*HEADER    ANTIMICROBIAL PROTEIN                   11-JUN-14   2MQ2              
*TITLE     CYSTEINE DELETED PROTEGRIN-1 (CDP-1): ANTI-BACTERIAL ACTIVITY, OUTER- 
*TITLE    2 MEMBRANE DISRUPTION AND SELECTIVITY                                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CDP-1 PEPTIDE, CYSTEINE DELETED PROTEGRIN-1;               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    BETA HAIRPIN, ANTIMICROBIAL PROTEIN                                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    H.MOHANRAM, S.BHATTACHARJYA                                           
*REVDAT   1   30-JUL-14 2MQ2    0                                                


1 ARG HA 2 GLY H  2.8 2.0
2 GLY HA 2 GLY H  2.8 2.0
2 GLY HA 3 GLY H  3.0 2.0
3 GLY HA 3 GLY H  3.0 2.0
3 GLY HA 4 ARG H  3.0 2.0
2 GLY HA 4 ARG H  3.1 2.0
4 ARG HA 4 ARG H  2.8 2.0
4 ARG QB 4 ARG H  3.1 2.0
4 ARG QG 4 ARG H  3.3 2.0
4 ARG HA 5 LEU H  3.0 2.0
5 LEU HA 5 LEU H  2.8 2.0
5 LEU QB 5 LEU H  3.1 2.0
5 LEU QQD 5 LEU H  3.4 2.0
5 LEU HA 6 TYR H  3.0 2.0
5 LEU QB 6 TYR H  3.5 2.0
6 TYR HA 6 TYR H  3.0 2.0
6 TYR QB2 6 TYR H  3.2 2.0
6 TYR QB3 6 TYR H  3.3 2.0
6 TYR QB2 6 TYR QD 3.5 2.0
6 TYR QB3 6 TYR QD 3.6 2.0
6 TYR QB2 6 TYR QE 3.9 2.0
6 TYR QB3 6 TYR QE 4.0 2.0
6 TYR HA 7 ARG H  3.2 2.0
6 TYR QB2 7 ARG H  4.2 2.0
6 TYR QB3 7 ARG H  4.1 2.0
7 ARG HA 7 ARG H  2.8 2.0
7 ARG QB 7 ARG H  3.1 2.0
7 ARG QG 7 ARG H  3.3 2.0
7 ARG HA 8 ARG H  3.1 2.0
8 ARG HA 8 ARG H  2.8 2.0
8 ARG QB 8 ARG H  3.1 2.0
8 ARG QG 8 ARG H  3.3 2.0
8 ARG HA 9 ARG H  3.1 2.0
9 ARG HA 9 ARG H  2.8 2.0
9 ARG QB 9 ARG H  3.1 2.0
9 ARG QG 9 ARG H  3.3 2.0
9 ARG HA 10 PHE H 3.2 2.0
10 PHE HA 10 PHE H  3.0 2.0
10 PHE QB2 10 PHE H 3.3 2.0
10 PHE QB3 10 PHE H 3.3 2.0
10 PHE QB2 10 PHE QD 3.5 2.0
10 PHE QB3 10 PHE QD 3.6 2.0
10 PHE QB2 10 PHE QE 4.0 2.0
10 PHE QB3 10 PHE QE 4.0 2.0
10 PHE HA 11 VAL H 3.2 2.0
10 PHE QB2 11 VAL H 3.5 2.0
10 PHE QB3 11 VAL H 3.8 2.0
10 PHE HA 12 VAL H 4.0 2.0
11 VAL HA 11 VAL H 3.0 2.0
11 VAL HB 11 VAL H 3.2 2.0
11 VAL QG21 11 VAL H 4.0 2.0
11 VAL QG11 11 VAL H 3.8 2.0
11 VAL HB 12 VAL H 4.3 2.0
11 VAL HA 12 VAL H 3.3 2.0
12 VAL HA 12 VAL H 3.0 2.0
12 VAL HB 12 VAL H 3.2 2.0
12 VAL QG21 12 VAL H 3.5 2.0
12 VAL QG11 12 VAL H 4.0 2.0
12 VAL HA 13 GLY H 3.1 2.0
12 VAL HB 13 GLY H 3.8 2.0
12 VAL QG21 13 GLY H 4.0 2.0
12 VAL QG11 13 GLY H 4.2 2.0
14 ARG QG 13 GLY H 3.3 2.0
13 GLY HA 13 GLY H 3.1 2.0
13 GLY HA 14 ARG H 3.1 2.0
14 ARG HA 14 ARG H 2.8 2.0
14 ARG QB 14 ARG H 3.1 2.0
14 ARG QG 14 ARG H 3.3 2.0
2 GLY H  3 GLY H  2.8 2.0
3 GLY H  4 ARG H  2.8 2.0
4 ARG H  5 LEU H  2.8 2.0
6 TYR H  7 ARG H  4.0 2.0
7 ARG H  8 ARG H  2.8 2.0
8 ARG H  9 ARG H  3.1 2.0
10 PHE H 11 VAL H 4.0 2.0
11 VAL H 12 VAL H 3.3 2.0
12 VAL H 13 GLY H 3.3 2.0
13 GLY H 14 ARG H 2.8 2.0
14 ARG QD 13 GLY H 3.5 2.0
12 VAL HB 14 ARG H 4.0 2.0
11 VAL QG21 10 PHE QD 4.6 2.0
11 VAL QG11 10 PHE QD 4.7 2.0
11 VAL QG21 10 PHE QE 4.6 2.0
11 VAL QG21 10 PHE QE 4.7 2.0
11 VAL HB 10 PHE QD 3.9 2.0
12 VAL HB 10 PHE QD 4.0 2.0
11 VAL HB 10 PHE QE 4.8 2.0
12 VAL HB 10 PHE QE 4.4 2.0
12 VAL QG11 4 ARG HA 4.5 2.0
12 VAL QG21 4 ARG HA 3.9 2.0
11 VAL HB 5 LEU HA 4.1 2.0
14 ARG QB 3 GLY H  3.8 2.0
14 ARG QG 3 GLY H  4.0 2.0
4  ARG QG 13 GLY HA 3.8 2.0
4 ARG QB 13 GLY HA 3.9 2.0
11 VAL HB 4 ARG HA 3.8 2.0
6 TYR HA 10 PHE H 3.5 2.0
10 PHE QB 6 TYR QD 3.6 2.0
10 PHE QB 6 TYR QE 3.6 2.0
10 PHE HA 6 TYR H  3.5 2.0
10 PHE QD 6 TYR QD 3.8 2.0
10 PHE QD 6 TYR QE 4.0 2.0






  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1           H        ARG   1   1.807   0.001   0.855
    2    HA   ARG   1           HA       ARG   1   2.738   0.866  -1.235
    3    HB2  ARG   1           2HB      ARG   1   2.693  -1.923  -0.523
    4    HB3  ARG   1           3HB      ARG   1   2.748  -1.755  -2.273
    5    HG2  ARG   1           2HG      ARG   1   4.840  -0.905  -2.265
    6    HG3  ARG   1           3HG      ARG   1   4.607  -0.055  -0.736
    7    HD2  ARG   1           2HD      ARG   1   4.551  -2.972  -0.505
    8    HD3  ARG   1           3HD      ARG   1   6.090  -2.327  -1.075
    9    HE   ARG   1           HE       ARG   1   5.115  -0.915   1.203
   10   HH11  ARG   1          1HH1      ARG   1   6.758  -3.813   0.193
   11   HH12  ARG   1          2HH1      ARG   1   7.591  -4.021   1.698
   12   HH21  ARG   1          1HH2      ARG   1   6.206  -1.177   3.188
   13   HH22  ARG   1          2HH2      ARG   1   7.276  -2.522   3.401
   14    H    GLY   2           H        GLY   2   2.723   0.429  -3.662
   15    HA2  GLY   2           2HA      GLY   2  -0.036   0.750  -4.579
   16    HA3  GLY   2           3HA      GLY   2   1.413   1.160  -5.484
   17    H    GLY   3           H        GLY   3   1.306  -1.910  -3.913
   18    HA2  GLY   3           2HA      GLY   3   1.743  -3.339  -6.299
   19    HA3  GLY   3           3HA      GLY   3   1.309  -4.047  -4.750
   20    H    ARG   4           H        ARG   4  -1.162  -2.203  -4.880
   21    HA   ARG   4           HA       ARG   4  -2.769  -4.081  -6.466
   22    HB2  ARG   4           2HB      ARG   4  -4.679  -2.997  -5.114
   23    HB3  ARG   4           3HB      ARG   4  -3.589  -4.096  -4.279
   24    HG2  ARG   4           2HG      ARG   4  -2.859  -2.503  -2.898
   25    HG3  ARG   4           3HG      ARG   4  -2.717  -1.315  -4.196
   26    HD2  ARG   4           2HD      ARG   4  -4.881  -0.578  -3.941
   27    HD3  ARG   4           3HD      ARG   4  -5.429  -2.102  -3.243
   28    HE   ARG   4           HE       ARG   4  -4.315   0.147  -1.842
   29   HH11  ARG   4          1HH1      ARG   4  -4.863  -3.290  -1.766
   30   HH12  ARG   4          2HH1      ARG   4  -4.792  -3.395  -0.038
   31   HH21  ARG   4          1HH2      ARG   4  -4.220   0.022   0.434
   32   HH22  ARG   4          2HH2      ARG   4  -4.428  -1.510   1.212
   33    H    LEU   5           H        LEU   5  -1.332  -1.989  -7.761
   34    HA   LEU   5           HA       LEU   5  -3.591  -0.420  -8.808
   35    HB2  LEU   5           2HB      LEU   5  -0.792   0.652  -8.709
   36    HB3  LEU   5           3HB      LEU   5  -2.297   1.527  -8.980
   37    HG   LEU   5           HG       LEU   5  -1.517   0.277  -6.349
   38   HD11  LEU   5          1HD1      LEU   5  -0.798   2.389  -5.602
   39   HD12  LEU   5          2HD1      LEU   5  -1.430   3.201  -7.034
   40   HD13  LEU   5          3HD1      LEU   5  -0.018   2.152  -7.166
   41   HD21  LEU   5          3HD2      LEU   5  -3.371   2.454  -6.211
   42   HD22  LEU   5          1HD2      LEU   5  -3.569   0.785  -5.676
   43   HD23  LEU   5          2HD2      LEU   5  -3.972   1.233  -7.334
   44    H    TYR   6           H        TYR   6  -3.978  -1.227 -10.765
   45    HA   TYR   6           HA       TYR   6  -2.215  -2.678 -12.351
   46    HB2  TYR   6           2HB      TYR   6  -4.801  -2.353 -12.519
   47    HB3  TYR   6           3HB      TYR   6  -4.387  -1.019 -13.589
   48    HD1  TYR   6           HD1      TYR   6  -3.233  -1.456 -15.727
   49    HD2  TYR   6           HD2      TYR   6  -4.552  -4.631 -13.220
   50    HE1  TYR   6           HE1      TYR   6  -3.000  -3.027 -17.605
   51    HE2  TYR   6           HE2      TYR   6  -4.322  -6.211 -15.090
   52    HH   TYR   6           HH       TYR   6  -2.587  -5.742 -17.692
   53    H    ARG   7           H        ARG   7  -2.388   0.690 -11.810
   54    HA   ARG   7           HA       ARG   7  -1.592   1.928 -14.081
   55    HB2  ARG   7           2HB      ARG   7  -0.948   2.334 -11.213
   56    HB3  ARG   7           3HB      ARG   7   0.058   3.189 -12.375
   57    HG2  ARG   7           2HG      ARG   7  -1.651   4.528 -13.083
   58    HG3  ARG   7           3HG      ARG   7  -2.893   3.338 -12.688
   59    HD2  ARG   7           2HD      ARG   7  -2.391   3.762 -10.267
   60    HD3  ARG   7           3HD      ARG   7  -1.357   5.094 -10.781
