511  -6.864 -14.353
   87    HA   SER  10           HA       SER  10   7.481  -7.981 -16.889
   88    HB2  SER  10           2HB      SER  10   7.381  -9.299 -14.626
   89    HB3  SER  10           3HB      SER  10   5.670  -9.467 -15.016
   90    HG   SER  10           HG       SER  10   6.331 -10.382 -17.031
   91    H    GLY  11           H        GLY  11   4.649  -6.743 -15.273
   92    HA2  GLY  11           2HA      GLY  11   2.700  -7.694 -17.092
   93    HA3  GLY  11           3HA      GLY  11   2.513  -6.325 -16.005
   94    H    ILE  12           H        ILE  12   4.937  -5.046 -17.241
   95    HA   ILE  12           HA       ILE  12   3.507  -3.648 -19.320
   96    HB   ILE  12           HB       ILE  12   5.036  -2.543 -17.625
   97   HG12  ILE  12          2HG1      ILE  12   5.804  -1.933 -20.477
   98   HG13  ILE  12          3HG1      ILE  12   4.203  -1.569 -19.843
   99   HG21  ILE  12          1HG2      ILE  12   7.320  -3.158 -19.425
  100   HG22  ILE  12          2HG2      ILE  12   7.308  -2.746 -17.711
  101   HG23  ILE  12          3HG2      ILE  12   6.848  -4.367 -18.230
  102   HD11  ILE  12          3HD1      ILE  12   5.071  -0.015 -18.294
  103   HD12  ILE  12          1HD1      ILE  12   6.727  -0.546 -18.582
  104   HD13  ILE  12          2HD1      ILE  12   5.848   0.325 -19.839
  105    H    LEU  13           H        LEU  13   6.024  -6.045 -19.100
  106    HA   LEU  13           HA       LEU  13   7.244  -7.171 -20.659
  107    HB2  LEU  13           2HB      LEU  13   4.680  -7.490 -21.268
  108    HB3  LEU  13           3HB      LEU  13   5.180  -6.639 -22.727
  109    HG   LEU  13           HG       LEU  13   7.081  -8.575 -22.572
  110   HD11  LEU  13          1HD1      LEU  13   5.766 -10.685 -22.164
  111   HD12  LEU  13          2HD1      LEU  13   4.545  -9.676 -21.389
  112   HD13  LEU  13          3HD1      LEU  13   6.179  -9.748 -20.728
  113   HD21  LEU  13          3HD2      LEU  13   4.397  -8.958 -23.882
  114   HD22  LEU  13          1HD2      LEU  13   5.956  -9.598 -24.402
  115   HD23  LEU  13          2HD2      LEU  13   5.638  -7.866 -24.497
  Start of MODEL    3
    1    H1   PHE   1           H        PHE   1   1.275  -1.088   0.407
    2    HA   PHE   1           HA       PHE   1   2.848   0.719  -1.306
    3    HB2  PHE   1           2HB      PHE   1   4.523  -0.774  -1.533
    4    HB3  PHE   1           3HB      PHE   1   3.876  -1.495  -0.063
    5    HD1  PHE   1           HD1      PHE   1   2.190  -3.375  -0.298
    6    HD2  PHE   1           HD2      PHE   1   4.580  -1.975  -3.529
    7    HE1  PHE   1           HE1      PHE   1   1.782  -5.479  -1.507
    8    HE2  PHE   1           HE2      PHE   1   4.176  -4.076  -4.744
    9    HZ   PHE   1           HZ       PHE   1   2.775  -5.831  -3.733
   10    H    LEU   2           H        LEU   2   2.968  -0.257  -3.622
   11    HA   LEU   2           HA       LEU   2   0.231  -1.037  -4.371
   12    HB2  LEU   2           2HB      LEU   2   2.205   0.822  -5.516
   13    HB3  LEU   2           3HB      LEU   2   1.331  -0.167  -6.685
   14    HG   LEU   2           HG       LEU   2  -0.538   0.963  -4.841
   15   HD11  LEU   2          1HD1      LEU   2   1.255   2.979  -6.184
   16   HD12  LEU   2          2HD1      LEU   2   1.187   2.666  -4.450
   17   HD13  LEU   2          3HD1      LEU   2  -0.221   3.323  -5.283
   18   HD21  LEU   2          3HD2      LEU   2  -1.661   1.567  -6.776
   19   HD22  LEU   2          1HD2      LEU   2  -0.708   0.180  -7.303
   20   HD23  LEU   2          2HD2      LEU   2  -0.171   1.816  -7.687
   21    HA   PRO   3           HA       PRO   3   2.201  -4.890  -5.522
   22    HB2  PRO   3           2HB      PRO   3  -0.107  -6.151  -6.194
   23    HB3  PRO   3           3HB      PRO   3   0.420  -5.939  -4.520
   24    HG2  PRO   3           2HG      PRO   3  -1.570  -4.351  -6.096
   25    HG3  PRO   3           3HG      PRO   3  -1.669  -4.922  -4.420
   26    HD2  PRO   3           2HD      PRO   3  -1.002  -2.376  -5.055
   27    HD3  PRO   3           3HD      PRO   3  -0.354  -3.205  -3.625
   28    H    LEU   4           H        LEU   4   0.843  -2.527  -7.408
   29    HA   LEU   4           HA       LEU   4   0.840  -4.073  -9.882
   30    HB2  LEU   4           2HB      LEU   4   0.258  -1.148  -9.444
   31    HB3  LEU   4           3HB      LEU   4  -0.017  -2.060 -10.927
   32    HG   LEU   4           HG       LEU   4  -1.489  -2.357  -8.312
   33   HD11  LEU   4          1HD1      LEU   4  -3.429  -1.719  -9.749
   34   HD12  LEU   4          2HD1      LEU   4  -2.282  -1.339 -11.033
   35   HD13  LEU   4          3HD1      LEU   4  -2.237  -0.440  -9.516
   36   HD21  LEU   4          3HD2      LEU   4  -1.165  -4.542  -9.335
   37   HD22  LEU   4          1HD2      LEU   4  -1.777  -3.928 -10.871
   38   HD23  LEU   4          2HD2      LEU   4  -2.848  -4.031  -9.474
   39    H    ILE   5           H        ILE   5   2.815  -1.850  -8.117
   40    HA   ILE   5           HA       ILE   5   4.423  -0.940 -10.273
   41    HB   ILE   5           HB       ILE   5   5.765   0.101  -8.705
   42   HG12  ILE   5          2HG1      ILE   5   5.029  -2.132  -6.806
   43   HG13  ILE   5          3HG1      ILE   5   6.602  -1.825  -7.533
   44   HG21  ILE   5          1HG2      ILE   5   4.288   1.283  -7.459
   45   HG22  ILE   5          2HG2      ILE   5   3.121   0.383  -8.427
   46   HG23  ILE   5          3HG2      ILE   5   3.521  -0.161  -6.798
   47   HD11  ILE   5          3HD1      ILE   5   7.070  -0.840  -5.591
   48   HD12  ILE   5          1HD1      ILE   5   6.134   0.513  -6.226
   49   HD13  ILE   5          2HD1      ILE   5   5.369  -0.664  -5.158
   50    H    GLY   6           H        GLY   6   4.623  -3.680  -8.063
   51    HA2  GLY   6           2HA      GLY   6   7.221  -4.490  -9.034
   52    HA3  GLY   6           3HA      GLY   6   6.210  -5.367  -7.896
   53    H    ARG   7           H        ARG   7   4.031  -4.881 -10.111
   54    HA   ARG   7           HA       ARG   7   4.658  -7.371 -11.524
   55    HB2  ARG   7           2HB      ARG   7   2.568  -7.693 -10.634
   56    HB3  ARG   7           3HB      ARG   7   2.146  -5.989 -10.730
   57    HG2  ARG   7           2HG      ARG   7   2.480  -7.444 -13.286
   58    HG3  ARG   7           3HG      ARG   7   1.061  -7.826 -12.309
   59    HD2  ARG   7           2HD      ARG   7   1.153  -5.073 -12.244
   60    HD3  ARG   7           3HD      ARG   7   1.665  -5.454 -13.888
   61    HE   ARG   7           HE       ARG   7  -0.701  -6.857 -13.028
   62   HH11  ARG   7          1HH1      ARG   7   0.562  -3.973 -14.515
   63   HH12  ARG   7          2HH1      ARG   7  -0.911  -3.600 -15.347
   64   HH21  ARG   7          1HH2      ARG   7  -2.646  -6.377 -14.118
   65   HH22  ARG   7          2HH2      ARG   7  -2.735  -4.968 -15.120
   66    H    VAL   8           H        VAL   8   3.914  -3.988 -12.042
   67    HA   VAL   8           HA       VAL   8   3.301  -3.860 -14.700
   68    HB   VAL   8           HB       VAL   8   3.491  -1.902 -13.165
   69   HG11  VAL   8          1HG1      VAL   8   5.448  -1.097 -12.385
   70   HG12  VAL   8          2HG1      VAL   8   6.004  -2.747 -12.672
   71   HG13  VAL   8          3HG1      VAL   8   6.322  -1.488 -13.866
   72   HG21  VAL   8          3HG2      VAL   8   3.388  -1.827 -15.734
   73   HG22  VAL   8          1HG2      VAL   8   3.870  -0.363 -14.877
   74   HG23  VAL   8          2HG2      VAL   8   5.091  -1.376 -15.647
   75    H    LEU   9           H        LEU   9   6.396  -4.597 -13.261
   76    HA   LEU   9           HA       LEU   9   8.126  -4.156 -15.370
   77    HB2  LEU   9           2HB      LEU   9   8.109  -6.309 -13.269
   78    HB3  LEU   9           3HB      LEU   9   9.436  -6.094 -14.408
   79    HG   LEU   9           HG       LEU   9   9.172  -3.586 -13.324
   80   HD11  LEU   9          1HD1      LEU   9   8.462  -3.613 -11.205
   81   HD12  LEU   9          2HD1      LEU   9   9.255  -5.149 -10.858
   82   HD13  LEU   9          3HD1      LEU   9   7.674  -5.131 -11.639
   83   HD21  LEU   9          3HD2      LEU   9  11.250  -4.798 -13.762
   84   HD22  LEU   9          1HD2      LEU   9  10.936  -5.842 -12.376
   85   HD23  LEU   9          2HD2      LEU   9  11.231  -4.121 -12.133
   86    H    SER  10           H        SER  10   6.075  -6.974 -14.740
   87    HA   SER  10           HA       SER  10   6.837  -8.080 -17.351
   88    HB2  SER  10           2HB      SER  10   5.115  -9.557 -15.394
   89    HB3  SER  10           3HB      SER  10   6.269 -10.190 -16.567
   90    HG   SER  10           HG       SER  10   6.914 -10.222 -14.274
   91    H    GLY  11           H        GLY  11   4.159  -6.792 -15.526
   92    HA2  GLY  11           2HA      GLY  11   2.060  -7.669 -17.209
   93    HA3  GLY  11           3HA      GLY  11   1.989  -6.306 -16.103
   94    H    ILE  12           H        ILE  12   4.378  -5.118 -17.527
   95    HA   ILE  12           HA       ILE  12   2.832  -3.673 -19.502
   96    HB   ILE  12           HB       ILE  12   4.457  -2.584 -17.887
   97   HG12  ILE  12          2HG1      ILE  12   5.531  -1.287 -20.027
   98   HG13  ILE  12          3HG1      ILE  12   4.177  -2.115 -20.788
   99   HG21  ILE  12          1HG2      ILE  12   6.600  -3.334 -19.834
  100   HG22  ILE  12          2HG2      ILE  12   6.749  -2.723 -18.187
  101   HG23  ILE  12          3HG2      ILE  12   6.227  -4.384 -18.467
  102   HD11  ILE  12          3HD1      ILE  12   3.617  -0.674 -18.272
  103   HD12  ILE  12          1HD1      ILE  12   3.970   0.299 -19.700
  104   HD13  ILE  12          2HD1      ILE  12   2.635  -0.853 -19.726
  105    H    LEU  13           H        LEU  13   5.329  -6.096 -19.418
  106    HA   LEU  13           HA       LEU  13   6.461  -5.880 -21.924
  107    HB2  LEU  13           2HB      LEU  13   6.827  -7.570 -19.945
  108    HB3  LEU  13           3HB      LEU  13   5.735  -8.581 -20.890
  109    HG   LEU  13           HG       LEU  13   7.516  -7.922 -22.797
  110   HD11  LEU  13          1HD1      LEU  13   9.039  -7.925 -20.198
  111   HD12  LEU  13          2HD1      LEU  13   8.951  -6.623 -21.384
  112   HD13  LEU  13          3HD1      LEU  13   9.775  -8.129 -21.788
  113   HD21  LEU  13          3HD2      LEU  13   8.721 -10.113 -21.785
  114   HD22  LEU  13          1HD2      LEU  13   7.211 -10.151 -22.695
  115   HD23  LEU  13          2HD2      LEU  13   7.178 -10.176 -20.932
  Start of MODEL    4
    1    H1   PHE   1           H        PHE   1   1.778  -0.757   0.894
    2    HA   PHE   1           HA       PHE   1   2.605   0.769  -1.263
    3    HB2  PHE   1           2HB      PHE   1   4.249  -0.764  -1.445
    4    HB3  PHE   1           3HB      PHE   1   3.540  -1.473   0.002
    5    HD1  PHE   1           HD1      PHE   1   1.816  -3.310  -0.291
    6    HD2  PHE   1           HD2      PHE   1   4.336  -1.959  -3.443
    7    HE1  PHE   1           HE1      PHE   1   1.392  -5.399  -1.520
    8    HE2  PHE   1           HE2      PHE   1   3.916  -4.046  -4.678
    9    HZ   PHE   1           HZ       PHE   1   2.442  -5.769  -3.717
   10    H    LEU   2           H        LEU   2   2.771  -0.201  -3.578
   11    HA   LEU   2           HA       LEU   2   0.038  -0.911  -4.411
   12    HB2  LEU   2           2HB      LEU   2   2.092   0.901  -5.491
   13    HB3  LEU   2           3HB      LEU   2   1.228  -0.061  -6.688
   14    HG   LEU   2           HG       LEU   2  -0.870   0.885  -5.338
   15   HD11  LEU   2          1HD1      LEU   2   1.225   2.279  -4.152
   16   HD12  LEU   2          2HD1      LEU   2  -0.496   2.645  -4.039
   17   HD13  LEU   2          3HD1      LEU   2   0.492   3.426  -5.274
   18   HD21  LEU   2          3HD2      LEU   2   0.578   2.576  -7.364
   19   HD22  LEU   2          1HD2      LEU   2  -1.161   2.461  -7.088
   20   HD23  LEU   2          2HD2      LEU   2  -0.284   1.093  -7.776
   21    HA   PRO   3           HA       PRO   3   1.947  -4.808  -5.519
   22    HB2  PRO   3           2HB      PRO   3  -0.371  -6.010  -6.264
   23    HB3  PRO   3           3HB      PRO   3   0.110  -5.815  -4.574
   24    HG2  PRO   3           2HG      PRO   3  -1.791  -4.174  -6.203
   25    HG3  PRO   3           3HG      PRO   3  -1.955  -4.748  -4.533
   26    HD2  PRO   3           2HD      PRO   3  -1.206  -2.217  -5.137
   27    HD3  PRO   3           3HD      PRO   3  -0.622  -3.066  -3.692
   28    H    LEU   4           H        LEU   4   0.705  -2.406  -7.435
   29    HA   LEU   4           HA       LEU   4   0.738  -3.943  -9.914
   30    HB2  LEU   4           2HB      LEU   4   0.218  -1.006  -9.484
   31    HB3  LEU   4           3HB      LEU   4  -0.039  -1.908 -10.976
   32    HG   LEU   4           HG       LEU   4  -1.591  -2.173  -8.404
   33   HD11  LEU   4          1HD1      LEU   4  -2.352  -1.197 -11.152
   34   HD12  LEU   4          2HD1      LEU   4  -2.190  -0.217  -9.695
   35   HD13  LEU   4          3HD1      LEU   4  -3.468  -1.427  -9.806
   36   HD21  LEU   4          3HD2      LEU   4  -1.803  -3.744 -10.970
   37   HD22  LEU   4          1HD2      LEU   4  -2.974  -3.791  -9.652
   38   HD23  LEU   4          2HD2      LEU   4  -1.327  -4.365  -9.389
   39    H    ILE   5           H        ILE   5   2.713  -1.776  -8.081
   40    HA   ILE   5           HA       ILE   5   4.408  -0.899 -10.184
   41    HB   ILE   5           HB       ILE   5   5.727   0.103  -8.573
   42   HG12  ILE   5          2HG1      ILE   5   4.879  -2.117  -6.705
   43   HG13  ILE   5          3HG1      ILE   5   6.480  -1.847  -7.384
   44   HG21  ILE   5          1HG2      ILE   5   4.243   1.317  -7.367
   45   HG22  ILE   5          2HG2      ILE   5   3.084   0.450  -8.373
   46   HG23  ILE   5          3HG2      ILE   5   3.421  -0.109  -6.735
   47   HD11  ILE   5          3HD1      ILE   5   5.064  -0.159  -5.340
   48   HD12  ILE   5          1HD1      ILE   5   6.491  -1.166  -5.100
   49   HD13  ILE   5          2HD1      ILE   5   6.590   0.279  -6.107
   50    H    GLY   6           H        GLY   6   4.474  -3.650  -7.980
   51    HA2  GLY   6           2HA      GLY   6   7.079  -4.521  -8.877
   52    HA3  GLY   6           3HA      GLY   6   6.013  -5.376  -7.772
   53    H    ARG   7           H        ARG   7   3.914  -4.829 -10.050
   54    HA   ARG   7           HA       ARG   7   4.520  -7.330 -11.452
   55    HB2  ARG   7           2HB      ARG   7   2.397  -7.605 -10.629
   56    HB3  ARG   7           3HB      ARG   7   2.022  -5.889 -10.725
   57    HG2  ARG   7           2HG      ARG   7   2.393  -7.338 -13.280
   58    HG3  ARG   7           3HG      ARG   7   0.936  -7.687 -12.347
   59    HD2  ARG   7           2HD      ARG   7   0.948  -4.996 -12.222
   60    HD3  ARG   7           3HD      ARG   7   1.737  -5.235 -13.780
   61    HE   ARG   7           HE       ARG   7  -0.294  -5.796 -14.638
   62   HH11  ARG   7          1HH1      ARG   7  -0.369  -6.332 -11.199
   63   HH12  ARG   7          2HH1      ARG   7  -2.045  -6.772 -11.172
   64   HH21  ARG   7          1HH2      ARG   7  -2.501  -6.373 -14.616
   65   HH22  ARG   7          2HH2      ARG   7  -3.256  -6.795 -13.116
   66    H    VAL   8           H        VAL   8   3.877  -3.928 -11.980
   67    HA   VAL   8           HA       VAL   8   3.347  -3.778 -14.655
   68    HB   VAL   8           HB       VAL   8   3.540  -1.829 -13.108
   69   HG11  VAL   8          1HG1      VAL   8   5.492  -1.076 -12.266
   70   HG12  VAL   8          2HG1      VAL   8   6.015  -2.739 -12.543
   71   HG13  VAL   8          3HG1      VAL   8   6.400  -1.484 -13.722
   72   HG21  VAL   8          3HG2      VAL   8   5.092  -1.584 -15.684
   73   HG22  VAL   8          1HG2      VAL   8   3.336  -1.530 -15.530
   74   HG23  VAL   8          2HG2      VAL   8   4.324  -0.262 -14.804
   75    H    LEU   9           H        LEU   9   6.379  -4.595 -13.126
   76    HA   LEU   9           HA       LEU   9   8.181  -4.193 -15.182
   77    HB2  LEU   9           2HB      LEU   9   8.426  -5.144 -12.733
   78    HB3  LEU   9           3HB      LEU   9   8.376  -6.691 -13.575
   79    HG   LEU   9           HG       LEU   9  10.668  -5.989 -13.141
   80   HD11  LEU   9          1HD1      LEU   9  11.516  -6.564 -15.205
   81   HD12  LEU   9          2HD1      LEU   9  10.301  -5.636 -16.083
   82   HD13  LEU   9          3HD1      LEU   9   9.860  -7.162 -15.318
   83   HD21  LEU   9          3HD2      LEU   9  10.557  -3.773 -15.086
   84   HD22  LEU   9          1HD2      LEU   9  11.526  -3.957 -13.623
   85   HD23  LEU   9          2HD2      LEU   9   9.837  -3.462 -13.506
   86    H    SER  10           H        SER  10   6.043  -6.959 -14.622
   87    HA   SER  10           HA       SER  10   6.855  -8.078 -17.212
   88    HB2  SER  10           2HB      SER  10   6.466  -9.303 -14.758
   89    HB3  SER  10           3HB      SER  10   4.987  -9.683 -15.640
   90    HG   SER  10           HG       SER  10   6.563 -10.255 -17.408
   91    H    GLY  11           H        GLY  11   4.156  -6.727 -15.466
   92    HA2  GLY  11           2HA      GLY  11   2.088  -7.547 -17.215
   93    HA3  GLY  11           3HA      GLY  11   2.018  -6.185 -16.107
   94    H    ILE  12           H        ILE  12   4.478  -5.054 -17.453
   95    HA   ILE  12           HA       ILE  12   3.030  -3.564 -19.469
   96    HB   ILE  12           HB       ILE  12   4.632  -2.521 -17.802
   97   HG12  ILE  12          2HG1      ILE  12   5.789  -1.501 -20.209
   98   HG13  ILE  12          3HG1      ILE  12   4.111  -1.924 -20.533
   99   HG21  ILE  12          1HG2      ILE  12   6.755  -3.490 -19.700
  100   HG22  ILE  12          2HG2      ILE  12   6.969  -2.623 -18.180
  101   HG23  ILE  12          3HG2      ILE  12   6.390  -4.289 -18.171
  102   HD11  ILE  12          3HD1      ILE  12   3.787   0.185 -19.810
  103   HD12  ILE  12          1HD1      ILE  12   3.775  -0.614 -18.238
  104   HD13  ILE  12          2HD1      ILE  12   5.239   0.186 -18.809
  105    H    LEU  13           H        LEU  13   5.461  -6.050 -19.318
  106    HA   LEU  13           HA       LEU  13   6.674  -5.856 -21.787
  107    HB2  LEU  13           2HB      LEU  13   6.462  -7.782 -19.738
  108    HB3  LEU  13           3HB      LEU  13   6.091  -8.606 -21.252
  109    HG   LEU  13           HG       LEU  13   8.596  -6.992 -20.790
  110   HD11  LEU  13          1HD1      LEU  13   9.759  -9.002 -20.345
  111   HD12  LEU  13          2HD1      LEU  13   8.352  -9.989 -20.741
  112   HD13  LEU  13          3HD1      LEU  13   8.350  -8.998 -19.283
  113   HD21  LEU  13          3HD2      LEU  13   9.139  -8.786 -22.738
  114   HD22  LEU  13          1HD2      LEU  13   8.586  -7.138 -23.036
  115   HD23  LEU  13          2HD2      LEU  13   7.431  -8.472 -23.052
  Start of MODEL    5
    1    H1   PHE   1           H        PHE   1   1.947   0.167   0.897
    2    HA   PHE   1           HA       PHE   1   2.693   0.681  -1.285
    3    HB2  PHE   1           2HB      PHE   1   4.377  -0.806  -1.490