   61    HE   ARG   7           HE       ARG   7  -3.233   6.352 -11.078
   62   HH11  ARG   7          1HH1      ARG   7  -4.132   2.989 -11.156
   63   HH12  ARG   7          2HH1      ARG   7  -5.832   3.312 -11.255
   64   HH21  ARG   7          1HH2      ARG   7  -5.467   6.789 -11.208
   65   HH22  ARG   7          2HH2      ARG   7  -6.590   5.474 -11.285
   66    H    ARG   8           H        ARG   8   0.476   0.012 -11.940
   67    HA   ARG   8           HA       ARG   8   2.593   0.137 -13.984
   68    HB2  ARG   8           2HB      ARG   8   2.687  -0.059 -10.996
   69    HB3  ARG   8           3HB      ARG   8   4.014  -0.706 -11.952
   70    HG2  ARG   8           2HG      ARG   8   3.086   2.074 -12.472
   71    HG3  ARG   8           3HG      ARG   8   4.075   1.747 -11.048
   72    HD2  ARG   8           2HD      ARG   8   5.869   0.947 -12.359
   73    HD3  ARG   8           3HD      ARG   8   4.863   0.838 -13.803
   74    HE   ARG   8           HE       ARG   8   5.027   3.509 -12.827
   75   HH11  ARG   8          1HH1      ARG   8   6.747   1.086 -14.641
   76   HH12  ARG   8          2HH1      ARG   8   7.664   2.236 -15.556
   77   HH21  ARG   8          1HH2      ARG   8   6.229   5.033 -14.025
   78   HH22  ARG   8          2HH2      ARG   8   7.370   4.481 -15.204
   79    H    ARG   9           H        ARG   9   0.941  -1.994 -11.685
   80    HA   ARG   9           HA       ARG   9   1.702  -4.273 -13.387
   81    HB2  ARG   9           2HB      ARG   9   1.677  -4.083 -10.381
   82    HB3  ARG   9           3HB      ARG   9   1.595  -5.629 -11.214
   83    HG2  ARG   9           2HG      ARG   9   3.732  -5.128 -12.319
   84    HG3  ARG   9           3HG      ARG   9   3.817  -3.609 -11.424
   85    HD2  ARG   9           2HD      ARG   9   5.080  -4.943 -10.064
   86    HD3  ARG   9           3HD      ARG   9   3.487  -5.201  -9.354
   87    HE   ARG   9           HE       ARG   9   4.047  -7.108 -11.390
   88   HH11  ARG   9          1HH1      ARG   9   4.717  -6.298  -8.071
   89   HH12  ARG   9          2HH1      ARG   9   5.033  -7.935  -7.599
   90   HH21  ARG   9          1HH2      ARG   9   4.460  -9.267 -10.780
   91   HH22  ARG   9          2HH2      ARG   9   4.887  -9.623  -9.141
   92    H    PHE  10           H        PHE  10  -0.135  -4.912 -10.582
   93    HA   PHE  10           HA       PHE  10  -2.680  -4.706 -12.009
   94    HB2  PHE  10           2HB      PHE  10  -1.931  -6.970 -12.473
   95    HB3  PHE  10           3HB      PHE  10  -1.625  -7.252 -10.763
   96    HD1  PHE  10           HD1      PHE  10  -3.708  -6.908  -9.198
   97    HD2  PHE  10           HD2      PHE  10  -3.915  -7.690 -13.377
   98    HE1  PHE  10           HE1      PHE  10  -6.006  -7.743  -8.925
   99    HE2  PHE  10           HE2      PHE  10  -6.214  -8.525 -13.110
  100    HZ   PHE  10           HZ       PHE  10  -7.263  -8.552 -10.882
  101    H    VAL  11           H        VAL  11  -4.516  -4.642 -10.663
  102    HA   VAL  11           HA       VAL  11  -4.024  -3.514  -8.074
  103    HB   VAL  11           HB       VAL  11  -6.567  -3.509  -7.936
  104   HG11  VAL  11          1HG1      VAL  11  -4.760  -1.879  -9.345
  105   HG12  VAL  11          2HG1      VAL  11  -6.200  -2.020 -10.354
  106   HG13  VAL  11          3HG1      VAL  11  -6.338  -1.436  -8.696
  107   HG21  VAL  11          3HG2      VAL  11  -6.429  -4.182 -10.863
  108   HG22  VAL  11          1HG2      VAL  11  -6.749  -5.400  -9.628
  109   HG23  VAL  11          2HG2      VAL  11  -7.855  -4.042  -9.835
  110    H    VAL  12           H        VAL  12  -2.914  -5.830  -7.712
  111    HA   VAL  12           HA       VAL  12  -4.672  -7.927  -6.887
  112    HB   VAL  12           HB       VAL  12  -2.552  -8.837  -5.787
  113   HG11  VAL  12          1HG1      VAL  12  -2.309  -8.254  -8.730
  114   HG12  VAL  12          2HG1      VAL  12  -1.718  -9.664  -7.848
  115   HG13  VAL  12          3HG1      VAL  12  -3.452  -9.422  -8.067
  116   HG21  VAL  12          3HG2      VAL  12  -0.935  -7.030  -7.454
  117   HG22  VAL  12          1HG2      VAL  12  -1.639  -6.301  -6.011
  118   HG23  VAL  12          2HG2      VAL  12  -0.598  -7.716  -5.865
  119    H    GLY  13           H        GLY  13  -2.254  -7.448  -4.572
  120    HA2  GLY  13           2HA      GLY  13  -4.243  -6.388  -2.659
  121    HA3  GLY  13           3HA      GLY  13  -3.115  -7.671  -2.246
  122    H    ARG  14           H        ARG  14  -0.730  -7.004  -2.719
  123    HA   ARG  14           HA       ARG  14   0.029  -5.072  -0.918
  124    HB2  ARG  14           2HB      ARG  14   2.219  -5.026  -2.254
  125    HB3  ARG  14           3HB      ARG  14   1.698  -6.573  -1.599
  126    HG2  ARG  14           2HG      ARG  14   0.658  -6.141  -4.262
  127    HG3  ARG  14           3HG      ARG  14   2.419  -6.032  -4.216
  128    HD2  ARG  14           2HD      ARG  14   2.209  -8.209  -2.775
  129    HD3  ARG  14           3HD      ARG  14   0.636  -8.334  -3.561
  130    HE   ARG  14           HE       ARG  14   2.738  -7.874  -5.434
  131   HH11  ARG  14          1HH1      ARG  14   1.175 -10.323  -3.515
  132   HH12  ARG  14          2HH1      ARG  14   1.618 -11.620  -4.574
  133   HH21  ARG  14          1HH2      ARG  14   3.329  -9.574  -6.835
  134   HH22  ARG  14          2HH2      ARG  14   2.844 -11.194  -6.462
  Start of MODEL    2
    1    H1   ARG   1           H        ARG   1   2.229   1.287   0.317
    2    HA   ARG   1           HA       ARG   1   3.238   0.080  -1.896
    3    HB2  ARG   1           2HB      ARG   1   2.280  -0.833   0.453
    4    HB3  ARG   1           3HB      ARG   1   1.003  -1.388  -0.621
    5    HG2  ARG   1           2HG      ARG   1   2.248  -3.080  -1.319
    6    HG3  ARG   1           3HG      ARG   1   3.568  -1.992  -1.752
    7    HD2  ARG   1           2HD      ARG   1   4.427  -2.059   0.494
    8    HD3  ARG   1           3HD      ARG   1   3.036  -2.994   1.040
    9    HE   ARG   1           HE       ARG   1   4.058  -4.882   0.263
   10   HH11  ARG   1          1HH1      ARG   1   5.547  -2.106  -1.220
   11   HH12  ARG   1          2HH1      ARG   1   6.799  -3.025  -1.988
   12   HH21  ARG   1          1HH2      ARG   1   5.702  -6.102  -0.743
   13   HH22  ARG   1          2HH2      ARG   1   6.886  -5.298  -1.717
   14    H    GLY   2           H        GLY   2   2.641   0.480  -3.939
   15    HA2  GLY   2           2HA      GLY   2  -0.210   0.660  -4.594
   16    HA3  GLY   2           3HA      GLY   2   1.122   1.143  -5.633
   17    H    GLY   3           H        GLY   3   1.358  -1.905  -4.035
   18    HA2  GLY   3           2HA      GLY   3   1.682  -3.347  -6.420
   19    HA3  GLY   3           3HA      GLY   3   1.381  -4.053  -4.839
   20    H    ARG   4           H        ARG   4  -1.180  -2.337  -4.823
   21    HA   ARG   4           HA       ARG   4  -2.791  -4.310  -6.282
   22    HB2  ARG   4           2HB      ARG   4  -4.662  -3.293  -4.827
   23    HB3  ARG   4           3HB      ARG   4  -3.471  -4.327  -4.048
   24    HG2  ARG   4           2HG      ARG   4  -2.730  -2.681  -2.739
   25    HG3  ARG   4           3HG      ARG   4  -2.728  -1.508  -4.058
   26    HD2  ARG   4           2HD      ARG   4  -4.718  -0.679  -3.462
   27    HD3  ARG   4           3HD      ARG   4  -5.409  -2.285  -3.229
   28    HE   ARG   4           HE       ARG   4  -3.676  -1.734  -1.098
   29   HH11  ARG   4          1HH1      ARG   4  -6.728  -0.674  -2.394
   30   HH12  ARG   4          2HH1      ARG   4  -7.362  -0.192  -0.855
   31   HH21  ARG   4          1HH2      ARG   4  -4.499  -1.103   0.934
   32   HH22  ARG   4          2HH2      ARG   4  -6.093  -0.435   1.037
   33    H    LEU   5           H        LEU   5  -1.539  -2.172  -7.693