    4    HB3  PHE   1           3HB      PHE   1   3.705  -1.537  -0.035
    5    HD1  PHE   1           HD2      PHE   1   2.029  -3.421  -0.312
    6    HD2  PHE   1           HD1      PHE   1   4.473  -1.994  -3.491
    7    HE1  PHE   1           HE2      PHE   1   1.651  -5.519  -1.540
    8    HE2  PHE   1           HE1      PHE   1   4.097  -4.089  -4.725
    9    HZ   PHE   1           HZ       PHE   1   2.685  -5.855  -3.749
   10    H    LEU   2           H        LEU   2   2.857  -0.281  -3.604
   11    HA   LEU   2           HA       LEU   2   0.137  -1.067  -4.405
   12    HB2  LEU   2           2HB      LEU   2   2.122   0.807  -5.504
   13    HB3  LEU   2           3HB      LEU   2   1.276  -0.179  -6.695
   14    HG   LEU   2           HG       LEU   2  -0.857   0.677  -5.424
   15   HD11  LEU   2          1HD1      LEU   2   1.301   2.567  -4.585
   16   HD12  LEU   2          2HD1      LEU   2  -0.024   1.888  -3.641
   17   HD13  LEU   2          3HD1      LEU   2  -0.346   3.148  -4.832
   18   HD21  LEU   2          3HD2      LEU   2   0.812   2.037  -7.494
   19   HD22  LEU   2          1HD2      LEU   2  -0.669   2.803  -6.920
   20   HD23  LEU   2          2HD2      LEU   2  -0.735   1.205  -7.664
   21    HA   PRO   3           HA       PRO   3   2.141  -4.906  -5.545
   22    HB2  PRO   3           2HB      PRO   3  -0.150  -6.171  -6.266
   23    HB3  PRO   3           3HB      PRO   3   0.345  -5.967  -4.582
   24    HG2  PRO   3           2HG      PRO   3  -1.621  -4.377  -6.185
   25    HG3  PRO   3           3HG      PRO   3  -1.749  -4.958  -4.514
   26    HD2  PRO   3           2HD      PRO   3  -1.079  -2.406  -5.121
   27    HD3  PRO   3           3HD      PRO   3  -0.455  -3.241  -3.684
   28    H    LEU   4           H        LEU   4   0.810  -2.537  -7.441
   29    HA   LEU   4           HA       LEU   4   0.858  -4.067  -9.923
   30    HB2  LEU   4           2HB      LEU   4   0.254  -1.149  -9.474
   31    HB3  LEU   4           3HB      LEU   4   0.018  -2.046 -10.972
   32    HG   LEU   4           HG       LEU   4  -1.512  -2.376  -8.394
   33   HD11  LEU   4          1HD1      LEU   4  -2.223  -0.447  -9.624
   34   HD12  LEU   4          2HD1      LEU   4  -3.422  -1.721  -9.842
   35   HD13  LEU   4          3HD1      LEU   4  -2.271  -1.365 -11.129
   36   HD21  LEU   4          3HD2      LEU   4  -1.720  -3.932 -10.970
   37   HD22  LEU   4          1HD2      LEU   4  -2.837  -4.045  -9.610
   38   HD23  LEU   4          2HD2      LEU   4  -1.159  -4.552  -9.417
   39    H    ILE   5           H        ILE   5   2.791  -1.848  -8.109
   40    HA   ILE   5           HA       ILE   5   4.436  -0.919 -10.229
   41    HB   ILE   5           HB       ILE   5   5.745   0.116  -8.630
   42   HG12  ILE   5          2HG1      ILE   5   4.981  -2.130  -6.758
   43   HG13  ILE   5          3HG1      ILE   5   6.566  -1.814  -7.454
   44   HG21  ILE   5          1HG2      ILE   5   4.242   1.286  -7.405
   45   HG22  ILE   5          2HG2      ILE   5   3.096   0.389  -8.400
   46   HG23  ILE   5          3HG2      ILE   5   3.467  -0.164  -6.767
   47   HD11  ILE   5          3HD1      ILE   5   6.710  -1.087  -5.242
   48   HD12  ILE   5          1HD1      ILE   5   6.502   0.387  -6.186
   49   HD13  ILE   5          2HD1      ILE   5   5.135  -0.296  -5.306
   50    H    GLY   6           H        GLY   6   4.605  -3.672  -8.033
   51    HA2  GLY   6           2HA      GLY   6   7.223  -4.467  -8.964
   52    HA3  GLY   6           3HA      GLY   6   6.197  -5.353  -7.846
   53    H    ARG   7           H        ARG   7   4.057  -4.858 -10.102
   54    HA   ARG   7           HA       ARG   7   4.715  -7.342 -11.513
   55    HB2  ARG   7           2HB      ARG   7   2.611  -7.675 -10.660
   56    HB3  ARG   7           3HB      ARG   7   2.185  -5.972 -10.756
   57    HG2  ARG   7           2HG      ARG   7   2.568  -7.415 -13.311
   58    HG3  ARG   7           3HG      ARG   7   1.134  -7.806 -12.360
   59    HD2  ARG   7           2HD      ARG   7   1.191  -5.062 -12.275
   60    HD3  ARG   7           3HD      ARG   7   1.772  -5.411 -13.903
   61    HE   ARG   7           HE       ARG   7  -0.601  -6.864 -13.173
   62   HH11  ARG   7          1HH1      ARG   7   0.659  -3.907 -14.510
   63   HH12  ARG   7          2HH1      ARG   7  -0.791  -3.529 -15.380
   64   HH21  ARG   7          1HH2      ARG   7  -2.515  -6.378 -14.315
   65   HH22  ARG   7          2HH2      ARG   7  -2.596  -4.936 -15.268
   66    H    VAL   8           H        VAL   8   3.973  -3.958 -12.026
   67    HA   VAL   8           HA       VAL   8   3.400  -3.814 -14.691
   68    HB   VAL   8           HB       VAL   8   3.565  -1.862 -13.155
   69   HG11  VAL   8          1HG1      VAL   8   5.502  -1.081 -12.308
   70   HG12  VAL   8          2HG1      VAL   8   6.067  -2.725 -12.607
   71   HG13  VAL   8          3HG1      VAL   8   6.413  -1.447 -13.773
   72   HG21  VAL   8          3HG2      VAL   8   4.423  -0.284 -14.864
   73   HG22  VAL   8          1HG2      VAL   8   5.041  -1.661 -15.777
   74   HG23  VAL   8          2HG2      VAL   8   3.306  -1.480 -15.521
   75    H    LEU   9           H        LEU   9   6.480  -4.551 -13.213
   76    HA   LEU   9           HA       LEU   9   8.237  -4.107 -15.295
   77    HB2  LEU   9           2HB      LEU   9   8.327  -6.494 -13.462
   78    HB3  LEU   9           3HB      LEU   9   9.683  -5.725 -14.284
   79    HG   LEU   9           HG       LEU   9   8.174  -3.992 -12.438
   80   HD11  LEU   9          1HD1      LEU   9   8.608  -5.028 -10.484
   81   HD12  LEU   9          2HD1      LEU   9  10.093  -5.769 -11.078
   82   HD13  LEU   9          3HD1      LEU   9   8.531  -6.479 -11.484
   83   HD21  LEU   9          3HD2      LEU   9  10.160  -2.923 -12.256
   84   HD22  LEU   9          1HD2      LEU   9  10.480  -3.753 -13.779
   85   HD23  LEU   9          2HD2      LEU   9  11.094  -4.419 -12.265
   86    H    SER  10           H        SER  10   6.180  -6.931 -14.708
   87    HA   SER  10           HA       SER  10   6.973  -8.019 -17.317
   88    HB2  SER  10           2HB      SER  10   6.339  -9.209 -14.773
   89    HB3  SER  10           3HB      SER  10   5.242  -9.826 -16.007
   90    HG   SER  10           HG       SER  10   8.071  -9.758 -16.238
   91    H    GLY  11           H        GLY  11   4.272  -6.740 -15.519
   92    HA2  GLY  11           2HA      GLY  11   2.195  -7.606 -17.235
   93    HA3  GLY  11           3HA      GLY  11   2.110  -6.249 -16.121
   94    H    ILE  12           H        ILE  12   4.517  -5.054 -17.506
   95    HA   ILE  12           HA       ILE  12   2.998  -3.596 -19.492
   96    HB   ILE  12           HB       ILE  12   4.601  -2.517 -17.849
   97   HG12  ILE  12          2HG1      ILE  12   5.659  -1.100 -19.830
   98   HG13  ILE  12          3HG1      ILE  12   4.533  -2.046 -20.797
   99   HG21  ILE  12          1HG2      ILE  12   6.761  -3.283 -19.775
  100   HG22  ILE  12          2HG2      ILE  12   6.903  -2.637 -18.141
  101   HG23  ILE  12          3HG2      ILE  12   6.381  -4.303 -18.388
  102   HD11  ILE  12          3HD1      ILE  12   3.193  -1.014 -18.491
  103   HD12  ILE  12          1HD1      ILE  12   4.016   0.290 -19.347
  104   HD13  ILE  12          2HD1      ILE  12   2.860  -0.734 -20.200
  105    H    LEU  13           H        LEU  13   5.494  -6.019 -19.390
  106    HA   LEU  13           HA       LEU  13   6.659  -5.788 -21.879
  107    HB2  LEU  13           2HB      LEU  13   7.388  -7.383 -20.187
  108    HB3  LEU  13           3HB      LEU  13   5.909  -8.314 -20.413
  109    HG   LEU  13           HG       LEU  13   7.507  -7.950 -22.850
  110   HD11  LEU  13          1HD1      LEU  13   8.966  -9.944 -21.939
  111   HD12  LEU  13          2HD1      LEU  13   8.662  -9.157 -20.390
  112   HD13  LEU  13          3HD1      LEU  13   9.449  -8.266 -21.692
  113   HD21  LEU  13          3HD2      LEU  13   7.113 -10.561 -22.647
  114   HD22  LEU  13          1HD2      LEU  13   5.834  -9.463 -23.166
  115   HD23  LEU  13          2HD2      LEU  13   5.881 -10.036 -21.498
  Start of MODEL    6
    1    H1   PHE   1           H        PHE   1   1.898  -0.235   0.758
    2    HA   PHE   1           HA       PHE   1   2.758   1.312  -1.460
    3    HB2  PHE   1           2HB      PHE   1   4.435  -0.191  -1.587
    4    HB3  PHE   1           3HB      PHE   1   3.790  -0.810  -0.070
    5    HD1  PHE   1           HD2      PHE   1   2.107  -2.705  -0.175
    6    HD2  PHE   1           HD1      PHE   1   4.492  -1.523  -3.497
    7    HE1  PHE   1           HE2      PHE   1   1.701  -4.886  -1.239
    8    HE2  PHE   1           HE1      PHE   1   4.089  -3.702  -4.566
    9    HZ   PHE   1           HZ       PHE   1   2.694  -5.388  -3.436
   10    H    LEU   2           H        LEU   2   2.877   0.182  -3.704
   11    HA   LEU   2           HA       LEU   2   0.141  -0.652  -4.395
   12    HB2  LEU   2           2HB      LEU   2   2.108   1.131  -5.664
   13    HB3  LEU   2           3HB      LEU   2   1.242   0.061  -6.765
   14    HG   LEU   2           HG       LEU   2   0.168   2.238  -6.635
   15   HD11  LEU   2          1HD1      LEU   2  -1.893   1.363  -6.749
   16   HD12  LEU   2          2HD1      LEU   2  -1.797   0.661  -5.134
   17   HD13  LEU   2          3HD1      LEU   2  -1.065  -0.175  -6.504
   18   HD21  LEU   2          3HD2      LEU   2   0.959   2.450  -4.132
   19   HD22  LEU   2          1HD2      LEU   2  -0.637   1.774  -3.808
   20   HD23  LEU   2          2HD2      LEU   2  -0.485   3.284  -4.707
   21    HA   PRO   3           HA       PRO   3   2.117  -4.571  -5.286
   22    HB2  PRO   3           2HB      PRO   3  -0.190  -5.879  -5.869
   23    HB3  PRO   3           3HB      PRO   3   0.338  -5.552  -4.213
   24    HG2  PRO   3           2HG      PRO   3  -1.656  -4.079  -5.892
   25    HG3  PRO   3           3HG      PRO   3  -1.753  -4.535  -4.181
   26    HD2  PRO   3           2HD      PRO   3  -1.090  -2.036  -4.987
   27    HD3  PRO   3           3HD      PRO   3  -0.440  -2.765  -3.505
   28    H    LEU   4           H        LEU   4   0.753  -2.343  -7.326
   29    HA   LEU   4           HA       LEU   4   0.752  -4.053  -9.689
   30    HB2  LEU   4           2HB      LEU   4   0.167  -1.106  -9.452
   31    HB3  LEU   4           3HB      LEU   4  -0.111  -2.118 -10.868
   32    HG   LEU   4           HG       LEU   4  -1.578  -2.234  -8.236
   33   HD11  LEU   4          1HD1      LEU   4  -2.403  -1.441 -11.022
   34   HD12  LEU   4          2HD1      LEU   4  -2.307  -0.402  -9.600
   35   HD13  LEU   4          3HD1      LEU   4  -3.520  -1.680  -9.678
   36   HD21  LEU   4          3HD2      LEU   4  -2.935  -3.989  -9.272
   37   HD22  LEU   4          1HD2      LEU   4  -1.250  -4.485  -9.103
   38   HD23  LEU   4          2HD2      LEU   4  -1.868  -3.983 -10.677
   39    H    ILE   5           H        ILE   5   2.723  -1.712  -8.080
   40    HA   ILE   5           HA       ILE   5   4.329  -0.948 -10.294
   41    HB   ILE   5           HB       ILE   5   5.670   0.199  -8.801
   42   HG12  ILE   5          2HG1      ILE   5   4.938  -1.900  -6.754
   43   HG13  ILE   5          3HG1      ILE   5   6.510  -1.642  -7.501
   44   HG21  ILE   5          1HG2      ILE   5   4.192   1.461  -7.638
   45   HG22  ILE   5          2HG2      ILE   5   3.027   0.495  -8.541
   46   HG23  ILE   5          3HG2      ILE   5   3.428   0.064  -6.879
   47   HD11  ILE   5          3HD1      ILE   5   6.034   0.780  -6.355
   48   HD12  ILE   5          1HD1      ILE   5   5.277  -0.325  -5.209
   49   HD13  ILE   5          2HD1      ILE   5   6.978  -0.523  -5.632
   50    H    GLY   6           H        GLY   6   4.535  -3.531  -7.904
   51    HA2  GLY   6           2HA      GLY   6   7.134  -4.401  -8.820
   52    HA3  GLY   6           3HA      GLY   6   6.125  -5.200  -7.624
   53    H    ARG   7           H        ARG   7   3.944  -4.869  -9.865
   54    HA   ARG   7           HA       ARG   7   4.573  -7.449 -11.105
   55    HB2  ARG   7           2HB      ARG   7   2.484  -7.714 -10.195
   56    HB3  ARG   7           3HB      ARG   7   2.061  -6.020 -10.403
   57    HG2  ARG   7           2HG      ARG   7   2.393  -7.642 -12.857
   58    HG3  ARG   7           3HG      ARG   7   0.976  -7.959 -11.854
   59    HD2  ARG   7           2HD      ARG   7   1.086  -5.201 -11.983
   60    HD3  ARG   7           3HD      ARG   7   1.561  -5.712 -13.602
   61    HE   ARG   7           HE       ARG   7  -0.794  -7.026 -12.592
   62   HH11  ARG   7          1HH1      ARG   7   0.453  -4.267 -14.311
   63   HH12  ARG   7          2HH1      ARG   7  -1.036  -3.945 -15.137
   64   HH21  ARG   7          1HH2      ARG   7  -2.759  -6.612 -13.674
   65   HH22  ARG   7          2HH2      ARG   7  -2.862  -5.279 -14.774
   66    H    VAL   8           H        VAL   8   3.823  -4.111 -11.851
   67    HA   VAL   8           HA       VAL   8   3.208  -4.164 -14.512
   68    HB   VAL   8           HB       VAL   8   3.396  -2.106 -13.115
   69   HG11  VAL   8          1HG1      VAL   8   5.353  -1.248 -12.391
   70   HG12  VAL   8          2HG1      VAL   8   5.911  -2.913 -12.566
   71   HG13  VAL   8          3HG1      VAL   8   6.227  -1.738 -13.842
   72   HG21  VAL   8          3HG2      VAL   8   3.165  -2.066 -15.594
   73   HG22  VAL   8          1HG2      VAL   8   3.982  -0.651 -14.931
   74   HG23  VAL   8          2HG2      VAL   8   4.919  -1.925 -15.712
   75    H    LEU   9           H        LEU   9   6.306  -4.796 -13.029
   76    HA   LEU   9           HA       LEU   9   8.033  -4.499 -15.166
   77    HB2  LEU   9           2HB      LEU   9   8.393  -5.252 -12.672
   78    HB3  LEU   9           3HB      LEU   9   8.330  -6.865 -13.378
   79    HG   LEU   9           HG       LEU   9  10.628  -6.091 -13.089
   80   HD11  LEU   9          1HD1      LEU   9   9.591  -7.339 -15.255
   81   HD12  LEU   9          2HD1      LEU   9  11.314  -7.082 -14.983
   82   HD13  LEU   9          3HD1      LEU   9  10.409  -5.974 -16.015
   83   HD21  LEU   9          3HD2      LEU   9  11.376  -4.071 -13.695
   84   HD22  LEU   9          1HD2      LEU   9   9.672  -3.626 -13.788
   85   HD23  LEU   9          2HD2      LEU   9  10.535  -4.120 -15.245
   86    H    SER  10           H        SER  10   5.987  -7.269 -14.342
   87    HA   SER  10           HA       SER  10   6.747  -8.550 -16.872
   88    HB2  SER  10           2HB      SER  10   6.426  -9.594 -14.308
   89    HB3  SER  10           3HB      SER  10   4.975 -10.108 -15.169
   90    HG   SER  10           HG       SER  10   7.643 -10.780 -15.604
   91    H    GLY  11           H        GLY  11   4.069  -7.143 -15.137
   92    HA2  GLY  11           2HA      GLY  11   1.967  -8.136 -16.746
   93    HA3  GLY  11           3HA      GLY  11   1.901  -6.693 -15.746
   94    H    ILE  12           H        ILE  12   4.312  -5.663 -17.292
   95    HA   ILE  12           HA       ILE  12   2.749  -4.386 -19.383
   96    HB   ILE  12           HB       ILE  12   4.305  -3.122 -17.827
   97   HG12  ILE  12          2HG1      ILE  12   5.267  -2.484 -20.540
   98   HG13  ILE  12          3HG1      ILE  12   3.519  -2.621 -20.389
   99   HG21  ILE  12          1HG2      ILE  12   6.484  -4.064 -19.664
  100   HG22  ILE  12          2HG2      ILE  12   6.627  -3.165 -18.155
  101   HG23  ILE  12          3HG2      ILE  12   6.145  -4.861 -18.129
  102   HD11  ILE  12          3HD1      ILE  12   5.272  -0.840 -18.714
  103   HD12  ILE  12          1HD1      ILE  12   4.311  -0.325 -20.100
  104   HD13  ILE  12          2HD1      ILE  12   3.513  -0.939 -18.652
  105    H    LEU  13           H        LEU  13   5.312  -6.718 -19.045
  106    HA   LEU  13           HA       LEU  13   5.058  -7.481 -21.801
  107    HB2  LEU  13           2HB      LEU  13   6.589  -5.772 -22.256
  108    HB3  LEU  13           3HB      LEU  13   7.521  -6.099 -20.796
  109    HG   LEU  13           HG       LEU  13   7.535  -8.363 -22.608
  110   HD11  LEU  13          1HD1      LEU  13   7.300  -6.311 -24.159
  111   HD12  LEU  13          2HD1      LEU  13   8.581  -7.480 -24.477
  112   HD13  LEU  13          3HD1      LEU  13   8.958  -5.957 -23.674
  113   HD21  LEU  13          3HD2      LEU  13   9.806  -8.409 -22.078
  114   HD22  LEU  13          1HD2      LEU  13   9.050  -7.750 -20.627
  115   HD23  LEU  13          2HD2      LEU  13   9.866  -6.674 -21.763
  Start of MODEL    7
    1    H1   PHE   1           H        PHE   1   2.223  -0.677   0.840
    2    HA   PHE   1           HA       PHE   1   2.960   0.790  -1.365
    3    HB2  PHE   1           2HB      PHE   1   4.591  -0.752  -1.589
    4    HB3  PHE   1           3HB      PHE   1   3.922  -1.452  -0.119
    5    HD1  PHE   1           HD2      PHE   1   2.183  -3.283  -0.353
    6    HD2  PHE   1           HD1      PHE   1   4.612  -1.954  -3.585
    7    HE1  PHE   1           HE2      PHE   1   1.714  -5.375  -1.561
    8    HE2  PHE   1           HE1      PHE   1   4.147  -4.043  -4.799
    9    HZ   PHE   1           HZ       PHE   1   2.697  -5.757  -3.786
   10    H    LEU   2           H        LEU   2   3.050  -0.190  -3.679
   11    HA   LEU   2           HA       LEU   2   0.291  -0.894  -4.426
   12    HB2  LEU   2           2HB      LEU   2   2.315   0.909  -5.573
   13    HB3  LEU   2           3HB      LEU   2   1.416  -0.056  -6.742
   14    HG   LEU   2           HG       LEU   2  -0.100   1.480  -4.685
   15   HD11  LEU   2          1HD1      LEU   2  -0.012   3.500  -5.909
   16   HD12  LEU   2          2HD1      LEU   2   0.878   2.747  -7.231
   17   HD13  LEU   2          3HD1      LEU   2   1.661   2.994  -5.671
   18   HD21  LEU   2          3HD2      LEU   2  -1.633   1.715  -6.667
   19   HD22  LEU   2          1HD2      LEU   2  -1.389   0.067  -6.088
   20   HD23  LEU   2          2HD2      LEU   2  -0.551   0.625  -7.536
   21    HA   PRO   3           HA       PRO   3   2.151  -4.801  -5.577
   22    HB2  PRO   3           2HB      PRO   3  -0.192  -5.997  -6.250
   23    HB3  PRO   3           3HB      PRO   3   0.340  -5.799  -4.576
   24    HG2  PRO   3           2HG      PRO   3  -1.603  -4.156  -6.153
   25    HG3  PRO   3           3HG      PRO   3  -1.719  -4.723  -4.477
   26    HD2  PRO   3           2HD      PRO   3  -0.979  -2.197  -5.112
   27    HD3  PRO   3           3HD      PRO   3  -0.356  -3.043  -3.681
   28    H    LEU   4           H        LEU   4   0.863  -2.401  -7.464
   29    HA   LEU   4           HA       LEU   4   0.817  -3.947  -9.938
   30    HB2  LEU   4           2HB      LEU   4   0.318  -1.007  -9.502
   31    HB3  LEU   4           3HB      LEU   4   0.016  -1.912 -10.984
   32    HG   LEU   4           HG       LEU   4  -1.461  -2.168  -8.367
   33   HD11  LEU   4          1HD1      LEU   4  -3.382  -1.456  -9.778
   34   HD12  LEU   4          2HD1      LEU   4  -2.244  -1.136 -11.087
   35   HD13  LEU   4          3HD1      LEU   4  -2.137  -0.221  -9.583