   34    HA   LEU   5           HA       LEU   5  -3.932  -0.730  -8.616
   35    HB2  LEU   5           2HB      LEU   5  -1.190   0.318  -8.042
   36    HB3  LEU   5           3HB      LEU   5  -2.195   1.092  -9.266
   37    HG   LEU   5           HG       LEU   5  -2.362   2.289  -7.174
   38   HD11  LEU   5          1HD1      LEU   5  -4.928   0.762  -7.483
   39   HD12  LEU   5          2HD1      LEU   5  -4.375   1.925  -8.687
   40   HD13  LEU   5          3HD1      LEU   5  -4.697   2.453  -7.036
   41   HD21  LEU   5          3HD2      LEU   5  -3.734   0.089  -5.762
   42   HD22  LEU   5          1HD2      LEU   5  -2.679   1.359  -5.140
   43   HD23  LEU   5          2HD2      LEU   5  -1.984  -0.058  -5.928
   44    H    TYR   6           H        TYR   6  -4.405  -1.559 -10.542
   45    HA   TYR   6           HA       TYR   6  -2.676  -2.961 -12.216
   46    HB2  TYR   6           2HB      TYR   6  -5.280  -2.766 -12.221
   47    HB3  TYR   6           3HB      TYR   6  -5.002  -1.428 -13.330
   48    HD1  TYR   6           HD2      TYR   6  -3.962  -1.839 -15.532
   49    HD2  TYR   6           HD1      TYR   6  -4.964  -5.038 -12.912
   50    HE1  TYR   6           HE2      TYR   6  -3.773  -3.424 -17.403
   51    HE2  TYR   6           HE1      TYR   6  -4.777  -6.632 -14.775
   52    HH   TYR   6           HH       TYR   6  -3.940  -5.536 -18.052
   53    H    ARG   7           H        ARG   7  -2.962   0.398 -11.695
   54    HA   ARG   7           HA       ARG   7  -2.382   1.644 -14.029
   55    HB2  ARG   7           2HB      ARG   7  -1.944   2.193 -11.243
   56    HB3  ARG   7           3HB      ARG   7  -0.562   2.754 -12.175
   57    HG2  ARG   7           2HG      ARG   7  -2.863   3.559 -13.582
   58    HG3  ARG   7           3HG      ARG   7  -3.139   3.941 -11.881
   59    HD2  ARG   7           2HD      ARG   7  -0.560   4.645 -13.241
   60    HD3  ARG   7           3HD      ARG   7  -1.972   5.694 -13.361
   61    HE   ARG   7           HE       ARG   7  -1.621   5.175 -10.672
   62   HH11  ARG   7          1HH1      ARG   7   0.201   6.650 -13.246
   63   HH12  ARG   7          2HH1      ARG   7   1.045   7.743 -12.198
   64   HH21  ARG   7          1HH2      ARG   7  -0.516   6.608  -9.283
   65   HH22  ARG   7          2HH2      ARG   7   0.637   7.717  -9.944
   66    H    ARG   8           H        ARG   8  -0.085  -0.141 -12.011
   67    HA   ARG   8           HA       ARG   8   1.879   0.047 -14.199
   68    HB2  ARG   8           2HB      ARG   8   2.190  -0.104 -11.221
   69    HB3  ARG   8           3HB      ARG   8   3.479  -0.688 -12.266
   70    HG2  ARG   8           2HG      ARG   8   2.403   2.008 -12.835
   71    HG3  ARG   8           3HG      ARG   8   3.371   1.811 -11.373
   72    HD2  ARG   8           2HD      ARG   8   4.592   0.474 -13.620
   73    HD3  ARG   8           3HD      ARG   8   4.299   2.175 -13.978
   74    HE   ARG   8           HE       ARG   8   5.446   2.091 -11.465
   75   HH11  ARG   8          1HH1      ARG   8   6.314   1.174 -14.709
   76   HH12  ARG   8          2HH1      ARG   8   8.011   1.426 -14.466
   77   HH21  ARG   8          1HH2      ARG   8   7.678   2.425 -11.132
   78   HH22  ARG   8          2HH2      ARG   8   8.786   2.136 -12.430
   79    H    ARG   9           H        ARG   9   0.482  -2.119 -11.769
   80    HA   ARG   9           HA       ARG   9   1.241  -4.389 -13.484
   81    HB2  ARG   9           2HB      ARG   9   1.387  -4.155 -10.484
   82    HB3  ARG   9           3HB      ARG   9   1.340  -5.714 -11.296
   83    HG2  ARG   9           2HG      ARG   9   3.389  -5.195 -12.479
   84    HG3  ARG   9           3HG      ARG   9   3.421  -3.587 -11.752
   85    HD2  ARG   9           2HD      ARG   9   3.405  -4.821  -9.503
   86    HD3  ARG   9           3HD      ARG   9   3.829  -6.254 -10.438
   87    HE   ARG   9           HE       ARG   9   5.669  -4.455 -11.240
   88   HH11  ARG   9          1HH1      ARG   9   4.597  -5.505  -8.099
   89   HH12  ARG   9          2HH1      ARG   9   6.131  -5.232  -7.340
   90   HH21  ARG   9          1HH2      ARG   9   7.692  -4.091 -10.253
   91   HH22  ARG   9          2HH2      ARG   9   7.890  -4.426  -8.566
   92    H    PHE  10           H        PHE  10  -0.384  -5.071 -10.562
   93    HA   PHE  10           HA       PHE  10  -3.021  -5.000 -11.825
   94    HB2  PHE  10           2HB      PHE  10  -2.200  -7.233 -12.315
   95    HB3  PHE  10           3HB      PHE  10  -1.770  -7.479 -10.626
   96    HD1  PHE  10           HD1      PHE  10  -3.759  -7.214  -8.930
   97    HD2  PHE  10           HD2      PHE  10  -4.204  -8.054 -13.079
   98    HE1  PHE  10           HE1      PHE  10  -5.992  -8.150  -8.497
   99    HE2  PHE  10           HE2      PHE  10  -6.439  -8.991 -12.653
  100    HZ   PHE  10           HZ       PHE  10  -7.336  -9.040 -10.360
  101    H    VAL  11           H        VAL  11  -4.769  -5.007 -10.365
  102    HA   VAL  11           HA       VAL  11  -4.168  -3.821  -7.824
  103    HB   VAL  11           HB       VAL  11  -6.693  -3.935  -7.523
  104   HG11  VAL  11          1HG1      VAL  11  -5.062  -2.246  -9.076
  105   HG12  VAL  11          2HG1      VAL  11  -6.566  -2.464  -9.972
  106   HG13  VAL  11          3HG1      VAL  11  -6.605  -1.863  -8.314
  107   HG21  VAL  11          3HG2      VAL  11  -6.711  -4.646 -10.444
  108   HG22  VAL  11          1HG2      VAL  11  -6.894  -5.858  -9.175
  109   HG23  VAL  11          2HG2      VAL  11  -8.073  -4.555  -9.328
  110    H    VAL  12           H        VAL  12  -2.926  -6.076  -7.510
  111    HA   VAL  12           HA       VAL  12  -4.522  -8.245  -6.552
  112    HB   VAL  12           HB       VAL  12  -2.294  -9.034  -5.578
  113   HG11  VAL  12          1HG1      VAL  12  -2.269  -8.482  -8.537
  114   HG12  VAL  12          2HG1      VAL  12  -1.550  -9.846  -7.680
  115   HG13  VAL  12          3HG1      VAL  12  -3.304  -9.697  -7.788
  116   HG21  VAL  12          3HG2      VAL  12  -0.877  -7.174  -7.365
  117   HG22  VAL  12          1HG2      VAL  12  -1.525  -6.460  -5.888
  118   HG23  VAL  12          2HG2      VAL  12  -0.407  -7.820  -5.793
  119    H    GLY  13           H        GLY  13  -1.990  -7.615  -4.400
  120    HA2  GLY  13           2HA      GLY  13  -3.905  -6.627  -2.377
  121    HA3  GLY  13           3HA      GLY  13  -2.692  -7.848  -2.022
  122    H    ARG  14           H        ARG  14  -0.377  -7.074  -2.650
  123    HA   ARG  14           HA       ARG  14   0.397  -5.082  -0.921
  124    HB2  ARG  14           2HB      ARG  14   2.495  -4.949  -2.393
  125    HB3  ARG  14           3HB      ARG  14   2.092  -6.509  -1.688
  126    HG2  ARG  14           2HG      ARG  14   0.864  -6.176  -4.282
  127    HG3  ARG  14           3HG      ARG  14   2.615  -5.967  -4.355
  128    HD2  ARG  14           2HD      ARG  14   2.628  -8.129  -2.879
  129    HD3  ARG  14           3HD      ARG  14   1.015  -8.356  -3.554
  130    HE   ARG  14           HE       ARG  14   1.974  -8.910  -5.555
  131   HH11  ARG  14          1HH1      ARG  14   4.342  -7.312  -3.566
  132   HH12  ARG  14          2HH1      ARG  14   5.656  -7.624  -4.651
  133   HH21  ARG  14          1HH2      ARG  14   3.695  -9.327  -6.992
  134   HH22  ARG  14          2HH2      ARG  14   5.286  -8.770  -6.601
  Start of MODEL    3
    1    H1   ARG   1           H        ARG   1   5.059   1.373  -2.302
    2    HA   ARG   1           HA       ARG   1   4.212  -0.791  -2.290
    3    HB2  ARG   1           2HB      ARG   1   2.463   0.389  -0.156
    4    HB3  ARG   1           3HB      ARG   1   2.046  -1.153  -0.891
    5    HG2  ARG   1           2HG      ARG   1   4.412  -1.888  -0.280
    6    HG3  ARG   1           3HG      ARG   1   4.454  -0.456   0.750