   36   HD21  LEU   4          3HD2      LEU   4  -1.753  -3.739 -10.925
   37   HD22  LEU   4          1HD2      LEU   4  -2.887  -3.780  -9.575
   38   HD23  LEU   4          2HD2      LEU   4  -1.236  -4.361  -9.357
   39    H    ILE   5           H        ILE   5   2.852  -1.779  -8.172
   40    HA   ILE   5           HA       ILE   5   4.487  -0.915 -10.327
   41    HB   ILE   5           HB       ILE   5   5.857   0.086  -8.758
   42   HG12  ILE   5          2HG1      ILE   5   5.055  -2.124  -6.859
   43   HG13  ILE   5          3HG1      ILE   5   6.637  -1.863  -7.585
   44   HG21  ILE   5          1HG2      ILE   5   4.414   1.310  -7.514
   45   HG22  ILE   5          2HG2      ILE   5   3.222   0.444  -8.482
   46   HG23  ILE   5          3HG2      ILE   5   3.606  -0.110  -6.852
   47   HD11  ILE   5          3HD1      ILE   5   6.147   0.497  -6.255
   48   HD12  ILE   5          1HD1      ILE   5   5.485  -0.735  -5.181
   49   HD13  ILE   5          2HD1      ILE   5   7.169  -0.828  -5.698
   50    H    GLY   6           H        GLY   6   4.609  -3.660  -8.118
   51    HA2  GLY   6           2HA      GLY   6   7.183  -4.543  -9.089
   52    HA3  GLY   6           3HA      GLY   6   6.148  -5.391  -7.950
   53    H    ARG   7           H        ARG   7   3.984  -4.843 -10.166
   54    HA   ARG   7           HA       ARG   7   4.540  -7.351 -11.578
   55    HB2  ARG   7           2HB      ARG   7   2.441  -7.615 -10.692
   56    HB3  ARG   7           3HB      ARG   7   2.069  -5.898 -10.782
   57    HG2  ARG   7           2HG      ARG   7   2.359  -7.356 -13.342
   58    HG3  ARG   7           3HG      ARG   7   0.929  -7.697 -12.366
   59    HD2  ARG   7           2HD      ARG   7   0.963  -5.003 -12.251
   60    HD3  ARG   7           3HD      ARG   7   1.692  -5.257 -13.836
   61    HE   ARG   7           HE       ARG   7  -0.373  -5.811 -14.613
   62   HH11  ARG   7          1HH1      ARG   7  -0.325  -6.320 -11.170
   63   HH12  ARG   7          2HH1      ARG   7  -2.001  -6.747 -11.078
   64   HH21  ARG   7          1HH2      ARG   7  -2.582  -6.372 -14.505
   65   HH22  ARG   7          2HH2      ARG   7  -3.284  -6.778 -12.976
   66    H    VAL   8           H        VAL   8   3.893  -3.948 -12.097
   67    HA   VAL   8           HA       VAL   8   3.285  -3.802 -14.756
   68    HB   VAL   8           HB       VAL   8   3.530  -1.851 -13.222
   69   HG11  VAL   8          1HG1      VAL   8   6.017  -2.769 -12.726
   70   HG12  VAL   8          2HG1      VAL   8   6.373  -1.518 -13.918
   71   HG13  VAL   8          3HG1      VAL   8   5.508  -1.106 -12.437
   72   HG21  VAL   8          3HG2      VAL   8   3.837  -1.983 -15.960
   73   HG22  VAL   8          1HG2      VAL   8   3.524  -0.525 -15.018
   74   HG23  VAL   8          2HG2      VAL   8   5.179  -0.960 -15.447
   75    H    LEU   9           H        LEU   9   6.358  -4.626 -13.315
   76    HA   LEU   9           HA       LEU   9   8.099  -4.237 -15.425
   77    HB2  LEU   9           2HB      LEU   9   8.023  -6.394 -13.330
   78    HB3  LEU   9           3HB      LEU   9   9.359  -6.203 -14.463
   79    HG   LEU   9           HG       LEU   9   9.224  -3.709 -13.406
   80   HD11  LEU   9          1HD1      LEU   9   7.568  -5.187 -11.736
   81   HD12  LEU   9          2HD1      LEU   9   8.280  -3.610 -11.398
   82   HD13  LEU   9          3HD1      LEU   9   9.099  -5.079 -10.867
   83   HD21  LEU   9          3HD2      LEU   9  11.268  -4.195 -12.476
   84   HD22  LEU   9          1HD2      LEU   9  11.107  -5.512 -13.638
   85   HD23  LEU   9          2HD2      LEU   9  10.763  -5.795 -11.931
   86    H    SER  10           H        SER  10   5.969  -6.994 -14.794
   87    HA   SER  10           HA       SER  10   6.698  -8.123 -17.404
   88    HB2  SER  10           2HB      SER  10   6.537  -9.395 -15.027
   89    HB3  SER  10           3HB      SER  10   4.886  -9.628 -15.602
   90    HG   SER  10           HG       SER  10   6.208 -11.315 -16.318
   91    H    GLY  11           H        GLY  11   4.058  -6.756 -15.581
   92    HA2  GLY  11           2HA      GLY  11   1.933  -7.574 -17.257
   93    HA3  GLY  11           3HA      GLY  11   1.907  -6.200 -16.161
   94    H    ILE  12           H        ILE  12   4.360  -5.156 -17.641
   95    HA   ILE  12           HA       ILE  12   2.840  -3.695 -19.645
   96    HB   ILE  12           HB       ILE  12   4.413  -2.576 -17.998
   97   HG12  ILE  12          2HG1      ILE  12   5.555  -1.479 -20.329
   98   HG13  ILE  12          3HG1      ILE  12   3.974  -2.089 -20.806
   99   HG21  ILE  12          1HG2      ILE  12   6.201  -4.420 -18.640
  100   HG22  ILE  12          2HG2      ILE  12   6.653  -3.210 -19.839
  101   HG23  ILE  12          3HG2      ILE  12   6.678  -2.803 -18.124
  102   HD11  ILE  12          3HD1      ILE  12   3.064  -0.259 -19.975
  103   HD12  ILE  12          1HD1      ILE  12   3.612  -0.739 -18.369
  104   HD13  ILE  12          2HD1      ILE  12   4.632   0.286 -19.379
  105    H    LEU  13           H        LEU  13   5.341  -6.107 -19.444
  106    HA   LEU  13           HA       LEU  13   6.256  -5.860 -22.136
  107    HB2  LEU  13           2HB      LEU  13   7.494  -6.902 -20.189
  108    HB3  LEU  13           3HB      LEU  13   6.446  -8.304 -20.393
  109    HG   LEU  13           HG       LEU  13   7.406  -8.098 -22.893
  110   HD11  LEU  13          1HD1      LEU  13   9.921  -7.716 -22.525
  111   HD12  LEU  13          2HD1      LEU  13   9.427  -6.820 -21.089
  112   HD13  LEU  13          3HD1      LEU  13   8.873  -6.306 -22.682
  113   HD21  LEU  13          3HD2      LEU  13   8.344  -9.547 -20.466
  114   HD22  LEU  13          1HD2      LEU  13   9.279  -9.684 -21.956
  115   HD23  LEU  13          2HD2      LEU  13   7.584 -10.170 -21.931
  Start of MODEL    8
    1    H1   PHE   1           H        PHE   1   2.114  -0.347   1.035
    2    HA   PHE   1           HA       PHE   1   2.740   0.614  -1.222
    3    HB2  PHE   1           2HB      PHE   1   4.395  -0.904  -1.426
    4    HB3  PHE   1           3HB      PHE   1   3.705  -1.626   0.024
    5    HD1  PHE   1           HD2      PHE   1   1.995  -3.478  -0.264
    6    HD2  PHE   1           HD1      PHE   1   4.473  -2.086  -3.432
    7    HE1  PHE   1           HE2      PHE   1   1.579  -5.563  -1.501
    8    HE2  PHE   1           HE1      PHE   1   4.061  -4.169  -4.674
    9    HZ   PHE   1           HZ       PHE   1   2.613  -5.912  -3.709
   10    H    LEU   2           H        LEU   2   2.890  -0.343  -3.543
   11    HA   LEU   2           HA       LEU   2   0.157  -1.075  -4.352
   12    HB2  LEU   2           2HB      LEU   2   2.180   0.764  -5.442
   13    HB3  LEU   2           3HB      LEU   2   1.316  -0.200  -6.637
   14    HG   LEU   2           HG       LEU   2  -0.761   0.735  -5.194
   15   HD11  LEU   2          1HD1      LEU   2   0.428   3.313  -5.306
   16   HD12  LEU   2          2HD1      LEU   2   1.446   2.273  -4.311
   17   HD13  LEU   2          3HD1      LEU   2  -0.261   2.473  -3.917
   18   HD21  LEU   2          3HD2      LEU   2  -0.639   2.685  -6.975
   19   HD22  LEU   2          1HD2      LEU   2  -0.961   1.017  -7.448
   20   HD23  LEU   2          2HD2      LEU   2   0.662   1.685  -7.624
   21    HA   PRO   3           HA       PRO   3   2.091  -4.946  -5.501
   22    HB2  PRO   3           2HB      PRO   3  -0.222  -6.165  -6.233
   23    HB3  PRO   3           3HB      PRO   3   0.272  -5.976  -4.546
   24    HG2  PRO   3           2HG      PRO   3  -1.659  -4.344  -6.148
   25    HG3  PRO   3           3HG      PRO   3  -1.802  -4.928  -4.480
   26    HD2  PRO   3           2HD      PRO   3  -1.082  -2.387  -5.077
   27    HD3  PRO   3           3HD      PRO   3  -0.478  -3.239  -3.641
   28    H    LEU   4           H        LEU   4   0.811  -2.545  -7.392
   29    HA   LEU   4           HA       LEU   4   0.836  -4.068  -9.880
   30    HB2  LEU   4           2HB      LEU   4   0.290  -1.138  -9.429
   31    HB3  LEU   4           3HB      LEU   4   0.030  -2.035 -10.924
   32    HG   LEU   4           HG       LEU   4  -1.496  -2.335  -8.339
   33   HD11  LEU   4          1HD1      LEU   4  -2.101  -0.366  -9.633
   34   HD12  LEU   4          2HD1      LEU   4  -3.389  -1.569  -9.684
   35   HD13  LEU   4          3HD1      LEU   4  -2.320  -1.363 -11.072
   36   HD21  LEU   4          3HD2      LEU   4  -1.203  -4.512  -9.375
   37   HD22  LEU   4          1HD2      LEU   4  -1.749  -3.870 -10.924
   38   HD23  LEU   4          2HD2      LEU   4  -2.869  -3.962  -9.564
   39    H    ILE   5           H        ILE   5   2.805  -1.891  -8.053
   40    HA   ILE   5           HA       ILE   5   4.472  -0.985 -10.165
   41    HB   ILE   5           HB       ILE   5   5.797   0.019  -8.558
   42   HG12  ILE   5          2HG1      ILE   5   4.985  -2.219  -6.697
   43   HG13  ILE   5          3HG1      ILE   5   6.578  -1.931  -7.388
   44   HG21  ILE   5          1HG2      ILE   5   4.313   1.212  -7.333
   45   HG22  ILE   5          2HG2      ILE   5   3.153   0.340  -8.334
   46   HG23  ILE   5          3HG2      ILE   5   3.510  -0.225  -6.702
   47   HD11  ILE   5          3HD1      ILE   5   6.524   0.281  -6.114
   48   HD12  ILE   5          1HD1      ILE   5   5.173  -0.420  -5.222
   49   HD13  ILE   5          2HD1      ILE   5   6.754  -1.202  -5.188
   50    H    GLY   6           H        GLY   6   4.587  -3.748  -7.978
   51    HA2  GLY   6           2HA      GLY   6   7.192  -4.588  -8.902
   52    HA3  GLY   6           3HA      GLY   6   6.142  -5.462  -7.797
   53    H    ARG   7           H        ARG   7   4.021  -4.919 -10.053
   54    HA   ARG   7           HA       ARG   7   4.642  -7.402 -11.481
   55    HB2  ARG   7           2HB      ARG   7   2.529  -7.704 -10.642
   56    HB3  ARG   7           3HB      ARG   7   2.134  -5.992 -10.726
   57    HG2  ARG   7           2HG      ARG   7   2.503  -7.423 -13.291
   58    HG3  ARG   7           3HG      ARG   7   1.057  -7.794 -12.350
   59    HD2  ARG   7           2HD      ARG   7   1.147  -5.060 -12.237
   60    HD3  ARG   7           3HD      ARG   7   1.758  -5.389 -13.858
   61    HE   ARG   7           HE       ARG   7  -0.652  -6.818 -13.191
   62   HH11  ARG   7          1HH1      ARG   7   0.690  -3.881 -14.494
   63   HH12  ARG   7          2HH1      ARG   7  -0.732  -3.479 -15.398
   64   HH21  ARG   7          1HH2      ARG   7  -2.530  -6.299 -14.378
   65   HH22  ARG   7          2HH2      ARG   7  -2.563  -4.855 -15.331
   66    H    VAL   8           H        VAL   8   3.961  -4.003 -11.975
   67    HA   VAL   8           HA       VAL   8   3.411  -3.839 -14.647
   68    HB   VAL   8           HB       VAL   8   3.588  -1.902 -13.081
   69   HG11  VAL   8          1HG1      VAL   8   6.436  -1.508 -13.723
   70   HG12  VAL   8          2HG1      VAL   8   5.538  -1.129 -12.252
   71   HG13  VAL   8          3HG1      VAL   8   6.084  -2.780 -12.554
   72   HG21  VAL   8          3HG2      VAL   8   4.146  -0.321 -14.764
   73   HG22  VAL   8          1HG2      VAL   8   5.196  -1.472 -15.590
   74   HG23  VAL   8          2HG2      VAL   8   3.449  -1.715 -15.591
   75    H    LEU   9           H        LEU   9   6.451  -4.652 -13.143
   76    HA   LEU   9           HA       LEU   9   8.240  -4.201 -15.206
   77    HB2  LEU   9           2HB      LEU   9   8.118  -6.260 -13.036
   78    HB3  LEU   9           3HB      LEU   9   9.420  -6.283 -14.224
   79    HG   LEU   9           HG       LEU   9  10.179  -5.191 -12.219
   80   HD11  LEU   9          1HD1      LEU   9  10.186  -4.020 -14.784
   81   HD12  LEU   9          2HD1      LEU   9  11.360  -3.809 -13.485
   82   HD13  LEU   9          3HD1      LEU   9   9.985  -2.713 -13.617
   83   HD21  LEU   9          3HD2      LEU   9   8.193  -2.988 -12.528
   84   HD22  LEU   9          1HD2      LEU   9   9.086  -3.511 -11.099
   85   HD23  LEU   9          2HD2      LEU   9   7.720  -4.463 -11.682
   86    H    SER  10           H        SER  10   6.141  -6.999 -14.652
   87    HA   SER  10           HA       SER  10   6.953  -8.091 -17.253
   88    HB2  SER  10           2HB      SER  10   6.747  -9.385 -14.888
   89    HB3  SER  10           3HB      SER  10   5.120  -9.644 -15.518
   90    HG   SER  10           HG       SER  10   6.881 -11.207 -16.094
   91    H    GLY  11           H        GLY  11   4.247  -6.783 -15.484
   92    HA2  GLY  11           2HA      GLY  11   2.180  -7.618 -17.226
   93    HA3  GLY  11           3HA      GLY  11   2.100  -6.261 -16.112
   94    H    ILE  12           H        ILE  12   4.539  -5.097 -17.467
   95    HA   ILE  12           HA       ILE  12   3.063  -3.615 -19.467
   96    HB   ILE  12           HB       ILE  12   4.663  -2.561 -17.806
   97   HG12  ILE  12          2HG1      ILE  12   5.712  -1.084 -19.676
   98   HG13  ILE  12          3HG1      ILE  12   4.767  -2.087 -20.771
   99   HG21  ILE  12          1HG2      ILE  12   6.780  -3.517 -19.719
  100   HG22  ILE  12          2HG2      ILE  12   7.002  -2.628 -18.213
  101   HG23  ILE  12          3HG2      ILE  12   6.440  -4.299 -18.175
  102   HD11  ILE  12          3HD1      ILE  12   3.348  -0.329 -20.420
  103   HD12  ILE  12          1HD1      ILE  12   2.800  -1.457 -19.180
  104   HD13  ILE  12          2HD1      ILE  12   3.854  -0.112 -18.744
  105    H    LEU  13           H        LEU  13   5.522  -6.074 -19.343
  106    HA   LEU  13           HA       LEU  13   6.717  -5.856 -21.819
  107    HB2  LEU  13           2HB      LEU  13   7.289  -7.483 -20.013
  108    HB3  LEU  13           3HB      LEU  13   5.896  -8.442 -20.508
  109    HG   LEU  13           HG       LEU  13   7.866  -7.822 -22.621
  110   HD11  LEU  13          1HD1      LEU  13   9.594  -8.375 -21.275
  111   HD12  LEU  13          2HD1      LEU  13   9.048 -10.012 -21.635
  112   HD13  LEU  13          3HD1      LEU  13   8.569  -9.235 -20.126
  113   HD21  LEU  13          3HD2      LEU  13   7.199 -10.577 -22.297
  114   HD22  LEU  13          1HD2      LEU  13   6.751  -9.471 -23.597
  115   HD23  LEU  13          2HD2      LEU  13   5.730  -9.609 -22.165
  Start of MODEL    9
    1    H1   PHE   1           H        PHE   1   1.825  -1.090   0.678
    2    HA   PHE   1           HA       PHE   1   2.879   0.684  -1.345
    3    HB2  PHE   1           2HB      PHE   1   4.532  -0.835  -1.566
    4    HB3  PHE   1           3HB      PHE   1   3.873  -1.539  -0.093
    5    HD1  PHE   1           HD2      PHE   1   2.159  -3.396  -0.322
    6    HD2  PHE   1           HD1      PHE   1   4.572  -2.044  -3.556
    7    HE1  PHE   1           HE2      PHE   1   1.721  -5.498  -1.523
    8    HE2  PHE   1           HE1      PHE   1   4.138  -4.143  -4.763
    9    HZ   PHE   1           HZ       PHE   1   2.712  -5.874  -3.746
   10    H    LEU   2           H        LEU   2   2.987  -0.303  -3.657
   11    HA   LEU   2           HA       LEU   2   0.239  -1.045  -4.406
   12    HB2  LEU   2           2HB      LEU   2   2.240   0.782  -5.554
   13    HB3  LEU   2           3HB      LEU   2   1.360  -0.201  -6.723
   14    HG   LEU   2           HG       LEU   2  -0.735   0.709  -5.404
   15   HD11  LEU   2          1HD1      LEU   2  -0.320   3.087  -4.757
   16   HD12  LEU   2          2HD1      LEU   2   1.408   2.748  -4.844
   17   HD13  LEU   2          3HD1      LEU   2   0.401   1.894  -3.676
   18   HD21  LEU   2          3HD2      LEU   2  -1.109   2.063  -7.196
   19   HD22  LEU   2          1HD2      LEU   2   0.247   1.130  -7.831
   20   HD23  LEU   2          2HD2      LEU   2   0.520   2.741  -7.168
   21    HA   PRO   3           HA       PRO   3   2.153  -4.932  -5.540
   22    HB2  PRO   3           2HB      PRO   3  -0.173  -6.162  -6.209
   23    HB3  PRO   3           3HB      PRO   3   0.355  -5.950  -4.535
   24    HG2  PRO   3           2HG      PRO   3  -1.609  -4.340  -6.120
   25    HG3  PRO   3           3HG      PRO   3  -1.719  -4.902  -4.442
   26    HD2  PRO   3           2HD      PRO   3  -1.012  -2.369  -5.087
   27    HD3  PRO   3           3HD      PRO   3  -0.379  -3.201  -3.652
   28    H    LEU   4           H        LEU   4   0.833  -2.557  -7.437
   29    HA   LEU   4           HA       LEU   4   0.809  -4.113  -9.904
   30    HB2  LEU   4           2HB      LEU   4   0.269  -1.179  -9.476
   31    HB3  LEU   4           3HB      LEU   4  -0.013  -2.088 -10.959
   32    HG   LEU   4           HG       LEU   4  -1.500  -2.357  -8.349
   33   HD11  LEU   4          1HD1      LEU   4  -2.127  -0.416  -9.681
   34   HD12  LEU   4          2HD1      LEU   4  -3.413  -1.621  -9.676
   35   HD13  LEU   4          3HD1      LEU   4  -2.372  -1.449 -11.089
   36   HD21  LEU   4          3HD2      LEU   4  -2.875  -4.019  -9.512
   37   HD22  LEU   4          1HD2      LEU   4  -1.201  -4.551  -9.356
   38   HD23  LEU   4          2HD2      LEU   4  -1.791  -3.940 -10.902
   39    H    ILE   5           H        ILE   5   2.815  -1.912  -8.146
   40    HA   ILE   5           HA       ILE   5   4.440  -1.036 -10.304
   41    HB   ILE   5           HB       ILE   5   5.795  -0.009  -8.738
   42   HG12  ILE   5          2HG1      ILE   5   5.022  -2.221  -6.830
   43   HG13  ILE   5          3HG1      ILE   5   6.600  -1.943  -7.557
   44   HG21  ILE   5          1HG2      ILE   5   4.336   1.201  -7.501
   45   HG22  ILE   5          2HG2      ILE   5   3.156   0.315  -8.466
   46   HG23  ILE   5          3HG2      ILE   5   3.545  -0.227  -6.834
   47   HD11  ILE   5          3HD1      ILE   5   6.921  -1.122  -5.448
   48   HD12  ILE   5          1HD1      ILE   5   6.442   0.342  -6.307
   49   HD13  ILE   5          2HD1      ILE   5   5.269  -0.521  -5.311
   50    H    GLY   6           H        GLY   6   4.598  -3.767  -8.080
   51    HA2  GLY   6           2HA      GLY   6   7.184  -4.621  -9.044
   52    HA3  GLY   6           3HA      GLY   6   6.157  -5.479  -7.905
   53    H    ARG   7           H        ARG   7   3.990  -4.969 -10.125
   54    HA   ARG   7           HA       ARG   7   4.583  -7.473 -11.529
   55    HB2  ARG   7           2HB      ARG   7   2.487  -7.762 -10.641
   56    HB3  ARG   7           3HB      ARG   7   2.090  -6.052 -10.743
   57    HG2  ARG   7           2HG      ARG   7   2.408  -7.520 -13.294
   58    HG3  ARG   7           3HG      ARG   7   0.982  -7.879 -12.318
   59    HD2  ARG   7           2HD      ARG   7   1.118  -5.126 -12.264
   60    HD3  ARG   7           3HD      ARG   7   1.618  -5.525 -13.907
   61    HE   ARG   7           HE       ARG   7  -0.766  -6.884 -13.033
   62   HH11  ARG   7          1HH1      ARG   7   0.536  -4.026 -14.535
   63   HH12  ARG   7          2HH1      ARG   7  -0.934  -3.633 -15.363
   64   HH21  ARG   7          1HH2      ARG   7  -2.708  -6.377 -14.118
   65   HH22  ARG   7          2HH2      ARG   7  -2.779  -4.971 -15.124
   66    H    VAL   8           H        VAL   8   3.890  -4.082 -12.059
   67    HA   VAL   8           HA       VAL   8   3.285  -3.957 -14.721
   68    HB   VAL   8           HB       VAL   8   3.494  -1.997 -13.188
   69   HG11  VAL   8          1HG1      VAL   8   6.000  -2.867 -12.698
   70   HG12  VAL   8          2HG1      VAL   8   6.327  -1.609 -13.891
   71   HG13  VAL   8          3HG1      VAL   8   5.458  -1.214 -12.408
   72   HG21  VAL   8          3HG2      VAL   8   5.130  -1.352 -15.589
   73   HG22  VAL   8          1HG2      VAL   8   3.514  -2.019 -15.824
   74   HG23  VAL   8          2HG2      VAL   8   3.727  -0.519 -14.921
   75    H    LEU   9           H        LEU   9   6.356  -4.747 -13.268
   76    HA   LEU   9           HA       LEU   9   8.102  -4.326 -15.374
   77    HB2  LEU   9           2HB      LEU   9   8.026  -6.353 -13.171
   78    HB3  LEU   9           3HB      LEU   9   9.302  -6.394 -14.386
   79    HG   LEU   9           HG       LEU   9  10.103  -5.272 -12.413
   80   HD11  LEU   9          1HD1      LEU   9  10.056  -4.139 -14.995
   81   HD12  LEU   9          2HD1      LEU   9  11.257  -3.910 -13.724
   82   HD13  LEU   9          3HD1      LEU   9   9.880  -2.815 -13.843
   83   HD21  LEU   9          3HD2      LEU   9   7.655  -4.535 -11.837
   84   HD22  LEU   9          1HD2      LEU   9   8.110  -3.074 -12.715
   85   HD23  LEU   9          2HD2      LEU   9   9.033  -3.574 -11.297
   86    H    SER  10           H        SER  10   6.016  -7.115 -14.735
   87    HA   SER  10           HA       SER  10   6.775  -8.246 -17.337
   88    HB2  SER  10           2HB      SER  10   6.752  -9.568 -15.061
   89    HB3  SER  10           3HB      SER  10   5.022  -9.689 -15.382
   90    HG   SER  10           HG       SER  10   5.564 -10.621 -17.414
   91    H    GLY  11           H        GLY  11   4.105  -6.912 -15.532
   92    HA2  GLY  11           2HA      GLY  11   2.003  -7.772 -17.218
   93    HA3  GLY  11           3HA      GLY  11   1.945  -6.400 -16.122
   94    H    ILE  12           H        ILE  12   4.355  -5.255 -17.544
   95    HA   ILE  12           HA       ILE  12   2.838  -3.802 -19.535
   96    HB   ILE  12           HB       ILE  12   4.471  -2.725 -17.922
   97   HG12  ILE  12          2HG1      ILE  12   5.482  -1.848 -20.514
   98   HG13  ILE  12          3HG1      ILE  12   3.736  -2.068 -20.515
   99   HG21  ILE  12          1HG2      ILE  12   6.561  -3.669 -19.866
  100   HG22  ILE  12          2HG2      ILE  12   6.794  -2.815 -18.341
  101   HG23  ILE  12          3HG2      ILE  12   6.236  -4.487 -18.338
  102   HD11  ILE  12          3HD1      ILE  12   4.389  -0.692 -18.148
  103   HD12  ILE  12          1HD1      ILE  12   5.273   0.080 -19.464
  104   HD13  ILE  12          2HD1      ILE  12   3.520  -0.092 -19.560
  105    H    LEU  13           H        LEU  13   5.300  -6.259 -19.425
  106    HA   LEU  13           HA       LEU  13   6.444  -6.076 -21.928
  107    HB2  LEU  13           2HB      LEU  13   5.797  -8.391 -20.150
  108    HB3  LEU  13           3HB      LEU  13   6.484  -8.671 -21.749
  109    HG   LEU  13           HG       LEU  13   7.815  -6.905 -19.709
  110   HD11  LEU  13          1HD1      LEU  13   9.068  -9.468 -20.011
  111   HD12  LEU  13          2HD1      LEU  13   7.406  -9.663 -19.455
  112   HD13  LEU  13          3HD1      LEU  13   8.527  -8.651 -18.545
  113   HD21  LEU  13          3HD2      LEU  13   9.767  -7.230 -21.054
  114   HD22  LEU  13          1HD2      LEU  13   8.452  -6.720 -22.112
  115   HD23  LEU  13          2HD2      LEU  13   8.937  -8.415 -22.064
  Start of MODEL   10
    1    H1   PHE   1           H        PHE   1   2.248  -0.768   0.983
    2    HA   PHE   1           HA       PHE   1   2.974   0.629  -1.215
    3    HB2  PHE   1           2HB      PHE   1   4.577  -0.939  -1.462
    4    HB3  PHE   1           3HB      PHE   1   3.886  -1.653  -0.009
    5    HD1  PHE   1           HD2      PHE   1   2.113  -3.447  -0.289
    6    HD2  PHE   1           HD1      PHE   1   4.593  -2.105  -3.478
    7    HE1  PHE   1           HE2      PHE   1   1.615  -5.507  -1.538
    8    HE2  PHE   1           HE1      PHE   1   4.098  -4.163  -4.733
    9    HZ   PHE   1           HZ       PHE   1   2.609  -5.868  -3.763
   10    H    LEU   2           H        LEU   2   3.072  -0.310  -3.549
   11    HA   LEU   2           HA       LEU   2   0.307  -0.938  -4.339
   12    HB2  LEU   2           2HB      LEU   2   2.384   0.838  -5.430
   13    HB3  LEU   2           3HB      LEU   2   1.477  -0.085  -6.627
   14    HG   LEU   2           HG       LEU   2  -0.014   1.462  -4.556
   15   HD11  LEU   2          1HD1      LEU   2   1.403   3.184  -5.228
   16   HD12  LEU   2          2HD1      LEU   2   0.003   3.357  -6.287
   17   HD13  LEU   2          3HD1      LEU   2   1.478   2.603  -6.892
   18   HD21  LEU   2          3HD2      LEU   2  -1.228   1.770  -6.985
   19   HD22  LEU   2          1HD2      LEU   2  -1.622   0.524  -5.800
   20   HD23  LEU   2          2HD2      LEU   2  -0.518   0.161  -7.126
   21    HA   PRO   3           HA       PRO   3   2.094  -4.866  -5.538
   22    HB2  PRO   3           2HB      PRO   3  -0.268  -6.000  -6.246
   23    HB3  PRO   3           3HB      PRO   3   0.256  -5.841  -4.566
   24    HG2  PRO   3           2HG      PRO   3  -1.641  -4.132  -6.129
   25    HG3  PRO   3           3HG      PRO   3  -1.781  -4.724  -4.463
   26    HD2  PRO   3           2HD      PRO   3  -0.984  -2.204  -5.051
   27    HD3  PRO   3           3HD      PRO   3  -0.389  -3.087  -3.630
   28    H    LEU   4           H        LEU   4   0.867  -2.408  -7.393
   29    HA   LEU   4           HA       LEU   4   0.805  -3.911  -9.893
   30    HB2  LEU   4           2HB      LEU   4   0.375  -0.967  -9.413
   31    HB3  LEU   4           3HB      LEU   4   0.058  -1.842 -10.910
   32    HG   LEU   4           HG       LEU   4  -1.437  -2.111  -8.304
   33   HD11  LEU   4          1HD1      LEU   4  -2.153  -0.967 -10.994
   34   HD12  LEU   4          2HD1      LEU   4  -2.083  -0.127  -9.446
   35   HD13  LEU   4          3HD1      LEU   4  -3.336  -1.333  -9.738
   36   HD21  LEU   4          3HD2      LEU   4  -1.891  -3.565 -10.907
   37   HD22  LEU   4          1HD2      LEU   4  -2.853  -3.709  -9.436
   38   HD23  LEU   4          2HD2      LEU   4  -1.183  -4.277  -9.456
   39    H    ILE   5           H        ILE   5   2.879  -1.823  -8.078
   40    HA   ILE   5           HA       ILE   5   4.549  -0.965 -10.209
   41    HB   ILE   5           HB       ILE   5   5.928  -0.015  -8.617
   42   HG12  ILE   5          2HG1      ILE   5   5.066  -2.233  -6.755
   43   HG13  ILE   5          3HG1      ILE   5   6.658  -1.996  -7.467
   44   HG21  ILE   5          1HG2      ILE   5   4.505   1.222  -7.362
   45   HG22  ILE   5          2HG2      ILE   5   3.302   0.400  -8.355
   46   HG23  ILE   5          3HG2      ILE   5   3.657  -0.190  -6.732
   47   HD11  ILE   5          3HD1      ILE   5   6.456   0.310  -6.163
   48   HD12  ILE   5          1HD1      ILE   5   5.396  -0.670  -5.150
   49   HD13  ILE   5          2HD1      ILE   5   7.069  -1.162  -5.409
   50    H    GLY   6           H        GLY   6   4.598  -3.736  -8.029
   51    HA2  GLY   6           2HA      GLY   6   7.156  -4.666  -9.001
   52    HA3  GLY   6           3HA      GLY   6   6.098  -5.502  -7.873
   53    H    ARG   7           H        ARG   7   3.953  -4.887 -10.088
   54    HA   ARG   7           HA       ARG   7   4.458  -7.392 -11.524
   55    HB2  ARG   7           2HB      ARG   7   2.352  -7.625 -10.653
   56    HB3  ARG   7           3HB      ARG   7   2.019  -5.899 -10.711
   57    HG2  ARG   7           2HG      ARG   7   2.277  -7.318 -13.296
   58    HG3  ARG   7           3HG      ARG   7   0.838  -7.639 -12.327
   59    HD2  ARG   7           2HD      ARG   7   1.239  -4.852 -12.284
   60    HD3  ARG   7           3HD      ARG   7   1.458  -5.366 -13.956
   61    HE   ARG   7           HE       ARG   7  -0.991  -5.214 -12.543
   62   HH11  ARG   7          1HH1      ARG   7   0.712  -7.138 -14.892
   63   HH12  ARG   7          2HH1      ARG   7  -0.731  -7.722 -15.653
   64   HH21  ARG   7          1HH2      ARG   7  -2.898  -5.976 -13.536
   65   HH22  ARG   7          2HH2      ARG   7  -2.784  -7.060 -14.881
   66    H    VAL   8           H        VAL   8   3.888  -3.971 -12.010
   67    HA   VAL   8           HA       VAL   8   3.291  -3.791 -14.671
   68    HB   VAL   8           HB       VAL   8   3.564  -1.859 -13.115
   69   HG11  VAL   8          1HG1      VAL   8   6.412  -1.567 -13.805
   70   HG12  VAL   8          2HG1      VAL   8   5.553  -1.154 -12.320
   71   HG13  VAL   8          3HG1      VAL   8   6.035  -2.823 -12.626
   72   HG21  VAL   8          3HG2      VAL   8   5.170  -0.801 -15.214
   73   HG22  VAL   8          1HG2      VAL   8   4.080  -2.008 -15.893
   74   HG23  VAL   8          2HG2      VAL   8   3.430  -0.651 -14.974
   75    H    LEU   9           H        LEU   9   6.332  -4.702 -13.224
   76    HA   LEU   9           HA       LEU   9   8.094  -4.317 -15.323
   77    HB2  LEU   9           2HB      LEU   9   7.946  -6.366 -13.145
   78    HB3  LEU   9           3HB      LEU   9   9.222  -6.435 -14.359
   79    HG   LEU   9           HG       LEU   9  10.057  -5.364 -12.372
   80   HD11  LEU   9          1HD1      LEU   9   9.922  -2.886 -13.775
   81   HD12  LEU   9          2HD1      LEU   9  10.053  -4.202 -14.941
   82   HD13  LEU   9          3HD1      LEU   9  11.260  -4.030 -13.667
   83   HD21  LEU   9          3HD2      LEU   9   7.636  -4.550 -11.790
   84   HD22  LEU   9          1HD2      LEU   9   8.142  -3.096 -12.651
   85   HD23  LEU   9          2HD2      LEU   9   9.045  -3.642 -11.238
   86    H    SER  10           H        SER  10   5.911  -7.038 -14.721
   87    HA   SER  10           HA       SER  10   6.637  -8.167 -17.333
   88    HB2  SER  10           2HB      SER  10   6.603  -9.541 -15.121
   89    HB3  SER  10           3HB      SER  10   4.853  -9.536 -15.338
   90    HG   SER  10           HG       SER  10   6.486 -11.209 -16.405
   91    H    GLY  11           H        GLY  11   4.010  -6.756 -15.523
   92    HA2  GLY  11           2HA      GLY  11   1.885  -7.521 -17.226
   93    HA3  GLY  11           3HA      GLY  11   1.873  -6.160 -16.115
   94    H    ILE  12           H        ILE  12   4.328  -5.086 -17.514
   95    HA   ILE  12           HA       ILE  12   2.871  -3.559 -19.495
   96    HB   ILE  12           HB       ILE  12   4.530  -2.554 -17.863
   97   HG12  ILE  12          2HG1      ILE  12   5.471  -1.812 -20.577
   98   HG13  ILE  12          3HG1      ILE  12   3.734  -1.729 -20.301
   99   HG21  ILE  12          1HG2      ILE  12   6.648  -3.423 -19.790
  100   HG22  ILE  12          2HG2      ILE  12   6.820  -2.792 -18.153
  101   HG23  ILE  12          3HG2      ILE  12   6.218  -4.430 -18.408
  102   HD11  ILE  12          3HD1      ILE  12   5.156  -0.506 -18.127
  103   HD12  ILE  12          1HD1      ILE  12   5.650   0.191 -19.670
  104   HD13  ILE  12          2HD1      ILE  12   3.947   0.182 -19.210
  105    H    LEU  13           H        LEU  13   5.248  -6.099 -19.400
  106    HA   LEU  13           HA       LEU  13   6.411  -5.928 -21.895
  107    HB2  LEU  13           2HB      LEU  13   6.346  -7.778 -19.840
  108    HB3  LEU  13           3HB      LEU  13   5.686  -8.659 -21.216
  109    HG   LEU  13           HG       LEU  13   7.821  -7.751 -22.435
  110   HD11  LEU  13          1HD1      LEU  13   9.712  -7.845 -20.661
  111   HD12  LEU  13          2HD1      LEU  13   8.438  -7.382 -19.535
  112   HD13  LEU  13          3HD1      LEU  13   8.823  -6.341 -20.906
  113   HD21  LEU  13          3HD2      LEU  13   7.411 -10.085 -22.167
  114   HD22  LEU  13          1HD2      LEU  13   7.775 -10.010 -20.443
  115   HD23  LEU  13          2HD2      LEU  13   9.060  -9.769 -21.626
  Start of MODEL   11
    1    H1   PHE   1           H        PHE   1   1.070  -1.008   0.527
    2    HA   PHE   1           HA       PHE   1   2.371   0.862  -1.328
    3    HB2  PHE   1           2HB      PHE   1   4.113  -0.566  -1.443
    4    HB3  PHE   1           3HB      PHE   1   3.430  -1.278   0.015
    5    HD1  PHE   1           HD1      PHE   1   1.833  -3.232  -0.248
    6    HD2  PHE   1           HD2      PHE   1   4.310  -1.809  -3.404
    7    HE1  PHE   1           HE1      PHE   1   1.566  -5.378  -1.420
    8    HE2  PHE   1           HE2      PHE   1   4.045  -3.953  -4.582
    9    HZ   PHE   1           HZ       PHE   1   2.672  -5.740  -3.591
   10    H    LEU   2           H        LEU   2   2.635  -0.162  -3.611
   11    HA   LEU   2           HA       LEU   2  -0.032  -1.072  -4.460
   12    HB2  LEU   2           2HB      LEU   2   1.912   0.843  -5.560
   13    HB3  LEU   2           3HB      LEU   2   1.142  -0.211  -6.745
   14    HG   LEU   2           HG       LEU   2  -1.067   0.576  -5.944
   15   HD11  LEU   2          1HD1      LEU   2   0.472   1.604  -3.810
   16   HD12  LEU   2          2HD1      LEU   2  -1.273   1.694  -4.044
   17   HD13  LEU   2          3HD1      LEU   2  -0.233   2.978  -4.663
   18   HD21  LEU   2          3HD2      LEU   2  -1.053   2.377  -7.332
   19   HD22  LEU   2          1HD2      LEU   2   0.521   1.701  -7.754
   20   HD23  LEU   2          2HD2      LEU   2   0.416   3.053  -6.625
   21    HA   PRO   3           HA       PRO   3   2.142  -4.866  -5.427
   22    HB2  PRO   3           2HB      PRO   3  -0.080  -6.237  -6.168
   23    HB3  PRO   3           3HB      PRO   3   0.361  -5.964  -4.478
   24    HG2  PRO   3           2HG      PRO   3  -1.618  -4.498  -6.180
   25    HG3  PRO   3           3HG      PRO   3  -1.770  -5.033  -4.496
   26    HD2  PRO   3           2HD      PRO   3  -1.177  -2.477  -5.165
   27    HD3  PRO   3           3HD      PRO   3  -0.562  -3.244  -3.687
   28    H    LEU   4           H        LEU   4   0.778  -2.606  -7.429
   29    HA   LEU   4           HA       LEU   4   0.949  -4.208  -9.861
   30    HB2  LEU   4           2HB      LEU   4   0.230  -1.300  -9.523
   31    HB3  LEU   4           3HB      LEU   4   0.060  -2.257 -10.994
   32    HG   LEU   4           HG       LEU   4  -1.516  -2.557  -8.440
   33   HD11  LEU   4          1HD1      LEU   4  -3.410  -1.942  -9.849
   34   HD12  LEU   4          2HD1      LEU   4  -2.328  -1.744 -11.227
   35   HD13  LEU   4          3HD1      LEU   4  -2.186  -0.672  -9.834
   36   HD21  LEU   4          3HD2      LEU   4  -1.609  -4.197 -10.970
   37   HD22  LEU   4          1HD2      LEU   4  -2.758  -4.304  -9.637
   38   HD23  LEU   4          2HD2      LEU   4  -1.070  -4.749  -9.384
   39    H    ILE   5           H        ILE   5   2.750  -1.864  -8.067
   40    HA   ILE   5           HA       ILE   5   4.416  -0.938 -10.171
   41    HB   ILE   5           HB       ILE   5   5.643   0.193  -8.572
   42   HG12  ILE   5          2HG1      ILE   5   4.911  -2.023  -6.652
   43   HG13  ILE   5          3HG1      ILE   5   6.502  -1.669  -7.316
   44   HG21  ILE   5          1HG2      ILE   5   4.065   1.341  -7.423
   45   HG22  ILE   5          2HG2      ILE   5   2.980   0.372  -8.418
   46   HG23  ILE   5          3HG2      ILE   5   3.327  -0.117  -6.760
   47   HD11  ILE   5          3HD1      ILE   5   6.852  -0.605  -5.394
   48   HD12  ILE   5          1HD1      ILE   5   5.860   0.678  -6.085
   49   HD13  ILE   5          2HD1      ILE   5   5.131  -0.523  -5.018
   50    H    GLY   6           H        GLY   6   4.628  -3.614  -7.886
   51    HA2  GLY   6           2HA      GLY   6   7.298  -4.339  -8.719
   52    HA3  GLY   6           3HA      GLY   6   6.271  -5.232  -7.608
   53    H    ARG   7           H        ARG   7   4.180  -4.886  -9.929
   54    HA   ARG   7           HA       ARG   7   4.972  -7.378 -11.254
   55    HB2  ARG   7           2HB      ARG   7   2.858  -7.769 -10.452
   56    HB3  ARG   7           3HB      ARG   7   2.372  -6.086 -10.607
   57    HG2  ARG   7           2HG      ARG   7   2.883  -7.581 -13.110
   58    HG3  ARG   7           3HG      ARG   7   1.438  -8.001 -12.189
   59    HD2  ARG   7           2HD      ARG   7   1.376  -5.262 -12.173
   60    HD3  ARG   7           3HD      ARG   7   2.039  -5.616 -13.768
   61    HE   ARG   7           HE       ARG   7  -0.304  -7.150 -13.097
   62   HH11  ARG   7          1HH1      ARG   7   0.903  -4.192 -14.479
   63   HH12  ARG   7          2HH1      ARG   7  -0.519  -3.901 -15.426
   64   HH21  ARG   7          1HH2      ARG   7  -2.181  -6.778 -14.338
   65   HH22  ARG   7          2HH2      ARG   7  -2.273  -5.373 -15.344
   66    H    VAL   8           H        VAL   8   4.117  -4.041 -11.884
   67    HA   VAL   8           HA       VAL   8   3.625  -4.000 -14.572
   68    HB   VAL   8           HB       VAL   8   3.654  -2.004 -13.072
   69   HG11  VAL   8          1HG1      VAL   8   6.182  -2.720 -12.457
   70   HG12  VAL   8          2HG1      VAL   8   6.489  -1.467 -13.660
   71   HG13  VAL   8          3HG1      VAL   8   5.535  -1.097 -12.224
   72   HG21  VAL   8          3HG2      VAL   8   3.805  -2.078 -15.710
   73   HG22  VAL   8          1HG2      VAL   8   3.870  -0.553 -14.826
   74   HG23  VAL   8          2HG2      VAL   8   5.359  -1.300 -15.407
   75    H    LEU   9           H        LEU   9   6.666  -4.590 -12.970
   76    HA   LEU   9           HA       LEU   9   8.479  -4.109 -15.006
   77    HB2  LEU   9           2HB      LEU   9   8.419  -6.098 -12.768
   78    HB3  LEU   9           3HB      LEU   9   9.750  -6.082 -13.923
   79    HG   LEU   9           HG       LEU   9  10.395  -4.882 -11.942
   80   HD11  LEU   9          1HD1      LEU   9   9.790  -2.888 -14.118
   81   HD12  LEU   9          2HD1      LEU   9  11.125  -4.039 -14.162
   82   HD13  LEU   9          3HD1      LEU   9  11.072  -2.797 -12.910
   83   HD21  LEU   9          3HD2      LEU   9   7.883  -4.290 -11.484
   84   HD22  LEU   9          1HD2      LEU   9   8.289  -2.814 -12.360
   85   HD23  LEU   9          2HD2      LEU   9   9.175  -3.243 -10.897
   86    H    SER  10           H        SER  10   6.525  -6.999 -14.400
   87    HA   SER  10           HA       SER  10   7.462  -8.135 -16.941
   88    HB2  SER  10           2HB      SER  10   5.990  -9.406 -14.622
   89    HB3  SER  10           3HB      SER  10   6.398 -10.243 -16.120
   90    HG   SER  10           HG       SER  10   7.902 -10.008 -14.006
   91    H    GLY  11           H        GLY  11   4.644  -6.920 -15.284
   92    HA2  GLY  11           2HA      GLY  11   2.673  -7.929 -17.048
   93    HA3  GLY  11           3HA      GLY  11   2.486  -6.548 -15.978
   94    H    ILE  12           H        ILE  12   4.864  -5.249 -17.283
   95    HA   ILE  12           HA       ILE  12   3.369  -3.905 -19.352
   96    HB   ILE  12           HB       ILE  12   4.916  -2.751 -17.707
   97   HG12  ILE  12          2HG1      ILE  12   5.667  -2.144 -20.557
   98   HG13  ILE  12          3HG1      ILE  12   4.031  -1.866 -19.971
   99   HG21  ILE  12          1HG2      ILE  12   7.171  -3.360 -19.545
  100   HG22  ILE  12          2HG2      ILE  12   7.189  -2.922 -17.837