    7    HD2  ARG   1           2HD      ARG   1   2.069  -2.174   1.007
    8    HD3  ARG   1           3HD      ARG   1   3.588  -2.869   1.573
    9    HE   ARG   1           HE       ARG   1   3.374  -0.292   2.623
   10   HH11  ARG   1          1HH1      ARG   1   1.785  -3.380   2.872
   11   HH12  ARG   1          2HH1      ARG   1   1.270  -3.129   4.507
   12   HH21  ARG   1          1HH2      ARG   1   2.701   0.049   4.775
   13   HH22  ARG   1          2HH2      ARG   1   1.790  -1.178   5.588
   14    H    GLY   2           H        GLY   2   3.839   0.032  -4.486
   15    HA2  GLY   2           2HA      GLY   2   1.019   0.679  -5.032
   16    HA3  GLY   2           3HA      GLY   2   2.364   1.009  -6.113
   17    H    GLY   3           H        GLY   3   2.378  -2.060  -4.581
   18    HA2  GLY   3           2HA      GLY   3   2.321  -3.459  -7.032
   19    HA3  GLY   3           3HA      GLY   3   2.191  -4.182  -5.435
   20    H    ARG   4           H        ARG   4  -0.217  -2.254  -5.089
   21    HA   ARG   4           HA       ARG   4  -2.150  -4.103  -6.302
   22    HB2  ARG   4           2HB      ARG   4  -3.731  -2.954  -4.620
   23    HB3  ARG   4           3HB      ARG   4  -2.527  -4.074  -3.997
   24    HG2  ARG   4           2HG      ARG   4  -1.504  -2.488  -2.808
   25    HG3  ARG   4           3HG      ARG   4  -1.585  -1.318  -4.127
   26    HD2  ARG   4           2HD      ARG   4  -2.858  -0.617  -2.127
   27    HD3  ARG   4           3HD      ARG   4  -3.863  -0.773  -3.567
   28    HE   ARG   4           HE       ARG   4  -3.854  -3.166  -2.023
   29   HH11  ARG   4          1HH1      ARG   4  -5.213   0.034  -2.205
   30   HH12  ARG   4          2HH1      ARG   4  -6.653  -0.387  -1.339
   31   HH21  ARG   4          1HH2      ARG   4  -5.746  -3.732  -0.882
   32   HH22  ARG   4          2HH2      ARG   4  -6.955  -2.529  -0.586
   33    H    LEU   5           H        LEU   5  -0.941  -2.065  -7.884
   34    HA   LEU   5           HA       LEU   5  -3.320  -0.444  -8.494
   35    HB2  LEU   5           2HB      LEU   5  -0.526   0.547  -8.952
   36    HB3  LEU   5           3HB      LEU   5  -2.032   1.463  -8.951
   37    HG   LEU   5           HG       LEU   5  -0.797   0.227  -6.492
   38   HD11  LEU   5          1HD1      LEU   5  -0.573   2.996  -7.641
   39   HD12  LEU   5          2HD1      LEU   5   0.725   1.889  -7.196
   40   HD13  LEU   5          3HD1      LEU   5  -0.266   2.633  -5.942
   41   HD21  LEU   5          3HD2      LEU   5  -3.354   1.387  -7.054
   42   HD22  LEU   5          1HD2      LEU   5  -2.481   2.403  -5.906
   43   HD23  LEU   5          2HD2      LEU   5  -2.749   0.697  -5.547
   44    H    TYR   6           H        TYR   6  -4.103  -1.258 -10.325
   45    HA   TYR   6           HA       TYR   6  -2.721  -2.774 -12.203
   46    HB2  TYR   6           2HB      TYR   6  -5.288  -2.345 -11.858
   47    HB3  TYR   6           3HB      TYR   6  -5.038  -1.074 -13.050
   48    HD1  TYR   6           HD1      TYR   6  -4.329  -1.649 -15.344
   49    HD2  TYR   6           HD2      TYR   6  -5.266  -4.657 -12.485
   50    HE1  TYR   6           HE1      TYR   6  -4.519  -3.302 -17.155
   51    HE2  TYR   6           HE2      TYR   6  -5.457  -6.319 -14.288
   52    HH   TYR   6           HH       TYR   6  -6.033  -6.043 -16.991
   53    H    ARG   7           H        ARG   7  -2.700   0.603 -11.689
   54    HA   ARG   7           HA       ARG   7  -2.332   1.797 -14.090
   55    HB2  ARG   7           2HB      ARG   7  -0.810   2.196 -11.520
   56    HB3  ARG   7           3HB      ARG   7  -0.567   3.228 -12.922
   57    HG2  ARG   7           2HG      ARG   7  -3.372   2.959 -12.290
   58    HG3  ARG   7           3HG      ARG   7  -2.446   3.556 -10.911
   59    HD2  ARG   7           2HD      ARG   7  -1.578   5.376 -12.195
   60    HD3  ARG   7           3HD      ARG   7  -2.252   4.715 -13.684
   61    HE   ARG   7           HE       ARG   7  -4.386   5.113 -11.975
   62   HH11  ARG   7          1HH1      ARG   7  -1.926   7.056 -13.490
   63   HH12  ARG   7          2HH1      ARG   7  -2.912   8.479 -13.564
   64   HH21  ARG   7          1HH2      ARG   7  -5.694   6.979 -12.067
   65   HH22  ARG   7          2HH2      ARG   7  -5.055   8.434 -12.754
   66    H    ARG   8           H        ARG   8   0.066  -0.154 -12.365
   67    HA   ARG   8           HA       ARG   8   1.744  -0.109 -14.786
   68    HB2  ARG   8           2HB      ARG   8   3.587  -0.837 -13.196
   69    HB3  ARG   8           3HB      ARG   8   3.009   0.814 -13.013
   70    HG2  ARG   8           2HG      ARG   8   1.632   0.121 -11.115
   71    HG3  ARG   8           3HG      ARG   8   2.223  -1.532 -11.297
   72    HD2  ARG   8           2HD      ARG   8   4.199   0.678 -11.012
   73    HD3  ARG   8           3HD      ARG   8   3.324   0.135  -9.581
   74    HE   ARG   8           HE       ARG   8   4.385  -2.089 -10.948
   75   HH11  ARG   8          1HH1      ARG   8   5.377   0.621  -9.001
   76   HH12  ARG   8          2HH1      ARG   8   6.781  -0.177  -8.373
   77   HH21  ARG   8          1HH2      ARG   8   6.230  -3.150 -10.128
   78   HH22  ARG   8          2HH2      ARG   8   7.266  -2.322  -9.016
   79    H    ARG   9           H        ARG   9   0.520  -2.169 -12.176
   80    HA   ARG   9           HA       ARG   9   0.877  -4.486 -13.958
   81    HB2  ARG   9           2HB      ARG   9   1.429  -4.275 -11.002
   82    HB3  ARG   9           3HB      ARG   9   1.174  -5.822 -11.799
   83    HG2  ARG   9           2HG      ARG   9   3.175  -4.039 -13.029
   84    HG3  ARG   9           3HG      ARG   9   3.585  -4.714 -11.451
   85    HD2  ARG   9           2HD      ARG   9   2.963  -6.971 -12.394
   86    HD3  ARG   9           3HD      ARG   9   2.887  -6.197 -13.976
   87    HE   ARG   9           HE       ARG   9   5.252  -6.885 -12.492
   88   HH11  ARG   9          1HH1      ARG   9   3.911  -4.824 -14.957
   89   HH12  ARG   9          2HH1      ARG   9   5.435  -4.536 -15.729
   90   HH21  ARG   9          1HH2      ARG   9   7.264  -6.513 -13.500
   91   HH22  ARG   9          2HH2      ARG   9   7.341  -5.498 -14.900
   92    H    PHE  10           H        PHE  10  -0.393  -5.046 -10.839
   93    HA   PHE  10           HA       PHE  10  -3.161  -4.783 -11.745
   94    HB2  PHE  10           2HB      PHE  10  -2.574  -7.072 -12.314
   95    HB3  PHE  10           3HB      PHE  10  -1.948  -7.345 -10.691
   96    HD1  PHE  10           HD2      PHE  10  -3.678  -6.929  -8.757
   97    HD2  PHE  10           HD1      PHE  10  -4.713  -7.745 -12.804
   98    HE1  PHE  10           HE2      PHE  10  -5.899  -7.697  -8.030
   99    HE2  PHE  10           HE1      PHE  10  -6.937  -8.513 -12.084
  100    HZ   PHE  10           HZ       PHE  10  -7.532  -8.491  -9.694
  101    H    VAL  11           H        VAL  11  -4.696  -4.656 -10.069
  102    HA   VAL  11           HA       VAL  11  -3.680  -3.516  -7.642
  103    HB   VAL  11           HB       VAL  11  -6.146  -3.440  -7.012
  104   HG11  VAL  11          1HG1      VAL  11  -4.608  -1.874  -8.770
  105   HG12  VAL  11          2HG1      VAL  11  -6.221  -1.984  -9.476
  106   HG13  VAL  11          3HG1      VAL  11  -6.017  -1.381  -7.831
  107   HG21  VAL  11          3HG2      VAL  11  -6.596  -4.147  -9.899
  108   HG22  VAL  11          1HG2      VAL  11  -6.706  -5.341  -8.605
  109   HG23  VAL  11          2HG2      VAL  11  -7.792  -3.952  -8.618
  110    H    VAL  12           H        VAL  12  -2.580  -5.860  -7.470
  111    HA   VAL  12           HA       VAL  12  -4.197  -7.898  -6.286
  112    HB   VAL  12           HB       VAL  12  -1.927  -8.859  -5.610
  113   HG11  VAL  12          1HG1      VAL  12  -2.248  -8.308  -8.551