  101   HG23  ILE  12          3HG2      ILE  12   6.742  -4.558 -18.323
  102   HD11  ILE  12          3HD1      ILE  12   5.483   0.138 -19.928
  103   HD12  ILE  12          1HD1      ILE  12   4.814  -0.291 -18.354
  104   HD13  ILE  12          2HD1      ILE  12   6.495  -0.670 -18.732
  105    H    LEU  13           H        LEU  13   5.926  -6.260 -19.151
  106    HA   LEU  13           HA       LEU  13   7.130  -7.392 -20.719
  107    HB2  LEU  13           2HB      LEU  13   4.556  -7.755 -21.268
  108    HB3  LEU  13           3HB      LEU  13   5.017  -6.924 -22.753
  109    HG   LEU  13           HG       LEU  13   6.776  -9.153 -22.016
  110   HD11  LEU  13          1HD1      LEU  13   5.120 -10.832 -22.869
  111   HD12  LEU  13          2HD1      LEU  13   3.869  -9.610 -22.645
  112   HD13  LEU  13          3HD1      LEU  13   4.783 -10.200 -21.257
  113   HD21  LEU  13          3HD2      LEU  13   5.934  -9.616 -24.522
  114   HD22  LEU  13          1HD2      LEU  13   7.234  -8.492 -24.127
  115   HD23  LEU  13          2HD2      LEU  13   5.601  -7.887 -24.410
  Start of MODEL   12
    1    H1   PHE   1           H        PHE   1   2.005  -1.005   0.813
    2    HA   PHE   1           HA       PHE   1   2.943   0.691  -1.278
    3    HB2  PHE   1           2HB      PHE   1   4.583  -0.841  -1.504
    4    HB3  PHE   1           3HB      PHE   1   3.920  -1.544  -0.032
    5    HD1  PHE   1           HD1      PHE   1   2.189  -3.384  -0.263
    6    HD2  PHE   1           HD2      PHE   1   4.611  -2.046  -3.497
    7    HE1  PHE   1           HE1      PHE   1   1.732  -5.480  -1.469
    8    HE2  PHE   1           HE2      PHE   1   4.157  -4.138  -4.708
    9    HZ   PHE   1           HZ       PHE   1   2.715  -5.859  -3.695
   10    H    LEU   2           H        LEU   2   3.039  -0.291  -3.592
   11    HA   LEU   2           HA       LEU   2   0.283  -1.008  -4.338
   12    HB2  LEU   2           2HB      LEU   2   2.299   0.802  -5.488
   13    HB3  LEU   2           3HB      LEU   2   1.401  -0.167  -6.655
   14    HG   LEU   2           HG       LEU   2  -0.167   1.308  -4.612
   15   HD11  LEU   2          1HD1      LEU   2   0.114   3.404  -5.481
   16   HD12  LEU   2          2HD1      LEU   2   0.676   2.806  -7.041
   17   HD13  LEU   2          3HD1      LEU   2   1.754   2.776  -5.645
   18   HD21  LEU   2          3HD2      LEU   2  -1.603   0.247  -6.014
   19   HD22  LEU   2          1HD2      LEU   2  -0.477   0.276  -7.371
   20   HD23  LEU   2          2HD2      LEU   2  -1.382   1.729  -6.946
   21    HA   PRO   3           HA       PRO   3   2.163  -4.908  -5.485
   22    HB2  PRO   3           2HB      PRO   3  -0.175  -6.116  -6.153
   23    HB3  PRO   3           3HB      PRO   3   0.358  -5.913  -4.480
   24    HG2  PRO   3           2HG      PRO   3  -1.595  -4.282  -6.058
   25    HG3  PRO   3           3HG      PRO   3  -1.707  -4.848  -4.381
   26    HD2  PRO   3           2HD      PRO   3  -0.981  -2.319  -5.020
   27    HD3  PRO   3           3HD      PRO   3  -0.352  -3.160  -3.589
   28    H    LEU   4           H        LEU   4   0.860  -2.516  -7.373
   29    HA   LEU   4           HA       LEU   4   0.819  -4.066  -9.845
   30    HB2  LEU   4           2HB      LEU   4   0.310  -1.126  -9.417
   31    HB3  LEU   4           3HB      LEU   4   0.004  -2.040 -10.893
   32    HG   LEU   4           HG       LEU   4  -1.459  -2.297  -8.268
   33   HD11  LEU   4          1HD1      LEU   4  -3.388  -1.574  -9.653
   34   HD12  LEU   4          2HD1      LEU   4  -2.270  -1.268 -10.981
   35   HD13  LEU   4          3HD1      LEU   4  -2.135  -0.344  -9.485
   36   HD21  LEU   4          3HD2      LEU   4  -2.880  -3.918  -9.446
   37   HD22  LEU   4          1HD2      LEU   4  -1.217  -4.485  -9.291
   38   HD23  LEU   4          2HD2      LEU   4  -1.792  -3.850 -10.833
   39    H    ILE   5           H        ILE   5   2.846  -1.886  -8.084
   40    HA   ILE   5           HA       ILE   5   4.474  -1.016 -10.242
   41    HB   ILE   5           HB       ILE   5   5.840  -0.006  -8.676
   42   HG12  ILE   5          2HG1      ILE   5   5.052  -2.218  -6.773
   43   HG13  ILE   5          3HG1      ILE   5   6.632  -1.950  -7.502
   44   HG21  ILE   5          1HG2      ILE   5   4.393   1.213  -7.432
   45   HG22  ILE   5          2HG2      ILE   5   3.204   0.338  -8.397
   46   HG23  ILE   5          3HG2      ILE   5   3.593  -0.212  -6.767
   47   HD11  ILE   5          3HD1      ILE   5   6.886  -1.188  -5.331
   48   HD12  ILE   5          1HD1      ILE   5   6.596   0.289  -6.250
   49   HD13  ILE   5          2HD1      ILE   5   5.293  -0.432  -5.305
   50    H    GLY   6           H        GLY   6   4.613  -3.757  -8.028
   51    HA2  GLY   6           2HA      GLY   6   7.191  -4.628  -8.998
   52    HA3  GLY   6           3HA      GLY   6   6.158  -5.482  -7.861
   53    H    ARG   7           H        ARG   7   3.993  -4.946 -10.077
   54    HA   ARG   7           HA       ARG   7   4.563  -7.449 -11.490
   55    HB2  ARG   7           2HB      ARG   7   2.466  -7.724 -10.602
   56    HB3  ARG   7           3HB      ARG   7   2.083  -6.011 -10.697
   57    HG2  ARG   7           2HG      ARG   7   2.385  -7.472 -13.253
   58    HG3  ARG   7           3HG      ARG   7   0.957  -7.821 -12.277
   59    HD2  ARG   7           2HD      ARG   7   1.066  -5.089 -12.194
   60    HD3  ARG   7           3HD      ARG   7   1.647  -5.435 -13.822
   61    HE   ARG   7           HE       ARG   7  -0.755  -6.851 -13.115
   62   HH11  ARG   7          1HH1      ARG   7   0.564  -3.906 -14.420
   63   HH12  ARG   7          2HH1      ARG   7  -0.875  -3.495 -15.294
   64   HH21  ARG   7          1HH2      ARG   7  -2.655  -6.322 -14.261
   65   HH22  ARG   7          2HH2      ARG   7  -2.705  -4.870 -15.202
   66    H    VAL   8           H        VAL   8   3.898  -4.050 -12.007
   67    HA   VAL   8           HA       VAL   8   3.291  -3.911 -14.668
   68    HB   VAL   8           HB       VAL   8   3.519  -1.958 -13.128
   69   HG11  VAL   8          1HG1      VAL   8   6.355  -1.596 -13.837
   70   HG12  VAL   8          2HG1      VAL   8   5.493  -1.192 -12.351
   71   HG13  VAL   8          3HG1      VAL   8   6.018  -2.850 -12.645
   72   HG21  VAL   8          3HG2      VAL   8   5.021  -1.656 -15.726
   73   HG22  VAL   8          1HG2      VAL   8   3.265  -1.718 -15.578
   74   HG23  VAL   8          2HG2      VAL   8   4.165  -0.390 -14.845
   75    H    LEU   9           H        LEU   9   6.358  -4.731 -13.221
   76    HA   LEU   9           HA       LEU   9   8.105  -4.318 -15.327
   77    HB2  LEU   9           2HB      LEU   9   8.013  -6.353 -13.132
   78    HB3  LEU   9           3HB      LEU   9   9.288  -6.400 -14.349
   79    HG   LEU   9           HG       LEU   9  10.100  -5.292 -12.372
   80   HD11  LEU   9          1HD1      LEU   9   9.899  -2.829 -13.795
   81   HD12  LEU   9          2HD1      LEU   9  10.061  -4.150 -14.951
   82   HD13  LEU   9          3HD1      LEU   9  11.266  -3.938 -13.680
   83   HD21  LEU   9          3HD2      LEU   9   7.660  -4.535 -11.791
   84   HD22  LEU   9          1HD2      LEU   9   8.127  -3.076 -12.665
   85   HD23  LEU   9          2HD2      LEU   9   9.046  -3.587 -11.250
   86    H    SER  10           H        SER  10   5.996  -7.092 -14.697
   87    HA   SER  10           HA       SER  10   6.742  -8.219 -17.304
   88    HB2  SER  10           2HB      SER  10   6.400  -9.427 -14.824
   89    HB3  SER  10           3HB      SER  10   4.924  -9.836 -15.698
   90    HG   SER  10           HG       SER  10   6.111 -11.296 -16.622
   91    H    GLY  11           H        GLY  11   4.086  -6.870 -15.491
   92    HA2  GLY  11           2HA      GLY  11   1.974  -7.706 -17.178
   93    HA3  GLY  11           3HA      GLY  11   1.929  -6.338 -16.076
   94    H    ILE  12           H        ILE  12   4.348  -5.209 -17.498
   95    HA   ILE  12           HA       ILE  12   2.840  -3.735 -19.481
   96    HB   ILE  12           HB       ILE  12   4.484  -2.677 -17.866
   97   HG12  ILE  12          2HG1      ILE  12   5.553  -1.714 -20.361
   98   HG13  ILE  12          3HG1      ILE  12   3.840  -2.071 -20.546
   99   HG21  ILE  12          1HG2      ILE  12   6.602  -3.525 -19.809
  100   HG22  ILE  12          2HG2      ILE  12   6.783  -2.844 -18.193
  101   HG23  ILE  12          3HG2      ILE  12   6.220  -4.503 -18.392
  102   HD11  ILE  12          3HD1      ILE  12   3.356  -0.641 -18.612
  103   HD12  ILE  12          1HD1      ILE  12   5.071  -0.254 -18.489
  104   HD13  ILE  12          2HD1      ILE  12   4.157   0.234 -19.917
  105    H    LEU  13           H        LEU  13   5.282  -6.213 -19.383
  106    HA   LEU  13           HA       LEU  13   6.425  -6.031 -21.887
  107    HB2  LEU  13           2HB      LEU  13   6.455  -7.848 -19.822
  108    HB3  LEU  13           3HB      LEU  13   5.753  -8.771 -21.148
  109    HG   LEU  13           HG       LEU  13   7.793  -7.982 -22.504
  110   HD11  LEU  13          1HD1      LEU  13   8.648  -7.321 -19.700
  111   HD12  LEU  13          2HD1      LEU  13   8.691  -6.292 -21.131
  112   HD13  LEU  13          3HD1      LEU  13   9.798  -7.657 -20.994
  113   HD21  LEU  13          3HD2      LEU  13   9.059  -9.738 -20.686
  114   HD22  LEU  13          1HD2      LEU  13   8.296 -10.123 -22.228
  115   HD23  LEU  13          2HD2      LEU  13   7.351 -10.175 -20.740
  Start of MODEL   13
    1    H1   PHE   1           H        PHE   1   1.684  -0.885   0.874
    2    HA   PHE   1           HA       PHE   1   2.491   0.847  -1.224
    3    HB2  PHE   1           2HB      PHE   1   4.242  -0.561  -1.427
    4    HB3  PHE   1           3HB      PHE   1   3.613  -1.309   0.037
    5    HD1  PHE   1           HD1      PHE   1   2.026  -3.272  -0.213
    6    HD2  PHE   1           HD2      PHE   1   4.384  -1.761  -3.419
    7    HE1  PHE   1           HE1      PHE   1   1.739  -5.396  -1.422
    8    HE2  PHE   1           HE2      PHE   1   4.100  -3.882  -4.633
    9    HZ   PHE   1           HZ       PHE   1   2.776  -5.703  -3.635
   10    H    LEU   2           H        LEU   2   2.688  -0.125  -3.536
   11    HA   LEU   2           HA       LEU   2   0.003  -1.044  -4.316
   12    HB2  LEU   2           2HB      LEU   2   1.894   0.911  -5.441
   13    HB3  LEU   2           3HB      LEU   2   1.090  -0.124  -6.619
   14    HG   LEU   2           HG       LEU   2  -0.913   0.845  -4.882
   15   HD11  LEU   2          1HD1      LEU   2  -0.684   3.175  -4.870
   16   HD12  LEU   2          2HD1      LEU   2   0.672   3.136  -5.997
   17   HD13  LEU   2          3HD1      LEU   2   0.885   2.568  -4.341
   18   HD21  LEU   2          3HD2      LEU   2  -1.004   0.245  -7.326
   19   HD22  LEU   2          1HD2      LEU   2  -0.266   1.812  -7.657
   20   HD23  LEU   2          2HD2      LEU   2  -1.845   1.729  -6.875
   21    HA   PRO   3           HA       PRO   3   2.178  -4.795  -5.433
   22    HB2  PRO   3           2HB      PRO   3  -0.055  -6.172  -6.130
   23    HB3  PRO   3           3HB      PRO   3   0.439  -5.930  -4.450
   24    HG2  PRO   3           2HG      PRO   3  -1.608  -4.448  -6.055
   25    HG3  PRO   3           3HG      PRO   3  -1.699  -5.019  -4.379
   26    HD2  PRO   3           2HD      PRO   3  -1.152  -2.444  -5.012
   27    HD3  PRO   3           3HD      PRO   3  -0.482  -3.236  -3.572
   28    H    LEU   4           H        LEU   4   0.727  -2.507  -7.342
   29    HA   LEU   4           HA       LEU   4   0.832  -4.056  -9.811
   30    HB2  LEU   4           2HB      LEU   4   0.096  -1.165  -9.383
   31    HB3  LEU   4           3HB      LEU   4  -0.107  -2.086 -10.872
   32    HG   LEU   4           HG       LEU   4  -1.605  -2.465  -8.283
   33   HD11  LEU   4          1HD1      LEU   4  -3.552  -1.911  -9.724
   34   HD12  LEU   4          2HD1      LEU   4  -2.425  -1.513 -11.021
   35   HD13  LEU   4          3HD1      LEU   4  -2.411  -0.580  -9.524
   36   HD21  LEU   4          3HD2      LEU   4  -1.143  -4.627  -9.309
   37   HD22  LEU   4          1HD2      LEU   4  -1.778  -4.043 -10.847
   38   HD23  LEU   4          2HD2      LEU   4  -2.850  -4.211  -9.457
   39    H    ILE   5           H        ILE   5   2.671  -1.733  -8.028
   40    HA   ILE   5           HA       ILE   5   4.258  -0.748 -10.166
   41    HB   ILE   5           HB       ILE   5   5.527   0.361  -8.584
   42   HG12  ILE   5          2HG1      ILE   5   4.879  -1.901  -6.688
   43   HG13  ILE   5          3HG1      ILE   5   6.444  -1.518  -7.398
   44   HG21  ILE   5          1HG2      ILE   5   3.978   1.471  -7.360
   45   HG22  ILE   5          2HG2      ILE   5   2.869   0.512  -8.340
   46   HG23  ILE   5          3HG2      ILE   5   3.276  -0.008  -6.705
   47   HD11  ILE   5          3HD1      ILE   5   6.551  -0.775  -5.182
   48   HD12  ILE   5          1HD1      ILE   5   6.304   0.680  -6.147
   49   HD13  ILE   5          2HD1      ILE   5   4.953  -0.033  -5.265
   50    H    GLY   6           H        GLY   6   4.569  -3.470  -7.947
   51    HA2  GLY   6           2HA      GLY   6   7.216  -4.150  -8.882
   52    HA3  GLY   6           3HA      GLY   6   6.234  -5.077  -7.757
   53    H    ARG   7           H        ARG   7   4.065  -4.702 -10.001
   54    HA   ARG   7           HA       ARG   7   4.836  -7.158 -11.404
   55    HB2  ARG   7           2HB      ARG   7   2.753  -7.586 -10.543
   56    HB3  ARG   7           3HB      ARG   7   2.247  -5.905 -10.644
   57    HG2  ARG   7           2HG      ARG   7   2.688  -7.340 -13.195
   58    HG3  ARG   7           3HG      ARG   7   1.278  -7.794 -12.237
   59    HD2  ARG   7           2HD      ARG   7   1.208  -5.049 -12.164
   60    HD3  ARG   7           3HD      ARG   7   1.795  -5.380 -13.794
   61    HE   ARG   7           HE       ARG   7  -0.510  -6.930 -13.030
   62   HH11  ARG   7          1HH1      ARG   7   0.625  -3.953 -14.434
   63   HH12  ARG   7          2HH1      ARG   7  -0.841  -3.655 -15.308
   64   HH21  ARG   7          1HH2      ARG   7  -2.444  -6.548 -14.176
   65   HH22  ARG   7          2HH2      ARG   7  -2.586  -5.131 -15.160
   66    H    VAL   8           H        VAL   8   3.930  -3.817 -11.934
   67    HA   VAL   8           HA       VAL   8   3.350  -3.725 -14.604
   68    HB   VAL   8           HB       VAL   8   3.407  -1.760 -13.064
   69   HG11  VAL   8          1HG1      VAL   8   6.217  -1.184 -13.733
   70   HG12  VAL   8          2HG1      VAL   8   5.307  -0.849 -12.259
   71   HG13  VAL   8          3HG1      VAL   8   5.961  -2.462 -12.545
   72   HG21  VAL   8          3HG2      VAL   8   4.794  -0.409 -15.049
   73   HG22  VAL   8          1HG2      VAL   8   4.188  -1.858 -15.852
   74   HG23  VAL   8          2HG2      VAL   8   3.067  -0.770 -15.033
   75    H    LEU   9           H        LEU   9   6.447  -4.315 -13.113
   76    HA   LEU   9           HA       LEU   9   8.187  -3.772 -15.198
   77    HB2  LEU   9           2HB      LEU   9   9.232  -4.311 -13.218
   78    HB3  LEU   9           3HB      LEU   9   8.204  -5.714 -12.936
   79    HG   LEU   9           HG       LEU   9  10.086  -5.832 -15.230
   80   HD11  LEU   9          1HD1      LEU   9  12.000  -5.899 -14.063
   81   HD12  LEU   9          2HD1      LEU   9  11.247  -6.675 -12.670
   82   HD13  LEU   9          3HD1      LEU   9  11.110  -4.930 -12.888
   83   HD21  LEU   9          3HD2      LEU   9  10.044  -8.074 -13.438
   84   HD22  LEU   9          1HD2      LEU   9   9.542  -7.981 -15.126
   85   HD23  LEU   9          2HD2      LEU   9   8.397  -7.589 -13.843
   86    H    SER  10           H        SER  10   6.280  -6.691 -14.587
   87    HA   SER  10           HA       SER  10   7.150  -7.771 -17.175
   88    HB2  SER  10           2HB      SER  10   5.683  -9.776 -16.096
   89    HB3  SER  10           3HB      SER  10   7.411  -9.572 -15.809
   90    HG   SER  10           HG       SER  10   6.329  -9.806 -13.845
   91    H    GLY  11           H        GLY  11   4.372  -6.615 -15.411
   92    HA2  GLY  11           2HA      GLY  11   2.357  -7.611 -17.129
   93    HA3  GLY  11           3HA      GLY  11   2.192  -6.247 -16.033
   94    H    ILE  12           H        ILE  12   4.543  -4.944 -17.418
   95    HA   ILE  12           HA       ILE  12   2.963  -3.590 -19.430
   96    HB   ILE  12           HB       ILE  12   4.498  -2.410 -17.792
   97   HG12  ILE  12          2HG1      ILE  12   5.520  -1.009 -19.842
   98   HG13  ILE  12          3HG1      ILE  12   4.350  -1.979 -20.729
   99   HG21  ILE  12          1HG2      ILE  12   6.687  -3.167 -19.703
  100   HG22  ILE  12          2HG2      ILE  12   6.820  -2.370 -18.136
  101   HG23  ILE  12          3HG2      ILE  12   6.376  -4.075 -18.223
  102   HD11  ILE  12          3HD1      ILE  12   3.944   0.283 -18.947
  103   HD12  ILE  12          1HD1      ILE  12   2.906  -0.368 -20.215
  104   HD13  ILE  12          2HD1      ILE  12   2.883  -1.083 -18.603
  105    H    LEU  13           H        LEU  13   5.580  -5.880 -19.286
  106    HA   LEU  13           HA       LEU  13   6.746  -5.618 -21.771
  107    HB2  LEU  13           2HB      LEU  13   7.544  -7.153 -20.053
  108    HB3  LEU  13           3HB      LEU  13   6.118  -8.164 -20.282
  109    HG   LEU  13           HG       LEU  13   7.545  -7.821 -22.768
  110   HD11  LEU  13          1HD1      LEU  13   9.101  -8.925 -20.435
  111   HD12  LEU  13          2HD1      LEU  13   9.516  -7.521 -21.418
  112   HD13  LEU  13          3HD1      LEU  13   9.539  -9.133 -22.131
  113   HD21  LEU  13          3HD2      LEU  13   5.887  -9.568 -22.258
  114   HD22  LEU  13          1HD2      LEU  13   6.997 -10.254 -21.071
  115   HD23  LEU  13          2HD2      LEU  13   7.432 -10.241 -22.780
  Start of MODEL   14
    1    H1   PHE   1           H        PHE   1   0.702   0.266   0.176
    2    HA   PHE   1           HA       PHE   1   2.709   0.986  -1.287
    3    HB2  PHE   1           2HB      PHE   1   4.405  -0.485  -1.509
    4    HB3  PHE   1           3HB      PHE   1   3.762  -1.211  -0.039
    5    HD1  PHE   1           HD1      PHE   1   2.101  -3.114  -0.277
    6    HD2  PHE   1           HD2      PHE   1   4.489  -1.690  -3.500
    7    HE1  PHE   1           HE1      PHE   1   1.728  -5.226  -1.482
    8    HE2  PHE   1           HE2      PHE   1   4.118  -3.800  -4.711
    9    HZ   PHE   1           HZ       PHE   1   2.735  -5.571  -3.703
   10    H    LEU   2           H        LEU   2   2.859   0.007  -3.603
   11    HA   LEU   2           HA       LEU   2   0.136  -0.804  -4.370
   12    HB2  LEU   2           2HB      LEU   2   2.099   1.073  -5.505
   13    HB3  LEU   2           3HB      LEU   2   1.247   0.072  -6.679
   14    HG   LEU   2           HG       LEU   2   0.216   2.298  -6.324
   15   HD11  LEU   2          1HD1      LEU   2  -1.028  -0.239  -6.395
   16   HD12  LEU   2          2HD1      LEU   2  -1.649   1.303  -6.982
   17   HD13  LEU   2          3HD1      LEU   2  -1.983   0.791  -5.328
   18   HD21  LEU   2          3HD2      LEU   2   0.700   2.621  -3.982
   19   HD22  LEU   2          1HD2      LEU   2  -0.288   1.225  -3.551
   20   HD23  LEU   2          2HD2      LEU   2  -1.046   2.666  -4.231
   21    HA   PRO   3           HA       PRO   3   2.158  -4.639  -5.496
   22    HB2  PRO   3           2HB      PRO   3  -0.133  -5.930  -6.172
   23    HB3  PRO   3           3HB      PRO   3   0.384  -5.705  -4.497
   24    HG2  PRO   3           2HG      PRO   3  -1.617  -4.147  -6.087
   25    HG3  PRO   3           3HG      PRO   3  -1.717  -4.712  -4.409
   26    HD2  PRO   3           2HD      PRO   3  -1.077  -2.161  -5.051
   27    HD3  PRO   3           3HD      PRO   3  -0.425  -2.976  -3.615
   28    H    LEU   4           H        LEU   4   0.779  -2.299  -7.396
   29    HA   LEU   4           HA       LEU   4   0.802  -3.854  -9.864
   30    HB2  LEU   4           2HB      LEU   4   0.194  -0.932  -9.444
   31    HB3  LEU   4           3HB      LEU   4  -0.073  -1.857 -10.920
   32    HG   LEU   4           HG       LEU   4  -1.541  -2.159  -8.302
   33   HD11  LEU   4          1HD1      LEU   4  -3.487  -1.522  -9.731
   34   HD12  LEU   4          2HD1      LEU   4  -2.345  -1.134 -11.017
   35   HD13  LEU   4          3HD1      LEU   4  -2.299  -0.239  -9.498
   36   HD21  LEU   4          3HD2      LEU   4  -2.871  -3.856  -9.414
   37   HD22  LEU   4          1HD2      LEU   4  -1.173  -4.333  -9.386
   38   HD23  LEU   4          2HD2      LEU   4  -1.887  -3.703 -10.871
   39    H    ILE   5           H        ILE   5   2.749  -1.606  -8.099
   40    HA   ILE   5           HA       ILE   5   4.358  -0.692 -10.254
   41    HB   ILE   5           HB       ILE   5   5.680   0.373  -8.686
   42   HG12  ILE   5          2HG1      ILE   5   4.961  -1.855  -6.777
   43   HG13  ILE   5          3HG1      ILE   5   6.533  -1.536  -7.499
   44   HG21  ILE   5          1HG2      ILE   5   4.187   1.546  -7.451
   45   HG22  ILE   5          2HG2      ILE   5   3.035   0.632  -8.423
   46   HG23  ILE   5          3HG2      ILE   5   3.429   0.097  -6.789
   47   HD11  ILE   5          3HD1      ILE   5   5.256  -0.346  -5.151
   48   HD12  ILE   5          1HD1      ILE   5   6.964  -0.559  -5.536
   49   HD13  ILE   5          2HD1      ILE   5   6.069   0.800  -6.216
   50    H    GLY   6           H        GLY   6   4.581  -3.410  -8.018
   51    HA2  GLY   6           2HA      GLY   6   7.189  -4.202  -8.979
   52    HA3  GLY   6           3HA      GLY   6   6.187  -5.078  -7.832
   53    H    ARG   7           H        ARG   7   4.004  -4.639 -10.052
   54    HA   ARG   7           HA       ARG   7   4.658  -7.137 -11.440
   55    HB2  ARG   7           2HB      ARG   7   2.572  -7.482 -10.558
   56    HB3  ARG   7           3HB      ARG   7   2.135  -5.781 -10.648
   57    HG2  ARG   7           2HG      ARG   7   2.473  -7.231 -13.207
   58    HG3  ARG   7           3HG      ARG   7   1.058  -7.619 -12.227
   59    HD2  ARG   7           2HD      ARG   7   1.287  -4.814 -12.237
   60    HD3  ARG   7           3HD      ARG   7   1.536  -5.343 -13.900
   61    HE   ARG   7           HE       ARG   7  -0.917  -5.317 -12.486
   62   HH11  ARG   7          1HH1      ARG   7   0.900  -7.175 -14.802
   63   HH12  ARG   7          2HH1      ARG   7  -0.504  -7.860 -15.550
   64   HH21  ARG   7          1HH2      ARG   7  -2.774  -6.213 -13.461
   65   HH22  ARG   7          2HH2      ARG   7  -2.594  -7.311 -14.787
   66    H    VAL   8           H        VAL   8   3.879  -3.768 -11.992
   67    HA   VAL   8           HA       VAL   8   3.268  -3.680 -14.655
   68    HB   VAL   8           HB       VAL   8   3.419  -1.704 -13.137
   69   HG11  VAL   8          1HG1      VAL   8   5.949  -2.498 -12.638
   70   HG12  VAL   8          2HG1      VAL   8   6.241  -1.240 -13.841
   71   HG13  VAL   8          3HG1      VAL   8   5.360  -0.859 -12.361
   72   HG21  VAL   8          3HG2      VAL   8   3.739  -0.185 -14.868
   73   HG22  VAL   8          1HG2      VAL   8   5.018  -1.148 -15.608
   74   HG23  VAL   8          2HG2      VAL   8   3.339  -1.676 -15.720
   75    H    LEU   9           H        LEU   9   6.360  -4.373 -13.196
   76    HA   LEU   9           HA       LEU   9   8.091  -3.918 -15.308
   77    HB2  LEU   9           2HB      LEU   9   9.138  -4.473 -13.332
   78    HB3  LEU   9           3HB      LEU   9   8.065  -5.838 -13.027
   79    HG   LEU   9           HG       LEU   9   9.916  -6.040 -15.340
   80   HD11  LEU   9          1HD1      LEU   9  10.798  -5.576 -12.603
   81   HD12  LEU   9          2HD1      LEU   9  11.713  -5.555 -14.110
   82   HD13  LEU   9          3HD1      LEU   9  11.405  -7.084 -13.287
   83   HD21  LEU   9          3HD2      LEU   9   9.801  -8.256 -13.508
   84   HD22  LEU   9          1HD2      LEU   9   9.327  -8.176 -15.205
   85   HD23  LEU   9          2HD2      LEU   9   8.177  -7.724 -13.946
   86    H    SER  10           H        SER  10   6.081  -6.754 -14.642
   87    HA   SER  10           HA       SER  10   6.880  -7.898 -17.225
   88    HB2  SER  10           2HB      SER  10   6.720  -9.121 -14.807
   89    HB3  SER  10           3HB      SER  10   5.111  -9.461 -15.443
   90    HG   SER  10           HG       SER  10   7.515  -9.958 -16.864
   91    H    GLY  11           H        GLY  11   4.169  -6.609 -15.449
   92    HA2  GLY  11           2HA      GLY  11   2.098  -7.544 -17.136
   93    HA3  GLY  11           3HA      GLY  11   1.999  -6.162 -16.054
   94    H    ILE  12           H        ILE  12   4.385  -4.968 -17.475
   95    HA   ILE  12           HA       ILE  12   2.840  -3.577 -19.490
   96    HB   ILE  12           HB       ILE  12   4.431  -2.437 -17.879
   97   HG12  ILE  12          2HG1      ILE  12   5.296  -1.729 -20.638
   98   HG13  ILE  12          3HG1      ILE  12   3.570  -1.685 -20.296
   99   HG21  ILE  12          1HG2      ILE  12   6.572  -3.316 -19.795
  100   HG22  ILE  12          2HG2      ILE  12   6.753  -2.486 -18.250
  101   HG23  ILE  12          3HG2      ILE  12   6.242  -4.173 -18.290
  102   HD11  ILE  12          3HD1      ILE  12   3.829  -0.017 -18.671
  103   HD12  ILE  12          1HD1      ILE  12   5.573  -0.260 -18.581
  104   HD13  ILE  12          2HD1      ILE  12   4.857   0.474 -20.017
  105    H    LEU  13           H        LEU  13   5.369  -5.964 -19.340
  106    HA   LEU  13           HA       LEU  13   6.522  -5.776 -21.838
  107    HB2  LEU  13           2HB      LEU  13   6.836  -7.448 -19.804
  108    HB3  LEU  13           3HB      LEU  13   5.841  -8.484 -20.824
  109    HG   LEU  13           HG       LEU  13   7.613  -7.943 -22.650
  110   HD11  LEU  13          1HD1      LEU  13   9.737  -7.301 -21.960
  111   HD12  LEU  13          2HD1      LEU  13   9.389  -7.620 -20.261
  112   HD13  LEU  13          3HD1      LEU  13   8.672  -6.220 -21.059
  113   HD21  LEU  13          3HD2      LEU  13   7.811  -9.831 -20.348
  114   HD22  LEU  13          1HD2      LEU  13   9.117  -9.763 -21.531
  115   HD23  LEU  13          2HD2      LEU  13   7.478 -10.159 -22.049
  Start of MODEL   15
    1    H1   PHE   1           H        PHE   1   1.157  -0.749   0.297
    2    HA   PHE   1           HA       PHE   1   2.659   1.075  -1.455
    3    HB2  PHE   1           2HB      PHE   1   4.418  -0.322  -1.654
    4    HB3  PHE   1           3HB      PHE   1   3.824  -1.040  -0.160
    5    HD1  PHE   1           HD2      PHE   1   2.251  -3.023  -0.331
    6    HD2  PHE   1           HD1      PHE   1   4.531  -1.569  -3.618
    7    HE1  PHE   1           HE2      PHE   1   1.960  -5.178  -1.482
    8    HE2  PHE   1           HE1      PHE   1   4.243  -3.721  -4.775
    9    HZ   PHE   1           HZ       PHE   1   2.958  -5.530  -3.706
   10    H    LEU   2           H        LEU   2   2.814   0.045  -3.743
   11    HA   LEU   2           HA       LEU   2   0.123  -0.922  -4.440
   12    HB2  LEU   2           2HB      LEU   2   1.967   1.022  -5.658
   13    HB3  LEU   2           3HB      LEU   2   1.141  -0.048  -6.789
   14    HG   LEU   2           HG       LEU   2  -1.018   0.710  -5.626
   15   HD11  LEU   2          1HD1      LEU   2  -0.004   1.745  -3.681
   16   HD12  LEU   2          2HD1      LEU   2  -0.903   2.941  -4.614
   17   HD13  LEU   2          3HD1      LEU   2   0.857   2.887  -4.713
   18   HD21  LEU   2          3HD2      LEU   2   0.690   2.233  -7.520
   19   HD22  LEU   2          1HD2      LEU   2  -0.772   3.010  -6.911
   20   HD23  LEU   2          2HD2      LEU   2  -0.883   1.473  -7.770
   21    HA   PRO   3           HA       PRO   3   2.315  -4.676  -5.515
   22    HB2  PRO   3           2HB      PRO   3   0.083  -6.092  -6.135
   23    HB3  PRO   3           3HB      PRO   3   0.607  -5.805  -4.472
   24    HG2  PRO   3           2HG      PRO   3  -1.486  -4.382  -6.070
   25    HG3  PRO   3           3HG      PRO   3  -1.539  -4.914  -4.379
   26    HD2  PRO   3           2HD      PRO   3  -1.032  -2.349  -5.084
   27    HD3  PRO   3           3HD      PRO   3  -0.325  -3.101  -3.639
   28    H    LEU   4           H        LEU   4   0.807  -2.447  -7.447
   29    HA   LEU   4           HA       LEU   4   0.882  -4.054  -9.882
   30    HB2  LEU   4           2HB      LEU   4   0.122  -1.160  -9.518
   31    HB3  LEU   4           3HB      LEU   4  -0.111  -2.131 -10.970
   32    HG   LEU   4           HG       LEU   4  -1.533  -2.448  -8.330
   33   HD11  LEU   4          1HD1      LEU   4  -2.365  -0.591  -9.619
   34   HD12  LEU   4          2HD1      LEU   4  -3.523  -1.918  -9.694
   35   HD13  LEU   4          3HD1      LEU   4  -2.464  -1.594 -11.066
   36   HD21  LEU   4          3HD2      LEU   4  -1.125  -4.636  -9.271
   37   HD22  LEU   4          1HD2      LEU   4  -1.710  -4.101 -10.846
   38   HD23  LEU   4          2HD2      LEU   4  -2.823  -4.209  -9.483
   39    H    ILE   5           H        ILE   5   2.723  -1.665  -8.189
   40    HA   ILE   5           HA       ILE   5   4.256  -0.708 -10.378
   41    HB   ILE   5           HB       ILE   5   5.545   0.446  -8.844
   42   HG12  ILE   5          2HG1      ILE   5   4.956  -1.781  -6.889
   43   HG13  ILE   5          3HG1      ILE   5   6.503  -1.399  -7.637
   44   HG21  ILE   5          1HG2      ILE   5   4.006   1.567  -7.618
   45   HG22  ILE   5          2HG2      ILE   5   2.889   0.572  -8.551
   46   HG23  ILE   5          3HG2      ILE   5   3.336   0.097  -6.913
   47   HD11  ILE   5          3HD1      ILE   5   5.883   0.938  -6.374
   48   HD12  ILE   5          1HD1      ILE   5   5.231  -0.273  -5.271
   49   HD13  ILE   5          2HD1      ILE   5   6.932  -0.327  -5.734
   50    H    GLY   6           H        GLY   6   4.650  -3.376  -8.106
   51    HA2  GLY   6           2HA      GLY   6   7.282  -4.046  -9.096
   52    HA3  GLY   6           3HA      GLY   6   6.346  -4.952  -7.917
   53    H    ARG   7           H        ARG   7   4.120  -4.644 -10.134
   54    HA   ARG   7           HA       ARG   7   4.877  -7.138 -11.480
   55    HB2  ARG   7           2HB      ARG   7   2.824  -7.576 -10.563
   56    HB3  ARG   7           3HB      ARG   7   2.300  -5.901 -10.666
   57    HG2  ARG   7           2HG      ARG   7   2.669  -7.375 -13.209
   58    HG3  ARG   7           3HG      ARG   7   1.286  -7.806 -12.201
   59    HD2  ARG   7           2HD      ARG   7   1.037  -5.154 -12.122
   60    HD3  ARG   7           3HD      ARG   7   1.867  -5.298 -13.671
   61    HE   ARG   7           HE       ARG   7  -0.085  -6.054 -14.564
   62   HH11  ARG   7          1HH1      ARG   7  -0.161  -6.607 -11.127
   63   HH12  ARG   7          2HH1      ARG   7  -1.787  -7.205 -11.127
   64   HH21  ARG   7          1HH2      ARG   7  -2.226  -6.840 -14.577
   65   HH22  ARG   7          2HH2      ARG   7  -2.960  -7.338 -13.090
   66    H    VAL   8           H        VAL   8   3.977  -3.814 -12.066
   67    HA   VAL   8           HA       VAL   8   3.289  -3.782 -14.713
   68    HB   VAL   8           HB       VAL   8   3.420  -1.778 -13.239
   69   HG11  VAL   8          1HG1      VAL   8   6.220  -1.260 -13.990
   70   HG12  VAL   8          2HG1      VAL   8   5.351  -0.874 -12.503
   71   HG13  VAL   8          3HG1      VAL   8   5.975  -2.503 -12.764
   72   HG21  VAL   8          3HG2      VAL   8   4.338  -0.250 -15.080
   73   HG22  VAL   8          1HG2      VAL   8   4.626  -1.735 -15.986
   74   HG23  VAL   8          2HG2      VAL   8   2.988  -1.307 -15.491
   75    H    LEU   9           H        LEU   9   6.448  -4.338 -13.328
   76    HA   LEU   9           HA       LEU   9   8.084  -3.889 -15.525
   77    HB2  LEU   9           2HB      LEU   9   9.707  -5.216 -14.455
   78    HB3  LEU   9           3HB      LEU   9   8.775  -4.449 -13.171
   79    HG   LEU   9           HG       LEU   9   7.453  -6.737 -13.245
   80   HD11  LEU   9          1HD1      LEU   9  10.028  -8.019 -13.694
   81   HD12  LEU   9          2HD1      LEU   9   9.364  -7.267 -15.144
   82   HD13  LEU   9          3HD1      LEU   9   8.420  -8.469 -14.263
   83   HD21  LEU   9          3HD2      LEU   9   8.796  -7.500 -11.415
   84   HD22  LEU   9          1HD2      LEU   9   8.720  -5.739 -11.347
   85   HD23  LEU   9          2HD2      LEU   9  10.171  -6.536 -11.957
   86    H    SER  10           H        SER  10   6.159  -6.728 -14.688
   87    HA   SER  10           HA       SER  10   6.963  -7.999 -17.211
   88    HB2  SER  10           2HB      SER  10   7.241  -9.641 -15.618
   89    HB3  SER  10           3HB      SER  10   5.940  -9.025 -14.601
   90    HG   SER  10           HG       SER  10   5.049 -10.781 -15.476
   91    H    GLY  11           H        GLY  11   4.240  -6.667 -15.483
   92    HA2  GLY  11           2HA      GLY  11   2.187  -7.720 -17.132
   93    HA3  GLY  11           3HA      GLY  11   2.051  -6.315 -16.086
   94    H    ILE  12           H        ILE  12   4.409  -5.103 -17.549
   95    HA   ILE  12           HA       ILE  12   2.823  -3.798 -19.589
   96    HB   ILE  12           HB       ILE  12   4.394  -2.580 -18.018
   97   HG12  ILE  12          2HG1      ILE  12   4.884  -2.149 -20.971
   98   HG13  ILE  12          3HG1      ILE  12   3.440  -1.617 -20.117
   99   HG21  ILE  12          1HG2      ILE  12   6.532  -3.520 -19.915
  100   HG22  ILE  12          2HG2      ILE  12   6.726  -2.562 -18.448
  101   HG23  ILE  12          3HG2      ILE  12   6.248  -4.255 -18.338
  102   HD11  ILE  12          3HD1      ILE  12   5.580  -0.609 -18.643
  103   HD12  ILE  12          1HD1      ILE  12   6.007  -0.354 -20.335
  104   HD13  ILE  12          2HD1      ILE  12   4.489   0.284 -19.703
  105    H    LEU  13           H        LEU  13   5.407  -6.121 -19.392
  106    HA   LEU  13           HA       LEU  13   6.542  -5.971 -21.901
  107    HB2  LEU  13           2HB      LEU  13   6.560  -7.770 -19.758
  108    HB3  LEU  13           3HB      LEU  13   6.106  -8.723 -21.169
  109    HG   LEU  13           HG       LEU  13   8.487  -8.854 -20.836
  110   HD11  LEU  13          1HD1      LEU  13   9.240  -8.219 -23.006
  111   HD12  LEU  13          2HD1      LEU  13   7.969  -7.007 -23.157
  112   HD13  LEU  13          3HD1      LEU  13   7.556  -8.722 -23.151
  113   HD21  LEU  13          3HD2      LEU  13   8.209  -6.104 -20.132
  114   HD22  LEU  13          1HD2      LEU  13   9.374  -6.244 -21.448
  115   HD23  LEU  13          2HD2      LEU  13   9.613  -7.157 -19.958
  Start of MODEL   16
    1    H1   PHE   1           H        PHE   1   1.187  -0.686   0.273
    2    HA   PHE   1           HA       PHE   1   2.885   1.021  -1.381
    3    HB2  PHE   1           2HB      PHE   1   4.593  -0.432  -1.618
    4    HB3  PHE   1           3HB      PHE   1   3.985  -1.155  -0.132
    5    HD1  PHE   1           HD2      PHE   1   2.342  -3.079  -0.326
    6    HD2  PHE   1           HD1      PHE   1   4.648  -1.647  -3.605
    7    HE1  PHE   1           HE2      PHE   1   1.968  -5.202  -1.512
    8    HE2  PHE   1           HE1      PHE   1   4.277  -3.768  -4.796
    9    HZ   PHE   1           HZ       PHE   1   2.936  -5.549  -3.749
   10    H    LEU   2           H        LEU   2   2.988   0.027  -3.688
   11    HA   LEU   2           HA       LEU   2   0.260  -0.833  -4.381
   12    HB2  LEU   2           2HB      LEU   2   2.161   1.069  -5.577
   13    HB3  LEU   2           3HB      LEU   2   1.295   0.047  -6.722
   14    HG   LEU   2           HG       LEU   2   0.197   2.211  -6.415
   15   HD11  LEU   2          1HD1      LEU   2  -1.484   0.058  -5.157
   16   HD12  LEU   2          2HD1      LEU   2  -1.073   0.079  -6.871
   17   HD13  LEU   2          3HD1      LEU   2  -2.010   1.401  -6.173
   18   HD21  LEU   2          3HD2      LEU   2  -0.266   1.353  -3.563
   19   HD22  LEU   2          1HD2      LEU   2  -0.783   2.857  -4.324
   20   HD23  LEU   2          2HD2      LEU   2   0.933   2.546  -4.063
   21    HA   PRO   3           HA       PRO   3   2.311  -4.641  -5.538
   22    HB2  PRO   3           2HB      PRO   3   0.026  -5.967  -6.165
   23    HB3  PRO   3           3HB      PRO   3   0.572  -5.728  -4.501
   24    HG2  PRO   3           2HG      PRO   3  -1.481  -4.205  -6.058
   25    HG3  PRO   3           3HG      PRO   3  -1.541  -4.765  -4.376
   26    HD2  PRO   3           2HD      PRO   3  -0.949  -2.207  -5.040
   27    HD3  PRO   3           3HD      PRO   3  -0.259  -3.008  -3.614
   28    H    LEU   4           H        LEU   4   0.868  -2.327  -7.419
   29    HA   LEU   4           HA       LEU   4   0.869  -3.892  -9.882
   30    HB2  LEU   4           2HB      LEU   4   0.210  -0.983  -9.454
   31    HB3  LEU   4           3HB      LEU   4  -0.058  -1.910 -10.929
   32    HG   LEU   4           HG       LEU   4  -1.489  -2.230  -8.294
   33   HD11  LEU   4          1HD1      LEU   4  -2.340  -1.263 -11.015
   34   HD12  LEU   4          2HD1      LEU   4  -2.314  -0.352  -9.506
   35   HD13  LEU   4          3HD1      LEU   4  -3.465  -1.671  -9.718
   36   HD21  LEU   4          3HD2      LEU   4  -1.075  -4.410  -9.346
   37   HD22  LEU   4          1HD2      LEU   4  -1.814  -3.822 -10.835
   38   HD23  LEU   4          2HD2      LEU   4  -2.785  -3.977  -9.371
   39    H    ILE   5           H        ILE   5   2.805  -1.600  -8.163
   40    HA   ILE   5           HA       ILE   5   4.355  -0.659 -10.346
   41    HB   ILE   5           HB       ILE   5   5.694   0.423  -8.803
   42   HG12  ILE   5          2HG1      ILE   5   5.042  -1.817  -6.882
   43   HG13  ILE   5          3HG1      ILE   5   6.596  -1.475  -7.635
   44   HG21  ILE   5          1HG2      ILE   5   4.205   1.575  -7.546
   45   HG22  ILE   5          2HG2      ILE   5   3.047   0.636  -8.487
   46   HG23  ILE   5          3HG2      ILE   5   3.488   0.117  -6.861
   47   HD11  ILE   5          3HD1      ILE   5   5.296  -0.221  -5.304
   48   HD12  ILE   5          1HD1      ILE   5   6.998  -0.561  -5.614
   49   HD13  ILE   5          2HD1      ILE   5   6.227   0.838  -6.363
   50    H    GLY   6           H        GLY   6   4.672  -3.377  -8.122