  114   HG12  VAL  12          2HG1      VAL  12  -1.536  -9.727  -7.782
  115   HG13  VAL  12          3HG1      VAL  12  -3.272  -9.435  -7.663
  116   HG21  VAL  12          3HG2      VAL  12  -0.620  -7.114  -7.585
  117   HG22  VAL  12          1HG2      VAL  12  -1.010  -6.352  -6.043
  118   HG23  VAL  12          2HG2      VAL  12   0.003  -7.795  -6.083
  119    H    GLY  13           H        GLY  13  -1.360  -7.470  -4.496
  120    HA2  GLY  13           2HA      GLY  13  -2.905  -6.333  -2.247
  121    HA3  GLY  13           3HA      GLY  13  -1.755  -7.646  -2.044
  122    H    ARG  14           H        ARG  14   0.509  -7.056  -2.982
  123    HA   ARG  14           HA       ARG  14   1.661  -5.133  -1.394
  124    HB2  ARG  14           2HB      ARG  14   3.547  -5.165  -3.131
  125    HB3  ARG  14           3HB      ARG  14   3.119  -6.691  -2.369
  126    HG2  ARG  14           2HG      ARG  14   1.583  -6.258  -4.774
  127    HG3  ARG  14           3HG      ARG  14   3.318  -6.172  -5.088
  128    HD2  ARG  14           2HD      ARG  14   3.353  -8.337  -3.589
  129    HD3  ARG  14           3HD      ARG  14   1.670  -8.449  -4.101
  130    HE   ARG  14           HE       ARG  14   2.386  -9.056  -6.185
  131   HH11  ARG  14          1HH1      ARG  14   5.043  -7.630  -4.445
  132   HH12  ARG  14          2HH1      ARG  14   6.217  -8.023  -5.656
  133   HH21  ARG  14          1HH2      ARG  14   3.923  -9.579  -7.787
  134   HH22  ARG  14          2HH2      ARG  14   5.579  -9.131  -7.557
  Start of MODEL    4
    1    H1   ARG   1           H        ARG   1   4.980   0.618  -1.198
    2    HA   ARG   1           HA       ARG   1   4.169  -1.489  -2.324
    3    HB2  ARG   1           2HB      ARG   1   2.421  -0.154  -0.256
    4    HB3  ARG   1           3HB      ARG   1   2.212  -1.824  -0.766
    5    HG2  ARG   1           2HG      ARG   1   4.948  -1.226   0.006
    6    HG3  ARG   1           3HG      ARG   1   3.788  -0.940   1.304
    7    HD2  ARG   1           2HD      ARG   1   2.862  -3.281   0.537
    8    HD3  ARG   1           3HD      ARG   1   4.496  -3.472  -0.096
    9    HE   ARG   1           HE       ARG   1   5.261  -3.701   2.048
   10   HH11  ARG   1          1HH1      ARG   1   2.054  -2.348   2.120
   11   HH12  ARG   1          2HH1      ARG   1   1.900  -2.471   3.841
   12   HH21  ARG   1          1HH2      ARG   1   5.070  -3.868   4.315
   13   HH22  ARG   1          2HH2      ARG   1   3.616  -3.335   5.089
   14    H    GLY   2           H        GLY   2   3.743  -0.216  -4.495
   15    HA2  GLY   2           2HA      GLY   2   0.890   0.267  -4.911
   16    HA3  GLY   2           3HA      GLY   2   2.180   0.617  -6.052
   17    H    GLY   3           H        GLY   3   2.232  -2.476  -4.549
   18    HA2  GLY   3           2HA      GLY   3   2.114  -3.858  -6.999
   19    HA3  GLY   3           3HA      GLY   3   1.976  -4.589  -5.407
   20    H    ARG   4           H        ARG   4  -0.391  -2.644  -5.004
   21    HA   ARG   4           HA       ARG   4  -2.364  -4.423  -6.254
   22    HB2  ARG   4           2HB      ARG   4  -3.912  -3.294  -4.526
   23    HB3  ARG   4           3HB      ARG   4  -2.725  -4.456  -3.947
   24    HG2  ARG   4           2HG      ARG   4  -1.657  -2.926  -2.724
   25    HG3  ARG   4           3HG      ARG   4  -1.735  -1.713  -4.003
   26    HD2  ARG   4           2HD      ARG   4  -3.976  -2.453  -2.124
   27    HD3  ARG   4           3HD      ARG   4  -2.973  -1.007  -2.014
   28    HE   ARG   4           HE       ARG   4  -4.143  -1.085  -4.555
   29   HH11  ARG   4          1HH1      ARG   4  -5.056  -0.677  -1.221
   30   HH12  ARG   4          2HH1      ARG   4  -6.433   0.311  -1.583
   31   HH21  ARG   4          1HH2      ARG   4  -5.953   0.214  -5.045
   32   HH22  ARG   4          2HH2      ARG   4  -6.942   0.816  -3.758
   33    H    LEU   5           H        LEU   5  -1.133  -2.361  -7.786
   34    HA   LEU   5           HA       LEU   5  -3.488  -0.683  -8.330
   35    HB2  LEU   5           2HB      LEU   5  -0.682   0.275  -8.783
   36    HB3  LEU   5           3HB      LEU   5  -2.172   1.215  -8.739
   37    HG   LEU   5           HG       LEU   5  -0.913  -0.107  -6.337
   38   HD11  LEU   5          1HD1      LEU   5   0.379   1.799  -7.463
   39   HD12  LEU   5          2HD1      LEU   5   0.030   1.940  -5.740
   40   HD13  LEU   5          3HD1      LEU   5  -0.937   2.835  -6.912
   41   HD21  LEU   5          3HD2      LEU   5  -3.480   0.515  -6.573
   42   HD22  LEU   5          1HD2      LEU   5  -2.868   2.119  -6.171
   43   HD23  LEU   5          2HD2      LEU   5  -2.590   0.769  -5.071
   44    H    TYR   6           H        TYR   6  -4.299  -1.432 -10.177
   45    HA   TYR   6           HA       TYR   6  -2.957  -2.915 -12.109
   46    HB2  TYR   6           2HB      TYR   6  -5.511  -2.468 -11.737
   47    HB3  TYR   6           3HB      TYR   6  -5.255  -1.148 -12.873
   48    HD1  TYR   6           HD2      TYR   6  -4.574  -1.630 -15.197
   49    HD2  TYR   6           HD1      TYR   6  -5.520  -4.750 -12.465
   50    HE1  TYR   6           HE2      TYR   6  -4.801  -3.199 -17.077
   51    HE2  TYR   6           HE1      TYR   6  -5.749  -6.329 -14.337
   52    HH   TYR   6           HH       TYR   6  -4.993  -6.571 -16.643
   53    H    ARG   7           H        ARG   7  -2.874   0.445 -11.498
   54    HA   ARG   7           HA       ARG   7  -2.502   1.701 -13.867
   55    HB2  ARG   7           2HB      ARG   7  -1.694   2.154 -11.165
   56    HB3  ARG   7           3HB      ARG   7  -0.349   2.561 -12.222
   57    HG2  ARG   7           2HG      ARG   7  -2.982   3.586 -13.050
   58    HG3  ARG   7           3HG      ARG   7  -2.314   4.269 -11.567
   59    HD2  ARG   7           2HD      ARG   7  -0.153   4.569 -12.930
   60    HD3  ARG   7           3HD      ARG   7  -1.179   4.317 -14.342
   61    HE   ARG   7           HE       ARG   7  -2.301   6.294 -12.668
   62   HH11  ARG   7          1HH1      ARG   7   0.327   5.776 -14.892
   63   HH12  ARG   7          2HH1      ARG   7   0.432   7.440 -15.360
   64   HH21  ARG   7          1HH2      ARG   7  -2.173   8.489 -13.277
   65   HH22  ARG   7          2HH2      ARG   7  -0.991   8.983 -14.441
   66    H    ARG   8           H        ARG   8  -0.128  -0.341 -12.217
   67    HA   ARG   8           HA       ARG   8   1.535  -0.254 -14.647
   68    HB2  ARG   8           2HB      ARG   8   2.331  -0.842 -11.790
   69    HB3  ARG   8           3HB      ARG   8   3.412  -0.953 -13.173
   70    HG2  ARG   8           2HG      ARG   8   2.693   1.529 -13.561
   71    HG3  ARG   8           3HG      ARG   8   2.268   1.456 -11.850
   72    HD2  ARG   8           2HD      ARG   8   4.715   0.328 -11.786
   73    HD3  ARG   8           3HD      ARG   8   4.912   1.419 -13.156
   74    HE   ARG   8           HE       ARG   8   4.751   2.141 -10.404
   75   HH11  ARG   8          1HH1      ARG   8   3.988   3.212 -13.627
   76   HH12  ARG   8          2HH1      ARG   8   4.041   4.895 -13.221
   77   HH21  ARG   8          1HH2      ARG   8   4.823   4.354  -9.857
   78   HH22  ARG   8          2HH2      ARG   8   4.517   5.544 -11.076
   79    H    ARG   9           H        ARG   9   0.295  -2.369 -12.089
   80    HA   ARG   9           HA       ARG   9   0.597  -4.638 -13.942
   81    HB2  ARG   9           2HB      ARG   9   1.198  -4.507 -10.994
   82    HB3  ARG   9           3HB      ARG   9   0.870  -6.034 -11.804
   83    HG2  ARG   9           2HG      ARG   9   2.823  -5.970 -13.015
   84    HG3  ARG   9           3HG      ARG   9   2.958  -4.214 -12.904
   85    HD2  ARG   9           2HD      ARG   9   3.219  -4.694 -10.347
   86    HD3  ARG   9           3HD      ARG   9   3.671  -6.307 -10.898