   51    HA2  GLY   6           2HA      GLY   6   7.272  -4.122  -9.143
   52    HA3  GLY   6           3HA      GLY   6   6.312  -5.016  -7.974
   53    H    ARG   7           H        ARG   7   4.083  -4.594 -10.166
   54    HA   ARG   7           HA       ARG   7   4.744  -7.086 -11.562
   55    HB2  ARG   7           2HB      ARG   7   2.683  -7.472 -10.642
   56    HB3  ARG   7           3HB      ARG   7   2.218  -5.777 -10.706
   57    HG2  ARG   7           2HG      ARG   7   2.515  -7.209 -13.282
   58    HG3  ARG   7           3HG      ARG   7   1.125  -7.611 -12.272
   59    HD2  ARG   7           2HD      ARG   7   1.324  -4.807 -12.271
   60    HD3  ARG   7           3HD      ARG   7   1.559  -5.319 -13.942
   61    HE   ARG   7           HE       ARG   7  -0.877  -5.333 -12.497
   62   HH11  ARG   7          1HH1      ARG   7   0.931  -7.147 -14.855
   63   HH12  ARG   7          2HH1      ARG   7  -0.475  -7.840 -15.592
   64   HH21  ARG   7          1HH2      ARG   7  -2.736  -6.239 -13.459
   65   HH22  ARG   7          2HH2      ARG   7  -2.560  -7.322 -14.798
   66    H    VAL   8           H        VAL   8   3.952  -3.724 -12.084
   67    HA   VAL   8           HA       VAL   8   3.256  -3.629 -14.730
   68    HB   VAL   8           HB       VAL   8   3.447  -1.657 -13.213
   69   HG11  VAL   8          1HG1      VAL   8   5.987  -2.451 -12.779
   70   HG12  VAL   8          2HG1      VAL   8   6.250  -1.194 -13.989
   71   HG13  VAL   8          3HG1      VAL   8   5.407  -0.811 -12.487
   72   HG21  VAL   8          3HG2      VAL   8   3.501  -0.228 -14.971
   73   HG22  VAL   8          1HG2      VAL   8   5.010  -0.887 -15.601
   74   HG23  VAL   8          2HG2      VAL   8   3.490  -1.733 -15.890
   75    H    LEU   9           H        LEU   9   6.392  -4.312 -13.361
   76    HA   LEU   9           HA       LEU   9   8.035  -3.863 -15.560
   77    HB2  LEU   9           2HB      LEU   9   9.637  -5.206 -14.500
   78    HB3  LEU   9           3HB      LEU   9   8.699  -4.479 -13.198
   79    HG   LEU   9           HG       LEU   9   7.374  -6.764 -13.359
   80   HD11  LEU   9          1HD1      LEU   9   9.567  -8.377 -13.663
   81   HD12  LEU   9          2HD1      LEU   9   9.771  -7.201 -14.961
   82   HD13  LEU   9          3HD1      LEU   9   8.287  -8.147 -14.855
   83   HD21  LEU   9          3HD2      LEU   9   8.760  -5.739 -11.468
   84   HD22  LEU   9          1HD2      LEU   9  10.069  -6.775 -12.038
   85   HD23  LEU   9          2HD2      LEU   9   8.558  -7.491 -11.477
   86    H    SER  10           H        SER  10   6.035  -6.654 -14.750
   87    HA   SER  10           HA       SER  10   6.809  -7.929 -17.279
   88    HB2  SER  10           2HB      SER  10   6.045  -8.926 -14.643
   89    HB3  SER  10           3HB      SER  10   5.153  -9.709 -15.947
   90    HG   SER  10           HG       SER  10   7.014 -10.856 -15.714
   91    H    GLY  11           H        GLY  11   4.122  -6.527 -15.553
   92    HA2  GLY  11           2HA      GLY  11   2.045  -7.506 -17.222
   93    HA3  GLY  11           3HA      GLY  11   1.944  -6.110 -16.159
   94    H    ILE  12           H        ILE  12   4.344  -4.951 -17.599
   95    HA   ILE  12           HA       ILE  12   2.805  -3.576 -19.630
   96    HB   ILE  12           HB       ILE  12   4.404  -2.422 -18.040
   97   HG12  ILE  12          2HG1      ILE  12   5.166  -1.853 -20.886
   98   HG13  ILE  12          3HG1      ILE  12   3.509  -1.602 -20.350
   99   HG21  ILE  12          1HG2      ILE  12   6.518  -3.425 -19.933
  100   HG22  ILE  12          2HG2      ILE  12   6.741  -2.461 -18.474
  101   HG23  ILE  12          3HG2      ILE  12   6.211  -4.138 -18.349
  102   HD11  ILE  12          3HD1      ILE  12   4.565  -0.195 -18.474
  103   HD12  ILE  12          1HD1      ILE  12   5.998  -0.188 -19.501
  104   HD13  ILE  12          2HD1      ILE  12   4.480   0.480 -20.101
  105    H    LEU  13           H        LEU  13   5.321  -5.976 -19.450
  106    HA   LEU  13           HA       LEU  13   6.470  -5.831 -21.953
  107    HB2  LEU  13           2HB      LEU  13   6.404  -7.667 -19.831
  108    HB3  LEU  13           3HB      LEU  13   5.967  -8.577 -21.275
  109    HG   LEU  13           HG       LEU  13   8.090  -7.552 -22.310
  110   HD11  LEU  13          1HD1      LEU  13   9.814  -6.884 -20.792
  111   HD12  LEU  13          2HD1      LEU  13   8.787  -7.217 -19.398
  112   HD13  LEU  13          3HD1      LEU  13   8.392  -5.886 -20.486
  113   HD21  LEU  13          3HD2      LEU  13   8.163  -9.614 -20.114
  114   HD22  LEU  13          1HD2      LEU  13   9.497  -9.310 -21.226
  115   HD23  LEU  13          2HD2      LEU  13   7.950  -9.889 -21.843
  Start of MODEL   17
    1    H1   PHE   1           H        PHE   1   1.544   0.759   0.607
    2    HA   PHE   1           HA       PHE   1   2.722   0.963  -1.331
    3    HB2  PHE   1           2HB      PHE   1   4.495  -0.412  -1.565
    4    HB3  PHE   1           3HB      PHE   1   3.928  -1.150  -0.071
    5    HD1  PHE   1           HD1      PHE   1   2.375  -3.148  -0.241
    6    HD2  PHE   1           HD2      PHE   1   4.599  -1.640  -3.542
    7    HE1  PHE   1           HE1      PHE   1   2.095  -5.297  -1.407
    8    HE2  PHE   1           HE2      PHE   1   4.322  -3.786  -4.713
    9    HZ   PHE   1           HZ       PHE   1   3.068  -5.617  -3.647
   10    H    LEU   2           H        LEU   2   2.862  -0.045  -3.631
   11    HA   LEU   2           HA       LEU   2   0.174  -1.035  -4.304
   12    HB2  LEU   2           2HB      LEU   2   1.981   0.942  -5.526
   13    HB3  LEU   2           3HB      LEU   2   1.156  -0.128  -6.657
   14    HG   LEU   2           HG       LEU   2  -0.678   0.988  -4.711
   15   HD11  LEU   2          1HD1      LEU   2   1.011   2.873  -6.333
   16   HD12  LEU   2          2HD1      LEU   2   0.699   2.903  -4.598
   17   HD13  LEU   2          3HD1      LEU   2  -0.593   3.294  -5.733
   18   HD21  LEU   2          3HD2      LEU   2  -0.620   1.410  -7.685
   19   HD22  LEU   2          1HD2      LEU   2  -2.014   1.351  -6.606
   20   HD23  LEU   2          2HD2      LEU   2  -1.113  -0.123  -6.963
   21    HA   PRO   3           HA       PRO   3   2.394  -4.754  -5.439
   22    HB2  PRO   3           2HB      PRO   3   0.171  -6.190  -6.044
   23    HB3  PRO   3           3HB      PRO   3   0.713  -5.911  -4.385
   24    HG2  PRO   3           2HG      PRO   3  -1.416  -4.498  -5.944
   25    HG3  PRO   3           3HG      PRO   3  -1.442  -5.046  -4.258
   26    HD2  PRO   3           2HD      PRO   3  -0.973  -2.470  -4.945
   27    HD3  PRO   3           3HD      PRO   3  -0.239  -3.225  -3.516
   28    H    LEU   4           H        LEU   4   0.837  -2.526  -7.333
   29    HA   LEU   4           HA       LEU   4   0.899  -4.110  -9.782
   30    HB2  LEU   4           2HB      LEU   4   0.111  -1.229  -9.380
   31    HB3  LEU   4           3HB      LEU   4  -0.127  -2.186 -10.841
   32    HG   LEU   4           HG       LEU   4  -1.516  -2.549  -8.189
   33   HD11  LEU   4          1HD1      LEU   4  -2.390  -0.690  -9.441
   34   HD12  LEU   4          2HD1      LEU   4  -3.528  -2.034  -9.534
   35   HD13  LEU   4          3HD1      LEU   4  -2.480  -1.669 -10.905
   36   HD21  LEU   4          3HD2      LEU   4  -2.766  -4.338  -9.276
   37   HD22  LEU   4          1HD2      LEU   4  -1.044  -4.714  -9.222
   38   HD23  LEU   4          2HD2      LEU   4  -1.778  -4.159 -10.727
   39    H    ILE   5           H        ILE   5   2.735  -1.716  -8.092
   40    HA   ILE   5           HA       ILE   5   4.230  -0.723 -10.291
   41    HB   ILE   5           HB       ILE   5   5.524   0.433  -8.763
   42   HG12  ILE   5          2HG1      ILE   5   4.987  -1.819  -6.821
   43   HG13  ILE   5          3HG1      ILE   5   6.520  -1.411  -7.585
   44   HG21  ILE   5          1HG2      ILE   5   3.990   1.524  -7.506
   45   HG22  ILE   5          2HG2      ILE   5   2.872   0.526  -8.435
   46   HG23  ILE   5          3HG2      ILE   5   3.344   0.040  -6.807
   47   HD11  ILE   5          3HD1      ILE   5   6.670  -0.644  -5.374
   48   HD12  ILE   5          1HD1      ILE   5   6.385   0.793  -6.356
   49   HD13  ILE   5          2HD1      ILE   5   5.063   0.080  -5.431
   50    H    GLY   6           H        GLY   6   4.681  -3.406  -8.047
   51    HA2  GLY   6           2HA      GLY   6   7.308  -4.038  -9.076
   52    HA3  GLY   6           3HA      GLY   6   6.397  -4.965  -7.893
   53    H    ARG   7           H        ARG   7   4.141  -4.662 -10.079
   54    HA   ARG   7           HA       ARG   7   4.907  -7.135 -11.456
   55    HB2  ARG   7           2HB      ARG   7   2.872  -7.605 -10.518
   56    HB3  ARG   7           3HB      ARG   7   2.327  -5.935 -10.600
   57    HG2  ARG   7           2HG      ARG   7   2.681  -7.383 -13.160
   58    HG3  ARG   7           3HG      ARG   7   1.315  -7.838 -12.139
   59    HD2  ARG   7           2HD      ARG   7   1.327  -5.049 -12.139
   60    HD3  ARG   7           3HD      ARG   7   1.676  -5.508 -13.806
   61    HE   ARG   7           HE       ARG   7  -0.539  -6.927 -12.641
   62   HH11  ARG   7          1HH1      ARG   7   0.459  -4.066 -14.354
   63   HH12  ARG   7          2HH1      ARG   7  -1.107  -3.768 -15.034
   64   HH21  ARG   7          1HH2      ARG   7  -2.605  -6.546 -13.529
   65   HH22  ARG   7          2HH2      ARG   7  -2.849  -5.179 -14.562
   66    H    VAL   8           H        VAL   8   3.964  -3.817 -12.002
   67    HA   VAL   8           HA       VAL   8   3.243  -3.771 -14.640
   68    HB   VAL   8           HB       VAL   8   3.369  -1.778 -13.150
   69   HG11  VAL   8          1HG1      VAL   8   5.938  -2.479 -12.714
   70   HG12  VAL   8          2HG1      VAL   8   6.153  -1.218 -13.930
   71   HG13  VAL   8          3HG1      VAL   8   5.298  -0.861 -12.429
   72   HG21  VAL   8          3HG2      VAL   8   3.453  -0.319 -14.909
   73   HG22  VAL   8          1HG2      VAL   8   4.903  -1.053 -15.592
   74   HG23  VAL   8          2HG2      VAL   8   3.338  -1.841 -15.792
   75    H    LEU   9           H        LEU   9   6.425  -4.302 -13.300
   76    HA   LEU   9           HA       LEU   9   8.027  -3.816 -15.512
   77    HB2  LEU   9           2HB      LEU   9   9.679  -5.134 -14.475
   78    HB3  LEU   9           3HB      LEU   9   8.754  -4.389 -13.172
   79    HG   LEU   9           HG       LEU   9   7.457  -6.691 -13.250
   80   HD11  LEU   9          1HD1      LEU   9  10.056  -7.919 -13.757
   81   HD12  LEU   9          2HD1      LEU   9   9.322  -7.191 -15.186
   82   HD13  LEU   9          3HD1      LEU   9   8.443  -8.415 -14.270
   83   HD21  LEU   9          3HD2      LEU   9  10.189  -6.533 -11.996
   84   HD22  LEU   9          1HD2      LEU   9   8.780  -7.425 -11.421
   85   HD23  LEU   9          2HD2      LEU   9   8.785  -5.662 -11.378
   86    H    SER  10           H        SER  10   6.146  -6.683 -14.677
   87    HA   SER  10           HA       SER  10   6.932  -7.924 -17.220
   88    HB2  SER  10           2HB      SER  10   6.359  -8.953 -14.579
   89    HB3  SER  10           3HB      SER  10   5.323  -9.723 -15.781
   90    HG   SER  10           HG       SER  10   7.265 -10.852 -15.614
   91    H    GLY  11           H        GLY  11   4.217  -6.636 -15.447
   92    HA2  GLY  11           2HA      GLY  11   2.154  -7.699 -17.080
   93    HA3  GLY  11           3HA      GLY  11   2.016  -6.304 -16.020
   94    H    ILE  12           H        ILE  12   4.341  -5.053 -17.501
   95    HA   ILE  12           HA       ILE  12   2.715  -3.749 -19.510
   96    HB   ILE  12           HB       ILE  12   4.292  -2.527 -17.949
   97   HG12  ILE  12          2HG1      ILE  12   4.763  -2.056 -20.898
   98   HG13  ILE  12          3HG1      ILE  12   3.300  -1.574 -20.046
   99   HG21  ILE  12          1HG2      ILE  12   6.459  -3.270 -19.876
  100   HG22  ILE  12          2HG2      ILE  12   6.591  -2.558 -18.269
  101   HG23  ILE  12          3HG2      ILE  12   6.145  -4.255 -18.446
  102   HD11  ILE  12          3HD1      ILE  12   5.937  -0.328 -20.113
  103   HD12  ILE  12          1HD1      ILE  12   4.353   0.372 -19.781
  104   HD13  ILE  12          2HD1      ILE  12   5.239  -0.455 -18.499
  105    H    LEU  13           H        LEU  13   5.328  -6.045 -19.365
  106    HA   LEU  13           HA       LEU  13   6.430  -5.861 -21.887
  107    HB2  LEU  13           2HB      LEU  13   6.394  -7.746 -19.766
  108    HB3  LEU  13           3HB      LEU  13   6.108  -8.619 -21.270
  109    HG   LEU  13           HG       LEU  13   8.451  -6.776 -20.818
  110   HD11  LEU  13          1HD1      LEU  13   9.777  -8.596 -20.239
  111   HD12  LEU  13          2HD1      LEU  13   8.591  -9.769 -20.811
  112   HD13  LEU  13          3HD1      LEU  13   8.292  -8.865 -19.326
  113   HD21  LEU  13          3HD2      LEU  13   7.510  -7.432 -23.172
  114   HD22  LEU  13          1HD2      LEU  13   8.319  -8.964 -22.840
  115   HD23  LEU  13          2HD2      LEU  13   9.246  -7.463 -22.861
  Start of MODEL   18
    1    H1   PHE   1           H        PHE   1   2.156  -0.009   0.887
    2    HA   PHE   1           HA       PHE   1   2.624   1.073  -1.428
    3    HB2  PHE   1           2HB      PHE   1   4.401  -0.303  -1.621
    4    HB3  PHE   1           3HB      PHE   1   3.817  -1.019  -0.122
    5    HD1  PHE   1           HD1      PHE   1   2.268  -3.022  -0.280
    6    HD2  PHE   1           HD2      PHE   1   4.531  -1.561  -3.577
    7    HE1  PHE   1           HE1      PHE   1   2.004  -5.188  -1.417
    8    HE2  PHE   1           HE2      PHE   1   4.269  -3.725  -4.719
    9    HZ   PHE   1           HZ       PHE   1   3.004  -5.541  -3.640
   10    H    LEU   2           H        LEU   2   2.794   0.031  -3.711
   11    HA   LEU   2           HA       LEU   2   0.114  -0.972  -4.402
   12    HB2  LEU   2           2HB      LEU   2   1.937   0.986  -5.633
   13    HB3  LEU   2           3HB      LEU   2   1.122  -0.100  -6.757
   14    HG   LEU   2           HG       LEU   2  -1.053   0.635  -5.749
   15   HD11  LEU   2          1HD1      LEU   2  -0.448   3.112  -4.723
   16   HD12  LEU   2          2HD1      LEU   2   0.792   2.074  -4.019
   17   HD13  LEU   2          3HD1      LEU   2  -0.914   1.689  -3.790
   18   HD21  LEU   2          3HD2      LEU   2  -0.686   1.617  -7.790
   19   HD22  LEU   2          1HD2      LEU   2   0.793   2.419  -7.262
   20   HD23  LEU   2          2HD2      LEU   2  -0.777   3.042  -6.754
   21    HA   PRO   3           HA       PRO   3   2.352  -4.706  -5.453
   22    HB2  PRO   3           2HB      PRO   3   0.137  -6.153  -6.063
   23    HB3  PRO   3           3HB      PRO   3   0.659  -5.849  -4.402
   24    HG2  PRO   3           2HG      PRO   3  -1.453  -4.462  -6.008
   25    HG3  PRO   3           3HG      PRO   3  -1.498  -4.984  -4.314
   26    HD2  PRO   3           2HD      PRO   3  -1.023  -2.418  -5.035
   27    HD3  PRO   3           3HD      PRO   3  -0.306  -3.151  -3.586
   28    H    LEU   4           H        LEU   4   0.815  -2.508  -7.399
   29    HA   LEU   4           HA       LEU   4   0.908  -4.129  -9.823
   30    HB2  LEU   4           2HB      LEU   4   0.115  -1.243  -9.478
   31    HB3  LEU   4           3HB      LEU   4  -0.108  -2.225 -10.924
   32    HG   LEU   4           HG       LEU   4  -1.527  -2.531  -8.281
   33   HD11  LEU   4          1HD1      LEU   4  -2.415  -0.718  -9.563
   34   HD12  LEU   4          2HD1      LEU   4  -3.524  -2.082  -9.698
   35   HD13  LEU   4          3HD1      LEU   4  -2.434  -1.697 -11.030
   36   HD21  LEU   4          3HD2      LEU   4  -2.755  -4.355  -9.329
   37   HD22  LEU   4          1HD2      LEU   4  -1.031  -4.721  -9.255
   38   HD23  LEU   4          2HD2      LEU   4  -1.759  -4.209 -10.778
   39    H    ILE   5           H        ILE   5   2.722  -1.709  -8.148
   40    HA   ILE   5           HA       ILE   5   4.243  -0.748 -10.343
   41    HB   ILE   5           HB       ILE   5   5.518   0.432  -8.819
   42   HG12  ILE   5          2HG1      ILE   5   4.959  -1.790  -6.849
   43   HG13  ILE   5          3HG1      ILE   5   6.500  -1.393  -7.600
   44   HG21  ILE   5          1HG2      ILE   5   3.967   1.541  -7.598
   45   HG22  ILE   5          2HG2      ILE   5   2.862   0.528  -8.524
   46   HG23  ILE   5          3HG2      ILE   5   3.314   0.067  -6.883
   47   HD11  ILE   5          3HD1      ILE   5   6.586  -0.609  -5.376
   48   HD12  ILE   5          1HD1      ILE   5   6.391   0.810  -6.404
   49   HD13  ILE   5          2HD1      ILE   5   5.010   0.169  -5.514
   50    H    GLY   6           H        GLY   6   4.669  -3.396  -8.053
   51    HA2  GLY   6           2HA      GLY   6   7.308  -4.042  -9.040
   52    HA3  GLY   6           3HA      GLY   6   6.383  -4.951  -7.854
   53    H    ARG   7           H        ARG   7   4.153  -4.684 -10.072
   54    HA   ARG   7           HA       ARG   7   4.939  -7.178 -11.400
   55    HB2  ARG   7           2HB      ARG   7   2.892  -7.635 -10.479
   56    HB3  ARG   7           3HB      ARG   7   2.348  -5.967 -10.594
   57    HG2  ARG   7           2HG      ARG   7   2.733  -7.454 -13.127
   58    HG3  ARG   7           3HG      ARG   7   1.356  -7.895 -12.115
   59    HD2  ARG   7           2HD      ARG   7   1.382  -5.100 -12.168
   60    HD3  ARG   7           3HD      ARG   7   1.722  -5.603 -13.824
   61    HE   ARG   7           HE       ARG   7  -0.500  -6.972 -12.604
   62   HH11  ARG   7          1HH1      ARG   7   0.519  -4.190 -14.432
   63   HH12  ARG   7          2HH1      ARG   7  -1.045  -3.908 -15.122
   64   HH21  ARG   7          1HH2      ARG   7  -2.564  -6.611 -13.506
   65   HH22  ARG   7          2HH2      ARG   7  -2.798  -5.285 -14.593
   66    H    VAL   8           H        VAL   8   3.999  -3.870 -12.009
   67    HA   VAL   8           HA       VAL   8   3.310  -3.865 -14.656
   68    HB   VAL   8           HB       VAL   8   3.417  -1.849 -13.197
   69   HG11  VAL   8          1HG1      VAL   8   5.336  -0.918 -12.468
   70   HG12  VAL   8          2HG1      VAL   8   5.982  -2.541 -12.718
   71   HG13  VAL   8          3HG1      VAL   8   6.210  -1.301 -13.951
   72   HG21  VAL   8          3HG2      VAL   8   3.326  -0.544 -15.018
   73   HG22  VAL   8          1HG2      VAL   8   4.968  -0.958 -15.511
   74   HG23  VAL   8          2HG2      VAL   8   3.629  -2.032 -15.915
   75    H    LEU   9           H        LEU   9   6.476  -4.372 -13.270
   76    HA   LEU   9           HA       LEU   9   8.105  -3.920 -15.471
   77    HB2  LEU   9           2HB      LEU   9   9.744  -5.221 -14.393
   78    HB3  LEU   9           3HB      LEU   9   8.804  -4.457 -13.113
   79    HG   LEU   9           HG       LEU   9   7.508  -6.760 -13.172
   80   HD11  LEU   9          1HD1      LEU   9   8.494  -8.486 -14.181
   81   HD12  LEU   9          2HD1      LEU   9  10.096  -8.018 -13.611
   82   HD13  LEU   9          3HD1      LEU   9   9.428  -7.280 -15.066
   83   HD21  LEU   9          3HD2      LEU   9   8.867  -7.498 -11.340
   84   HD22  LEU   9          1HD2      LEU   9   8.759  -5.739 -11.278
   85   HD23  LEU   9          2HD2      LEU   9  10.223  -6.512 -11.886
   86    H    SER  10           H        SER  10   6.214  -6.775 -14.614
   87    HA   SER  10           HA       SER  10   7.030  -8.054 -17.128
   88    HB2  SER  10           2HB      SER  10   6.467  -9.045 -14.483
   89    HB3  SER  10           3HB      SER  10   5.389  -9.812 -15.650
   90    HG   SER  10           HG       SER  10   7.187 -10.476 -16.822
   91    H    GLY  11           H        GLY  11   4.292  -6.746 -15.405
   92    HA2  GLY  11           2HA      GLY  11   2.250  -7.833 -17.047
   93    HA3  GLY  11           3HA      GLY  11   2.099  -6.422 -16.010
   94    H    ILE  12           H        ILE  12   4.441  -5.192 -17.482
   95    HA   ILE  12           HA       ILE  12   2.838  -3.920 -19.530
   96    HB   ILE  12           HB       ILE  12   4.397  -2.673 -17.968
   97   HG12  ILE  12          2HG1      ILE  12   5.402  -1.370 -20.085
   98   HG13  ILE  12          3HG1      ILE  12   4.226  -2.378 -20.922
   99   HG21  ILE  12          1HG2      ILE  12   6.546  -3.588 -19.863
  100   HG22  ILE  12          2HG2      ILE  12   6.725  -2.635 -18.391
  101   HG23  ILE  12          3HG2      ILE  12   6.269  -4.335 -18.290
  102   HD11  ILE  12          3HD1      ILE  12   2.635  -1.468 -19.024
  103   HD12  ILE  12          1HD1      ILE  12   3.807  -0.151 -19.015
  104   HD13  ILE  12          2HD1      ILE  12   2.945  -0.554 -20.500
  105    H    LEU  13           H        LEU  13   5.450  -6.212 -19.319
  106    HA   LEU  13           HA       LEU  13   6.582  -6.065 -21.830
  107    HB2  LEU  13           2HB      LEU  13   6.658  -7.826 -19.675
  108    HB3  LEU  13           3HB      LEU  13   6.154  -8.815 -21.044
  109    HG   LEU  13           HG       LEU  13   8.570  -8.899 -20.714
  110   HD11  LEU  13          1HD1      LEU  13   9.151  -8.715 -22.945
  111   HD12  LEU  13          2HD1      LEU  13   8.143  -7.291 -23.199
  112   HD13  LEU  13          3HD1      LEU  13   7.397  -8.879 -23.020
  113   HD21  LEU  13          3HD2      LEU  13   9.953  -7.077 -20.627
  114   HD22  LEU  13          1HD2      LEU  13   8.511  -6.408 -19.862
  115   HD23  LEU  13          2HD2      LEU  13   8.854  -6.057 -21.557
  Start of MODEL   19
    1    H1   PHE   1           H        PHE   1   0.790   0.439   0.180
    2    HA   PHE   1           HA       PHE   1   2.654   1.012  -1.370
    3    HB2  PHE   1           2HB      PHE   1   4.419  -0.378  -1.577
    4    HB3  PHE   1           3HB      PHE   1   3.819  -1.116  -0.095
    5    HD1  PHE   1           HD1      PHE   1   2.252  -3.100  -0.301
    6    HD2  PHE   1           HD2      PHE   1   4.547  -1.600  -3.556
    7    HE1  PHE   1           HE1      PHE   1   1.974  -5.242  -1.480
    8    HE2  PHE   1           HE2      PHE   1   4.272  -3.739  -4.740
    9    HZ   PHE   1           HZ       PHE   1   2.983  -5.563  -3.703
   10    H    LEU   2           H        LEU   2   2.826   0.011  -3.670
   11    HA   LEU   2           HA       LEU   2   0.141  -0.954  -4.394
   12    HB2  LEU   2           2HB      LEU   2   1.988   1.010  -5.579
   13    HB3  LEU   2           3HB      LEU   2   1.169  -0.048  -6.727
   14    HG   LEU   2           HG       LEU   2  -0.023   2.056  -6.466
   15   HD11  LEU   2          1HD1      LEU   2  -1.127  -0.545  -6.068
   16   HD12  LEU   2          2HD1      LEU   2  -1.829   0.847  -6.891
   17   HD13  LEU   2          3HD1      LEU   2  -2.072   0.633  -5.157
   18   HD21  LEU   2          3HD2      LEU   2  -1.166   2.499  -4.272
   19   HD22  LEU   2          1HD2      LEU   2   0.582   2.737  -4.273
   20   HD23  LEU   2          2HD2      LEU   2  -0.109   1.280  -3.558
   21    HA   PRO   3           HA       PRO   3   2.349  -4.688  -5.504
   22    HB2  PRO   3           2HB      PRO   3   0.124  -6.102  -6.153
   23    HB3  PRO   3           3HB      PRO   3   0.639  -5.834  -4.484
   24    HG2  PRO   3           2HG      PRO   3  -1.450  -4.397  -6.075
   25    HG3  PRO   3           3HG      PRO   3  -1.510  -4.951  -4.392
   26    HD2  PRO   3           2HD      PRO   3  -1.006  -2.376  -5.061
   27    HD3  PRO   3           3HD      PRO   3  -0.305  -3.143  -3.622
   28    H    LEU   4           H        LEU   4   0.846  -2.439  -7.416
   29    HA   LEU   4           HA       LEU   4   0.938  -4.015  -9.870
   30    HB2  LEU   4           2HB      LEU   4   0.169  -1.128  -9.476
   31    HB3  LEU   4           3HB      LEU   4  -0.055  -2.083 -10.940
   32    HG   LEU   4           HG       LEU   4  -1.489  -2.432  -8.309
   33   HD11  LEU   4          1HD1      LEU   4  -2.374  -1.510 -11.036
   34   HD12  LEU   4          2HD1      LEU   4  -2.353  -0.575  -9.541
   35   HD13  LEU   4          3HD1      LEU   4  -3.476  -1.922  -9.722
   36   HD21  LEU   4          3HD2      LEU   4  -2.736  -4.212  -9.410
   37   HD22  LEU   4          1HD2      LEU   4  -1.017  -4.601  -9.341
   38   HD23  LEU   4          2HD2      LEU   4  -1.734  -4.039 -10.851
   39    H    ILE   5           H        ILE   5   2.763  -1.643  -8.138
   40    HA   ILE   5           HA       ILE   5   4.305  -0.655 -10.306
   41    HB   ILE   5           HB       ILE   5   5.582   0.484  -8.752
   42   HG12  ILE   5          2HG1      ILE   5   4.991  -1.770  -6.828
   43   HG13  ILE   5          3HG1      ILE   5   6.540  -1.374  -7.563
   44   HG21  ILE   5          1HG2      ILE   5   4.035   1.584  -7.519
   45   HG22  ILE   5          2HG2      ILE   5   2.925   0.598  -8.470
   46   HG23  ILE   5          3HG2      ILE   5   3.365   0.103  -6.836
   47   HD11  ILE   5          3HD1      ILE   5   6.651  -0.619  -5.343
   48   HD12  ILE   5          1HD1      ILE   5   6.411   0.823  -6.328
   49   HD13  ILE   5          2HD1      ILE   5   5.057   0.130  -5.435
   50    H    GLY   6           H        GLY   6   4.695  -3.349  -8.065
   51    HA2  GLY   6           2HA      GLY   6   7.334  -4.001  -9.050
   52    HA3  GLY   6           3HA      GLY   6   6.394  -4.924  -7.887
   53    H    ARG   7           H        ARG   7   4.179  -4.594 -10.112
   54    HA   ARG   7           HA       ARG   7   4.950  -7.068 -11.485
   55    HB2  ARG   7           2HB      ARG   7   2.894  -7.524 -10.584
   56    HB3  ARG   7           3HB      ARG   7   2.365  -5.849 -10.670
   57    HG2  ARG   7           2HG      ARG   7   2.752  -7.291 -13.228
   58    HG3  ARG   7           3HG      ARG   7   1.365  -7.738 -12.233
   59    HD2  ARG   7           2HD      ARG   7   1.415  -4.944 -12.232
   60    HD3  ARG   7           3HD      ARG   7   1.763  -5.417 -13.895
   61    HE   ARG   7           HE       ARG   7  -0.478  -6.793 -12.722
   62   HH11  ARG   7          1HH1      ARG   7   0.574  -3.975 -14.475
   63   HH12  ARG   7          2HH1      ARG   7  -0.984  -3.664 -15.167
   64   HH21  ARG   7          1HH2      ARG   7  -2.533  -6.394 -13.628
   65   HH22  ARG   7          2HH2      ARG   7  -2.751  -5.039 -14.684
   66    H    VAL   8           H        VAL   8   4.045  -3.740 -12.034
   67    HA   VAL   8           HA       VAL   8   3.371  -3.677 -14.684
   68    HB   VAL   8           HB       VAL   8   3.489  -1.691 -13.184
   69   HG11  VAL   8          1HG1      VAL   8   6.044  -2.416 -12.706
   70   HG12  VAL   8          2HG1      VAL   8   6.291  -1.154 -13.915
   71   HG13  VAL   8          3HG1      VAL   8   5.413  -0.793 -12.428
   72   HG21  VAL   8          3HG2      VAL   8   5.054  -0.751 -15.464
   73   HG22  VAL   8          1HG2      VAL   8   3.729  -1.828 -15.909
   74   HG23  VAL   8          2HG2      VAL   8   3.402  -0.362 -14.984
   75    H    LEU   9           H        LEU   9   6.523  -4.243 -13.290
   76    HA   LEU   9           HA       LEU   9   8.169  -3.763 -15.472
   77    HB2  LEU   9           2HB      LEU   9   9.790  -5.099 -14.410
   78    HB3  LEU   9           3HB      LEU   9   8.850  -4.350 -13.122
   79    HG   LEU   9           HG       LEU   9   7.534  -6.640 -13.231
   80   HD11  LEU   9          1HD1      LEU   9  10.047  -7.990 -13.629
   81   HD12  LEU   9          2HD1      LEU   9   9.561  -7.118 -15.082
   82   HD13  LEU   9          3HD1      LEU   9   8.473  -8.303 -14.361
   83   HD21  LEU   9          3HD2      LEU   9   8.802  -7.382 -11.375
   84   HD22  LEU   9          1HD2      LEU   9   8.855  -5.620 -11.339
   85   HD23  LEU   9          2HD2      LEU   9  10.245  -6.532 -11.929
   86    H    SER  10           H        SER  10   6.248  -6.616 -14.681
   87    HA   SER  10           HA       SER  10   7.068  -7.855 -17.214
   88    HB2  SER  10           2HB      SER  10   6.547  -8.896 -14.602
   89    HB3  SER  10           3HB      SER  10   5.378  -9.592 -15.724
   90    HG   SER  10           HG       SER  10   8.069  -9.480 -16.486
   91    H    GLY  11           H        GLY  11   4.333  -6.550 -15.485
   92    HA2  GLY  11           2HA      GLY  11   2.291  -7.588 -17.158
   93    HA3  GLY  11           3HA      GLY  11   2.145  -6.196 -16.095
   94    H    ILE  12           H        ILE  12   4.508  -4.960 -17.530
   95    HA   ILE  12           HA       ILE  12   2.929  -3.633 -19.562
   96    HB   ILE  12           HB       ILE  12   4.491  -2.432 -17.967
   97   HG12  ILE  12          2HG1      ILE  12   5.265  -1.807 -20.792
   98   HG13  ILE  12          3HG1      ILE  12   3.578  -1.665 -20.310
   99   HG21  ILE  12          1HG2      ILE  12   6.676  -3.210 -19.864
  100   HG22  ILE  12          2HG2      ILE  12   6.799  -2.470 -18.268
  101   HG23  ILE  12          3HG2      ILE  12   6.337  -4.165 -18.420
  102   HD11  ILE  12          3HD1      ILE  12   3.944   0.236 -19.213
  103   HD12  ILE  12          1HD1      ILE  12   5.420  -0.371 -18.463
  104   HD13  ILE  12          2HD1      ILE  12   5.469   0.291 -20.097
  105    H    LEU  13           H        LEU  13   5.518  -5.954 -19.381
  106    HA   LEU  13           HA       LEU  13   6.666  -5.770 -21.882
  107    HB2  LEU  13           2HB      LEU  13   7.513  -7.266 -20.196
  108    HB3  LEU  13           3HB      LEU  13   6.036  -8.226 -20.254
  109    HG   LEU  13           HG       LEU  13   7.087  -8.232 -22.865
  110   HD11  LEU  13          1HD1      LEU  13   9.176  -8.306 -20.755
  111   HD12  LEU  13          2HD1      LEU  13   9.257  -7.705 -22.411
  112   HD13  LEU  13          3HD1      LEU  13   9.308  -9.440 -22.100
  113   HD21  LEU  13          3HD2      LEU  13   7.567 -10.670 -22.175
  114   HD22  LEU  13          1HD2      LEU  13   5.901 -10.092 -22.133
  115   HD23  LEU  13          2HD2      LEU  13   6.828 -10.220 -20.637
  Start of MODEL   20
    1    H1   PHE   1           H        PHE   1   2.077   0.086   0.761
    2    HA   PHE   1           HA       PHE   1   2.644   1.496  -1.564
    3    HB2  PHE   1           2HB      PHE   1   4.443   0.141  -1.689
    4    HB3  PHE   1           3HB      PHE   1   3.879  -0.499  -0.149
    5    HD1  PHE   1           HD2      PHE   1   2.365  -2.534  -0.185
    6    HD2  PHE   1           HD1      PHE   1   4.581  -1.221  -3.574
    7    HE1  PHE   1           HE2      PHE   1   2.132  -4.764  -1.198
    8    HE2  PHE   1           HE1      PHE   1   4.351  -3.449  -4.592
    9    HZ   PHE   1           HZ       PHE   1   3.126  -5.224  -3.404
   10    H    LEU   2           H        LEU   2   2.816   0.330  -3.785
   11    HA   LEU   2           HA       LEU   2   0.151  -0.758  -4.399
   12    HB2  LEU   2           2HB      LEU   2   1.929   1.159  -5.753
   13    HB3  LEU   2           3HB      LEU   2   1.123  -0.001  -6.806
   14    HG   LEU   2           HG       LEU   2  -0.377   1.730  -4.854
   15   HD11  LEU   2          1HD1      LEU   2  -0.777   2.684  -7.454
   16   HD12  LEU   2          2HD1      LEU   2   0.968   2.522  -7.264
   17   HD13  LEU   2          3HD1      LEU   2   0.045   3.498  -6.122
   18   HD21  LEU   2          3HD2      LEU   2  -2.051   1.236  -6.888
   19   HD22  LEU   2          1HD2      LEU   2  -1.909   0.187  -5.477
   20   HD23  LEU   2          2HD2      LEU   2  -1.058  -0.220  -6.968
   21    HA   PRO   3           HA       PRO   3   2.448  -4.504  -5.257
   22    HB2  PRO   3           2HB      PRO   3   0.256  -6.021  -5.772
   23    HB3  PRO   3           3HB      PRO   3   0.782  -5.616  -4.133
   24    HG2  PRO   3           2HG      PRO   3  -1.363  -4.358  -5.800
   25    HG3  PRO   3           3HG      PRO   3  -1.390  -4.786  -4.080
   26    HD2  PRO   3           2HD      PRO   3  -0.965  -2.256  -4.945
   27    HD3  PRO   3           3HD      PRO   3  -0.227  -2.895  -3.461
   28    H    LEU   4           H        LEU   4   0.862  -2.445  -7.312
   29    HA   LEU   4           HA       LEU   4   0.971  -4.196  -9.643
   30    HB2  LEU   4           2HB      LEU   4   0.127  -1.309  -9.453
   31    HB3  LEU   4           3HB      LEU   4  -0.086  -2.376 -10.841
   32    HG   LEU   4           HG       LEU   4  -1.483  -2.565  -8.174
   33   HD11  LEU   4          1HD1      LEU   4  -3.495  -2.195  -9.564
   34   HD12  LEU   4          2HD1      LEU   4  -2.447  -1.915 -10.954
   35   HD13  LEU   4          3HD1      LEU   4  -2.384  -0.825  -9.569
   36   HD21  LEU   4          3HD2      LEU   4  -2.689  -4.458  -9.122
   37   HD22  LEU   4          1HD2      LEU   4  -0.960  -4.792  -9.039
   38   HD23  LEU   4          2HD2      LEU   4  -1.702  -4.370 -10.582
   39    H    ILE   5           H        ILE   5   2.749  -1.654  -8.116
   40    HA   ILE   5           HA       ILE   5   4.239  -0.788 -10.371
   41    HB   ILE   5           HB       ILE   5   5.502   0.497  -8.922
   42   HG12  ILE   5          2HG1      ILE   5   4.993  -1.623  -6.828
   43   HG13  ILE   5          3HG1      ILE   5   6.523  -1.241  -7.610
   44   HG21  ILE   5          1HG2      ILE   5   3.938   1.644  -7.755
   45   HG22  ILE   5          2HG2      ILE   5   2.846   0.560  -8.616
   46   HG23  ILE   5          3HG2      ILE   5   3.316   0.201  -6.955
   47   HD11  ILE   5          3HD1      ILE   5   6.902  -0.092  -5.729
   48   HD12  ILE   5          1HD1      ILE   5   5.915   1.146  -6.507
   49   HD13  ILE   5          2HD1      ILE   5   5.187   0.042  -5.340
   50    H    GLY   6           H        GLY   6   4.727  -3.298  -7.942
   51    HA2  GLY   6           2HA      GLY   6   7.372  -3.950  -8.910
   52    HA3  GLY   6           3HA      GLY   6   6.471  -4.808  -7.669
   53    H    ARG   7           H        ARG   7   4.224  -4.704  -9.883
   54    HA   ARG   7           HA       ARG   7   5.047  -7.253 -11.078
   55    HB2  ARG   7           2HB      ARG   7   3.014  -7.696 -10.120
   56    HB3  ARG   7           3HB      ARG   7   2.439  -6.046 -10.321
   57    HG2  ARG   7           2HG      ARG   7   2.836  -7.662 -12.772
   58    HG3  ARG   7           3HG      ARG   7   1.473  -8.070 -11.728
   59    HD2  ARG   7           2HD      ARG   7   1.449  -5.283 -11.934
   60    HD3  ARG   7           3HD      ARG   7   1.789  -5.869 -13.561
   61    HE   ARG   7           HE       ARG   7  -0.400  -7.211 -12.259
   62   HH11  ARG   7          1HH1      ARG   7   0.555  -4.505 -14.230
   63   HH12  ARG   7          2HH1      ARG   7  -1.018  -4.286 -14.922
   64   HH21  ARG   7          1HH2      ARG   7  -2.476  -6.933 -13.162
   65   HH22  ARG   7          2HH2      ARG   7  -2.742  -5.667 -14.313
   66    H    VAL   8           H        VAL   8   4.044  -4.001 -11.862
   67    HA   VAL   8           HA       VAL   8   3.340  -4.155 -14.500
   68    HB   VAL   8           HB       VAL   8   3.418  -2.059 -13.155
   69   HG11  VAL   8          1HG1      VAL   8   5.324  -1.055 -12.491
   70   HG12  VAL   8          2HG1      VAL   8   5.997  -2.678 -12.654
   71   HG13  VAL   8          3HG1      VAL   8   6.197  -1.504 -13.955
   72   HG21  VAL   8          3HG2      VAL   8   3.192  -2.154 -15.673
   73   HG22  VAL   8          1HG2      VAL   8   3.760  -0.623 -15.005
   74   HG23  VAL   8          2HG2      VAL   8   4.904  -1.738 -15.753
   75    H    LEU   9           H        LEU   9   6.523  -4.526 -13.109
   76    HA   LEU   9           HA       LEU   9   8.130  -4.168 -15.342
   77    HB2  LEU   9           2HB      LEU   9   9.800  -5.376 -14.205
   78    HB3  LEU   9           3HB      LEU   9   8.853  -4.558 -12.964
   79    HG   LEU   9           HG       LEU   9   7.600  -6.885 -12.884
   80   HD11  LEU   9          1HD1      LEU   9   9.599  -7.451 -14.728
   81   HD12  LEU   9          2HD1      LEU   9   8.580  -8.611 -13.878
   82   HD13  LEU   9          3HD1      LEU   9  10.158  -8.178 -13.222
   83   HD21  LEU   9          3HD2      LEU   9  10.318  -6.527 -11.632
   84   HD22  LEU   9          1HD2      LEU   9   8.973  -7.489 -11.019
   85   HD23  LEU   9          2HD2      LEU   9   8.850  -5.730 -11.063
   86    H    SER  10           H        SER  10   6.298  -7.005 -14.315
   87    HA   SER  10           HA       SER  10   7.125  -8.407 -16.759
   88    HB2  SER  10           2HB      SER  10   5.737 -10.288 -15.439
   89    HB3  SER  10           3HB      SER  10   7.446  -9.980 -15.130
   90    HG   SER  10           HG       SER  10   6.627  -9.833 -13.154
   91    H    GLY  11           H        GLY  11   4.375  -7.048 -15.098
   92    HA2  GLY  11           2HA      GLY  11   2.341  -8.265 -16.655
   93    HA3  GLY  11           3HA      GLY  11   2.173  -6.795 -15.706
   94    H    ILE  12           H        ILE  12   4.512  -5.662 -17.296
   95    HA   ILE  12           HA       ILE  12   2.864  -4.560 -19.420
   96    HB   ILE  12           HB       ILE  12   4.342  -3.147 -17.923
   97   HG12  ILE  12          2HG1      ILE  12   5.318  -1.930 -20.096
   98   HG13  ILE  12          3HG1      ILE  12   4.223  -3.053 -20.896
   99   HG21  ILE  12          1HG2      ILE  12   6.278  -4.886 -18.374
  100   HG22  ILE  12          2HG2      ILE  12   6.621  -3.794 -19.715
  101   HG23  ILE  12          3HG2      ILE  12   6.620  -3.184 -18.060
  102   HD11  ILE  12          3HD1      ILE  12   3.019  -1.649 -18.642
  103   HD12  ILE  12          1HD1      ILE  12   3.553  -0.590 -19.947
  104   HD13  ILE  12          2HD1      ILE  12   2.420  -1.899 -20.282
  105    H    LEU  13           H        LEU  13   5.570  -6.714 -19.021
  106    HA   LEU  13           HA       LEU  13   5.345  -7.607 -21.736
  107    HB2  LEU  13           2HB      LEU  13   7.207  -5.553 -21.152
  108    HB3  LEU  13           3HB      LEU  13   8.120  -7.033 -21.443
  109    HG   LEU  13           HG       LEU  13   6.096  -6.641 -23.469
  110   HD11  LEU  13          1HD1      LEU  13   6.583  -4.247 -22.765
  111   HD12  LEU  13          2HD1      LEU  13   6.810  -4.642 -24.468
  112   HD13  LEU  13          3HD1      LEU  13   8.207  -4.507 -23.401
  113   HD21  LEU  13          3HD2      LEU  13   8.130  -8.110 -23.529
  114   HD22  LEU  13          1HD2      LEU  13   9.098  -6.647 -23.703
  115   HD23  LEU  13          2HD2      LEU  13   7.916  -7.074 -24.940