   87    HE   ARG   9           HE       ARG   9   5.207  -4.627 -12.398
   88   HH11  ARG   9          1HH1      ARG   9   4.692  -5.092  -8.986
   89   HH12  ARG   9          2HH1      ARG   9   6.291  -4.593  -8.544
   90   HH21  ARG   9          1HH2      ARG   9   7.315  -3.968 -11.828
   91   HH22  ARG   9          2HH2      ARG   9   7.782  -3.953 -10.161
   92    H    PHE  10           H        PHE  10  -0.659  -5.266 -10.830
   93    HA   PHE  10           HA       PHE  10  -3.429  -4.930 -11.706
   94    HB2  PHE  10           2HB      PHE  10  -2.886  -7.211 -12.344
   95    HB3  PHE  10           3HB      PHE  10  -2.253  -7.542 -10.736
   96    HD1  PHE  10           HD2      PHE  10  -3.959  -7.152  -8.776
   97    HD2  PHE  10           HD1      PHE  10  -5.041  -7.832 -12.836
   98    HE1  PHE  10           HE2      PHE  10  -6.188  -7.903  -8.052
   99    HE2  PHE  10           HE1      PHE  10  -7.272  -8.583 -12.119
  100    HZ   PHE  10           HZ       PHE  10  -7.847  -8.620  -9.725
  101    H    VAL  11           H        VAL  11  -4.949  -4.825 -10.014
  102    HA   VAL  11           HA       VAL  11  -3.895  -3.773  -7.564
  103    HB   VAL  11           HB       VAL  11  -6.354  -3.673  -6.911
  104   HG11  VAL  11          1HG1      VAL  11  -4.802  -2.084  -8.637
  105   HG12  VAL  11          2HG1      VAL  11  -6.423  -2.146  -9.333
  106   HG13  VAL  11          3HG1      VAL  11  -6.195  -1.594  -7.673
  107   HG21  VAL  11          3HG2      VAL  11  -6.843  -4.284  -9.814
  108   HG22  VAL  11          1HG2      VAL  11  -6.954  -5.518  -8.559
  109   HG23  VAL  11          2HG2      VAL  11  -8.022  -4.115  -8.512
  110    H    VAL  12           H        VAL  12  -2.834  -6.139  -7.467
  111    HA   VAL  12           HA       VAL  12  -4.476  -8.183  -6.330
  112    HB   VAL  12           HB       VAL  12  -2.218  -9.200  -5.698
  113   HG11  VAL  12          1HG1      VAL  12  -2.552  -8.561  -8.621
  114   HG12  VAL  12          2HG1      VAL  12  -1.856 -10.012  -7.898
  115   HG13  VAL  12          3HG1      VAL  12  -3.586  -9.697  -7.756
  116   HG21  VAL  12          3HG2      VAL  12  -0.896  -7.422  -7.634
  117   HG22  VAL  12          1HG2      VAL  12  -1.262  -6.697  -6.069
  118   HG23  VAL  12          2HG2      VAL  12  -0.274  -8.155  -6.156
  119    H    GLY  13           H        GLY  13  -1.620  -7.851  -4.551
  120    HA2  GLY  13           2HA      GLY  13  -3.131  -6.757  -2.258
  121    HA3  GLY  13           3HA      GLY  13  -1.999  -8.092  -2.102
  122    H    ARG  14           H        ARG  14   0.267  -7.509  -3.042
  123    HA   ARG  14           HA       ARG  14   1.459  -5.650  -1.407
  124    HB2  ARG  14           2HB      ARG  14   3.332  -5.661  -3.159
  125    HB3  ARG  14           3HB      ARG  14   2.887  -7.200  -2.436
  126    HG2  ARG  14           2HG      ARG  14   1.348  -6.665  -4.824
  127    HG3  ARG  14           3HG      ARG  14   3.085  -6.627  -5.136
  128    HD2  ARG  14           2HD      ARG  14   1.857  -8.852  -3.551
  129    HD3  ARG  14           3HD      ARG  14   1.822  -8.877  -5.313
  130    HE   ARG  14           HE       ARG  14   4.448  -8.373  -4.479
  131   HH11  ARG  14          1HH1      ARG  14   2.086 -10.931  -4.436
  132   HH12  ARG  14          2HH1      ARG  14   3.267 -12.198  -4.450
  133   HH21  ARG  14          1HH2      ARG  14   6.012 -10.033  -4.498
  134   HH22  ARG  14          2HH2      ARG  14   5.500 -11.686  -4.484
  Start of MODEL    5
    1    H1   ARG   1           H        ARG   1   1.296   1.305   0.629
    2    HA   ARG   1           HA       ARG   1   2.491   0.821  -1.256
    3    HB2  ARG   1           2HB      ARG   1   1.822  -1.585   0.102
    4    HB3  ARG   1           3HB      ARG   1   1.743  -1.912  -1.624
    5    HG2  ARG   1           2HG      ARG   1   4.094  -0.790  -0.116
    6    HG3  ARG   1           3HG      ARG   1   3.945  -2.414  -0.792
    7    HD2  ARG   1           2HD      ARG   1   3.483  -1.016  -3.008
    8    HD3  ARG   1           3HD      ARG   1   4.453   0.177  -2.145
    9    HE   ARG   1           HE       ARG   1   6.295  -1.100  -2.560
   10   HH11  ARG   1          1HH1      ARG   1   3.459  -3.090  -2.906
   11   HH12  ARG   1          2HH1      ARG   1   4.337  -4.469  -3.480
   12   HH21  ARG   1          1HH2      ARG   1   7.462  -2.909  -3.315
   13   HH22  ARG   1          2HH2      ARG   1   6.614  -4.365  -3.711
   14    H    GLY   2           H        GLY   2   2.396   0.577  -3.506
   15    HA2  GLY   2           2HA      GLY   2  -0.312   0.791  -4.584
   16    HA3  GLY   2           3HA      GLY   2   1.174   1.220  -5.418
   17    H    GLY   3           H        GLY   3   1.156  -1.807  -3.798
   18    HA2  GLY   3           2HA      GLY   3   1.698  -3.262  -6.146
   19    HA3  GLY   3           3HA      GLY   3   1.277  -3.958  -4.588
   20    H    ARG   4           H        ARG   4  -1.280  -2.233  -4.805
   21    HA   ARG   4           HA       ARG   4  -2.768  -4.226  -6.366
   22    HB2  ARG   4           2HB      ARG   4  -4.749  -3.203  -5.066
   23    HB3  ARG   4           3HB      ARG   4  -3.625  -4.237  -4.195
   24    HG2  ARG   4           2HG      ARG   4  -2.978  -2.587  -2.838
   25    HG3  ARG   4           3HG      ARG   4  -2.886  -1.415  -4.154
   26    HD2  ARG   4           2HD      ARG   4  -5.220  -0.980  -4.039
   27    HD3  ARG   4           3HD      ARG   4  -5.485  -2.348  -2.958
   28    HE   ARG   4           HE       ARG   4  -4.690   0.284  -2.218
   29   HH11  ARG   4          1HH1      ARG   4  -4.342  -3.077  -1.377
   30   HH12  ARG   4          2HH1      ARG   4  -4.015  -2.759   0.294
   31   HH21  ARG   4          1HH2      ARG   4  -4.261   0.715  -0.020
   32   HH22  ARG   4          2HH2      ARG   4  -3.970  -0.602   1.066
   33    H    LEU   5           H        LEU   5  -1.418  -2.100  -7.692
   34    HA   LEU   5           HA       LEU   5  -3.734  -0.664  -8.803
   35    HB2  LEU   5           2HB      LEU   5  -0.996   0.549  -8.715
   36    HB3  LEU   5           3HB      LEU   5  -2.547   1.341  -8.987
   37    HG   LEU   5           HG       LEU   5  -1.707   0.160  -6.343
   38   HD11  LEU   5          1HD1      LEU   5  -0.198   1.977  -6.979
   39   HD12  LEU   5          2HD1      LEU   5  -1.241   2.440  -5.635
   40   HD13  LEU   5          3HD1      LEU   5  -1.585   3.030  -7.261
   41   HD21  LEU   5          3HD2      LEU   5  -3.813   0.535  -5.758
   42   HD22  LEU   5          1HD2      LEU   5  -4.176   1.148  -7.371
   43   HD23  LEU   5          2HD2      LEU   5  -3.598   2.248  -6.119
   44    H    TYR   6           H        TYR   6  -4.056  -1.541 -10.742
   45    HA   TYR   6           HA       TYR   6  -2.202  -2.938 -12.272
   46    HB2  TYR   6           2HB      TYR   6  -4.802  -2.742 -12.473
   47    HB3  TYR   6           3HB      TYR   6  -4.436  -1.425 -13.582
   48    HD1  TYR   6           HD1      TYR   6  -3.235  -1.877 -15.690
   49    HD2  TYR   6           HD2      TYR   6  -4.436  -5.027 -13.095
   50    HE1  TYR   6           HE1      TYR   6  -2.904  -3.496 -17.512
   51    HE2  TYR   6           HE2      TYR   6  -4.107  -6.655 -14.910
   52    HH   TYR   6           HH       TYR   6  -2.741  -5.695 -18.014
   53    H    ARG   7           H        ARG   7  -2.558   0.430 -11.819
   54    HA   ARG   7           HA       ARG   7  -1.797   1.650 -14.113
   55    HB2  ARG   7           2HB      ARG   7  -1.381   2.186 -11.260
   56    HB3  ARG   7           3HB      ARG   7  -0.183   2.942 -12.302
   57    HG2  ARG   7           2HG      ARG   7  -1.973   4.006 -13.585
   58    HG3  ARG   7           3HG      ARG   7  -3.169   3.255 -12.526
   59    HD2  ARG   7           2HD      ARG   7  -2.072   4.423 -10.604
   60    HD3  ARG   7           3HD      ARG   7  -1.073   5.285 -11.773
   61    HE   ARG   7           HE       ARG   7  -3.872   5.533 -12.315
   62   HH11  ARG   7          1HH1      ARG   7  -1.240   6.772 -10.401
   63   HH12  ARG   7          2HH1      ARG   7  -1.968   8.327 -10.171
   64   HH21  ARG   7          1HH2      ARG   7  -4.840   7.577 -12.018
   65   HH22  ARG   7          2HH2      ARG   7  -4.016   8.784 -11.090
   66    H    ARG   8           H        ARG   8   0.338  -0.096 -11.893
   67    HA   ARG   8           HA       ARG   8   2.476   0.087 -13.913
   68    HB2  ARG   8           2HB      ARG   8   2.522   0.031 -10.926
   69    HB3  ARG   8           3HB      ARG   8   3.881  -0.655 -11.805
   70    HG2  ARG   8           2HG      ARG   8   4.342   1.434 -12.865
   71    HG3  ARG   8           3HG      ARG   8   2.860   2.143 -12.220
   72    HD2  ARG   8           2HD      ARG   8   3.720   1.943  -9.959
   73    HD3  ARG   8           3HD      ARG   8   5.176   1.152 -10.562
   74    HE   ARG   8           HE       ARG   8   4.620   3.963 -10.542
   75   HH11  ARG   8          1HH1      ARG   8   6.382   1.426 -12.149
   76   HH12  ARG   8          2HH1      ARG   8   7.609   2.487 -12.758
   77   HH21  ARG   8          1HH2      ARG   8   6.230   5.369 -11.338
   78   HH22  ARG   8          2HH2      ARG   8   7.523   4.729 -12.295
   79    H    ARG   9           H        ARG   9   0.902  -2.066 -11.580
   80    HA   ARG   9           HA       ARG   9   1.812  -4.346 -13.206
   81    HB2  ARG   9           2HB      ARG   9   1.695  -4.103 -10.203
   82    HB3  ARG   9           3HB      ARG   9   1.772  -5.657 -11.022
   83    HG2  ARG   9           2HG      ARG   9   3.812  -3.766 -11.906
   84    HG3  ARG   9           3HG      ARG   9   3.918  -4.190 -10.196
   85    HD2  ARG   9           2HD      ARG   9   3.832  -6.124 -12.509
   86    HD3  ARG   9           3HD      ARG   9   5.258  -5.702 -11.562
   87    HE   ARG   9           HE       ARG   9   3.490  -6.609  -9.709
   88   HH11  ARG   9          1HH1      ARG   9   4.780  -7.902 -12.672
   89   HH12  ARG   9          2HH1      ARG   9   4.670  -9.551 -12.153
   90   HH21  ARG   9          1HH2      ARG   9   3.340  -8.776  -9.014
   91   HH22  ARG   9          2HH2      ARG   9   3.850 -10.047 -10.072
   92    H    PHE  10           H        PHE  10  -0.035  -5.010 -10.414
   93    HA   PHE  10           HA       PHE  10  -2.564  -4.976 -11.883
   94    HB2  PHE  10           2HB      PHE  10  -1.684  -7.207 -12.278
   95    HB3  PHE  10           3HB      PHE  10  -1.399  -7.431 -10.555
   96    HD1  PHE  10           HD1      PHE  10  -3.529  -7.158  -9.040
   97    HD2  PHE  10           HD2      PHE  10  -3.608  -8.056 -13.200
   98    HE1  PHE  10           HE1      PHE  10  -5.785  -8.106  -8.789
   99    HE2  PHE  10           HE2      PHE  10  -5.865  -9.004 -12.956
  100    HZ   PHE  10           HZ       PHE  10  -6.957  -9.030 -10.748
  101    H    VAL  11           H        VAL  11  -4.420  -4.970 -10.568
  102    HA   VAL  11           HA       VAL  11  -4.028  -3.761  -7.997
  103    HB   VAL  11           HB       VAL  11  -6.571  -3.880  -7.902
  104   HG11  VAL  11          1HG1      VAL  11  -4.820  -2.189  -9.309
  105   HG12  VAL  11          2HG1      VAL  11  -6.231  -2.422 -10.343
  106   HG13  VAL  11          3HG1      VAL  11  -6.432  -1.813  -8.700
  107   HG21  VAL  11          3HG2      VAL  11  -6.196  -5.683  -9.992
  108   HG22  VAL  11          1HG2      VAL  11  -7.726  -5.006  -9.435
  109   HG23  VAL  11          2HG2      VAL  11  -6.848  -4.233 -10.755
  110    H    VAL  12           H        VAL  12  -2.814  -6.013  -7.566
  111    HA   VAL  12           HA       VAL  12  -4.483  -8.173  -6.720
  112    HB   VAL  12           HB       VAL  12  -2.340  -8.957  -5.569
  113   HG11  VAL  12          1HG1      VAL  12  -2.074  -8.426  -8.520
  114   HG12  VAL  12          2HG1      VAL  12  -1.438  -9.790  -7.597
  115   HG13  VAL  12          3HG1      VAL  12  -3.177  -9.629  -7.852
  116   HG21  VAL  12          3HG2      VAL  12  -0.783  -7.113  -7.251
  117   HG22  VAL  12          1HG2      VAL  12  -1.546  -6.385  -5.838
  118   HG23  VAL  12          2HG2      VAL  12  -0.441  -7.746  -5.641
  119    H    GLY  13           H        GLY  13  -2.127  -7.528  -4.382
  120    HA2  GLY  13           2HA      GLY  13  -4.193  -6.523  -2.522
  121    HA3  GLY  13           3HA      GLY  13  -3.012  -7.741  -2.064
  122    H    ARG  14           H        ARG  14  -0.654  -6.969  -2.522
  123    HA   ARG  14           HA       ARG  14  -0.016  -4.964  -0.753
  124    HB2  ARG  14           2HB      ARG  14   2.189  -4.842  -2.056
  125    HB3  ARG  14           3HB      ARG  14   1.732  -6.399  -1.377
  126    HG2  ARG  14           2HG      ARG  14   0.734  -6.034  -4.079
  127    HG3  ARG  14           3HG      ARG  14   2.492  -5.909  -3.977
  128    HD2  ARG  14           2HD      ARG  14   1.114  -8.141  -2.560
  129    HD3  ARG  14           3HD      ARG  14   1.314  -8.235  -4.310
  130    HE   ARG  14           HE       ARG  14   3.787  -7.571  -3.234
  131   HH11  ARG  14          1HH1      ARG  14   1.533 -10.222  -3.125
  132   HH12  ARG  14          2HH1      ARG  14   2.755 -11.422  -2.867
  133   HH21  ARG  14          1HH2      ARG  14   5.406  -9.142  -2.894
  134   HH22  ARG  14          2HH2      ARG  14   4.958 -10.807  -2.734
  Start of MODEL    6
    1    H1   ARG   1           H        ARG   1   3.960   1.601  -1.129
    2    HA   ARG   1           HA       ARG   1   3.798  -1.173  -1.938
    3    HB2  ARG   1           2HB      ARG   1   2.158   0.489  -0.022
    4    HB3  ARG   1           3HB      ARG   1   1.853  -1.213  -0.341
    5    HG2  ARG   1           2HG      ARG   1   3.800  -1.894   0.710
    6    HG3  ARG   1           3HG      ARG   1   4.556  -0.306   0.556
    7    HD2  ARG   1           2HD      ARG   1   2.766   0.548   2.128
    8    HD3  ARG   1           3HD      ARG   1   2.349  -1.140   2.423
    9    HE   ARG   1           HE       ARG   1   5.100  -0.822   2.828
   10   HH11  ARG   1          1HH1      ARG   1   2.075   0.154   4.249
   11   HH12  ARG   1          2HH1      ARG   1   2.717   0.272   5.854
   12   HH21  ARG   1          1HH2      ARG   1   5.957  -0.671   4.937
   13   HH22  ARG   1          2HH2      ARG   1   4.926  -0.196   6.244
   14    H    GLY   2           H        GLY   2   3.438  -0.155  -4.232
   15    HA2  GLY   2           2HA      GLY   2   0.563   0.336  -4.650
   16    HA3  GLY   2           3HA      GLY   2   1.842   0.783  -5.770
   17    H    GLY   3           H        GLY   3   1.971  -2.334  -4.279
   18    HA2  GLY   3           2HA      GLY   3   2.042  -3.699  -6.739
   19    HA3  GLY   3           3HA      GLY   3   1.832  -4.448  -5.163
   20    H    ARG   4           H        ARG   4  -0.618  -2.589  -4.886
   21    HA   ARG   4           HA       ARG   4  -2.452  -4.415  -6.275
   22    HB2  ARG   4           2HB      ARG   4  -4.136  -3.363  -4.626
   23    HB3  ARG   4           3HB      ARG   4  -2.950  -4.499  -3.997
   24    HG2  ARG   4           2HG      ARG   4  -1.998  -2.961  -2.689
   25    HG3  ARG   4           3HG      ARG   4  -2.049  -1.725  -3.948
   26    HD2  ARG   4           2HD      ARG   4  -3.932  -0.829  -3.139
   27    HD3  ARG   4           3HD      ARG   4  -4.684  -2.408  -2.912
   28    HE   ARG   4           HE       ARG   4  -4.087  -2.323  -0.710
   29   HH11  ARG   4          1HH1      ARG   4  -2.167  -0.023  -2.483
   30   HH12  ARG   4          2HH1      ARG   4  -1.441   0.660  -1.066
   31   HH21  ARG   4          1HH2      ARG   4  -3.139  -1.431   1.163
   32   HH22  ARG   4          2HH2      ARG   4  -1.994  -0.142   1.008
   33    H    LEU   5           H        LEU   5  -1.206  -2.291  -7.704
   34    HA   LEU   5           HA       LEU   5  -3.580  -0.680  -8.359
   35    HB2  LEU   5           2HB      LEU   5  -0.789   0.376  -8.645
   36    HB3  LEU   5           3HB      LEU   5  -2.310   1.265  -8.659
   37    HG   LEU   5           HG       LEU   5  -1.154  -0.072  -6.215
   38   HD11  LEU   5          1HD1      LEU   5   0.287   1.752  -7.068
   39   HD12  LEU   5          2HD1      LEU   5  -0.433   2.106  -5.498
   40   HD13  LEU   5          3HD1      LEU   5  -1.090   2.849  -6.956
   41   HD21  LEU   5          3HD2      LEU   5  -3.352   0.168  -5.677
   42   HD22  LEU   5          1HD2      LEU   5  -3.599   1.500  -6.806
   43   HD23  LEU   5          2HD2      LEU   5  -2.791   1.789  -5.265
   44    H    TYR   6           H        TYR   6  -4.259  -1.432 -10.257
   45    HA   TYR   6           HA       TYR   6  -2.759  -2.837 -12.130
   46    HB2  TYR   6           2HB      TYR   6  -5.339  -2.508 -11.901
   47    HB3  TYR   6           3HB      TYR   6  -5.083  -1.141 -12.980
   48    HD1  TYR   6           HD2      TYR   6  -4.261  -1.515 -15.278
   49    HD2  TYR   6           HD1      TYR   6  -5.206  -4.764 -12.698
   50    HE1  TYR   6           HE2      TYR   6  -4.319  -3.029 -17.215
   51    HE2  TYR   6           HE1      TYR   6  -5.266  -6.287 -14.628
   52    HH   TYR   6           HH       TYR   6  -5.550  -5.350 -17.702
   53    H    ARG   7           H        ARG   7  -2.836   0.514 -11.472
   54    HA   ARG   7           HA       ARG   7  -2.380   1.816 -13.801
   55    HB2  ARG   7           2HB      ARG   7  -1.742   2.261 -11.051
   56    HB3  ARG   7           3HB      ARG   7  -0.360   2.737 -12.028
   57    HG2  ARG   7           2HG      ARG   7  -3.027   3.662 -12.917
   58    HG3  ARG   7           3HG      ARG   7  -2.354   4.394 -11.459
   59    HD2  ARG   7           2HD      ARG   7  -1.227   5.760 -12.812
   60    HD3  ARG   7           3HD      ARG   7  -0.230   4.367 -13.230
   61    HE   ARG   7           HE       ARG   7  -2.417   4.223 -14.885
   62   HH11  ARG   7          1HH1      ARG   7   0.097   6.544 -14.243
   63   HH12  ARG   7          2HH1      ARG   7   0.089   7.192 -15.850
   64   HH21  ARG   7          1HH2      ARG   7  -2.436   5.067 -17.004
   65   HH22  ARG   7          2HH2      ARG   7  -1.352   6.351 -17.419
   66    H    ARG   8           H        ARG   8  -0.026  -0.156 -12.041
   67    HA   ARG   8           HA       ARG   8   1.769   0.027 -14.370
   68    HB2  ARG   8           2HB      ARG   8   3.537  -0.751 -12.703
   69    HB3  ARG   8           3HB      ARG   8   2.944   0.894 -12.521
   70    HG2  ARG   8           2HG      ARG   8   1.442   0.132 -10.729
   71    HG3  ARG   8           3HG      ARG   8   2.110  -1.494 -10.889
   72    HD2  ARG   8           2HD      ARG   8   3.128  -0.229  -9.035
   73    HD3  ARG   8           3HD      ARG   8   4.303  -0.693 -10.264
   74    HE   ARG   8           HE       ARG   8   3.331   1.888 -10.822
   75   HH11  ARG   8          1HH1      ARG   8   5.357   0.198  -8.552
   76   HH12  ARG   8          2HH1      ARG   8   6.342   1.579  -8.203
   77   HH21  ARG   8          1HH2      ARG   8   4.621   3.714 -10.372
   78   HH22  ARG   8          2HH2      ARG   8   5.922   3.579  -9.238
   79    H    ARG   9           H        ARG   9   0.462  -2.166 -11.913
   80    HA   ARG   9           HA       ARG   9   0.962  -4.398 -13.768
   81    HB2  ARG   9           2HB      ARG   9   1.344  -4.312 -10.778
   82    HB3  ARG   9           3HB      ARG   9   1.192  -5.822 -11.666
   83    HG2  ARG   9           2HG      ARG   9   3.265  -3.755 -12.335
   84    HG3  ARG   9           3HG      ARG   9   3.537  -5.041 -11.157
   85    HD2  ARG   9           2HD      ARG   9   4.144  -6.359 -12.841
   86    HD3  ARG   9           3HD      ARG   9   2.475  -6.308 -13.409
   87    HE   ARG   9           HE       ARG   9   4.041  -4.066 -14.276
   88   HH11  ARG   9          1HH1      ARG   9   3.167  -7.366 -14.955
   89   HH12  ARG   9          2HH1      ARG   9   3.509  -7.246 -16.649
   90   HH21  ARG   9          1HH2      ARG   9   4.495  -3.895 -16.505
   91   HH22  ARG   9          2HH2      ARG   9   4.266  -5.271 -17.529
   92    H    PHE  10           H        PHE  10  -0.451  -5.117 -10.745
   93    HA   PHE  10           HA       PHE  10  -3.175  -4.872 -11.781
   94    HB2  PHE  10           2HB      PHE  10  -2.505  -7.122 -12.415
   95    HB3  PHE  10           3HB      PHE  10  -1.962  -7.453 -10.773
   96    HD1  PHE  10           HD1      PHE  10  -3.801  -7.153  -8.921
   97    HD2  PHE  10           HD2      PHE  10  -4.599  -7.818 -13.048
   98    HE1  PHE  10           HE1      PHE  10  -6.041  -7.997  -8.348
   99    HE2  PHE  10           HE2      PHE  10  -6.840  -8.661 -12.483
  100    HZ   PHE  10           HZ       PHE  10  -7.564  -8.750 -10.130
  101    H    VAL  11           H        VAL  11  -4.794  -4.843 -10.183
  102    HA   VAL  11           HA       VAL  11  -3.925  -3.797  -7.658
  103    HB   VAL  11           HB       VAL  11  -6.423  -3.790  -7.156
  104   HG11  VAL  11          1HG1      VAL  11  -4.822  -2.118  -8.752
  105   HG12  VAL  11          2HG1      VAL  11  -6.392  -2.221  -9.552
  106   HG13  VAL  11          3HG1      VAL  11  -6.290  -1.693  -7.872
  107   HG21  VAL  11          3HG2      VAL  11  -6.494  -5.493  -9.360
  108   HG22  VAL  11          1HG2      VAL  11  -7.873  -4.772  -8.530
  109   HG23  VAL  11          2HG2      VAL  11  -7.175  -3.973  -9.938
  110    H    VAL  12           H        VAL  12  -2.794  -6.128  -7.532
  111    HA   VAL  12           HA       VAL  12  -4.432  -8.243  -6.525
  112    HB   VAL  12           HB       VAL  12  -2.183  -9.195  -5.773
  113   HG11  VAL  12          1HG1      VAL  12  -2.360  -8.522  -8.701
  114   HG12  VAL  12          2HG1      VAL  12  -1.665  -9.963  -7.956
  115   HG13  VAL  12          3HG1      VAL  12  -3.410  -9.702  -7.916
  116   HG21  VAL  12          3HG2      VAL  12  -0.251  -8.081  -6.099
  117   HG22  VAL  12          1HG2      VAL  12  -0.810  -7.344  -7.601
  118   HG23  VAL  12          2HG2      VAL  12  -1.290  -6.656  -6.050
  119    H    GLY  13           H        GLY  13  -1.699  -7.845  -4.573
  120    HA2  GLY  13           2HA      GLY  13  -3.382  -6.840  -2.359
  121    HA3  GLY  13           3HA      GLY  13  -2.215  -8.138  -2.154
  122    H    ARG  14           H        ARG  14   0.080  -7.461  -2.951
  123    HA   ARG  14           HA       ARG  14   1.106  -5.589  -1.220
  124    HB2  ARG  14           2HB      ARG  14   3.080  -5.508  -2.857
  125    HB3  ARG  14           3HB      ARG  14   2.648  -7.073  -2.181
  126    HG2  ARG  14           2HG      ARG  14   1.244  -6.541  -4.657
  127    HG3  ARG  14           3HG      ARG  14   2.996  -6.466  -4.853
  128    HD2  ARG  14           2HD      ARG  14   2.865  -8.686  -3.403
  129    HD3  ARG  14           3HD      ARG  14   1.254  -8.756  -4.117
  130    HE   ARG  14           HE       ARG  14   2.874  -8.296  -6.243
  131   HH11  ARG  14          1HH1      ARG  14   2.848 -10.671  -3.697
  132   HH12  ARG  14          2HH1      ARG  14   3.570 -11.911  -4.669
  133   HH21  ARG  14          1HH2      ARG  14   3.826  -9.920  -7.532
  134   HH22  ARG  14          2HH2      ARG  14   4.127 -11.482  -6.849
  Start of MODEL    7
    1    H1   ARG   1           H        ARG   1   3.357   2.516  -0.743
    2    HA   ARG   1           HA       ARG   1   3.810   0.228  -2.284
    3    HB2  ARG   1           2HB      ARG   1   2.275   0.906   0.130
    4    HB3  ARG   1           3HB      ARG   1   1.644  -0.468  -0.767
    5    HG2  ARG   1           2HG      ARG   1   4.553  -0.328  -0.113
    6    HG3  ARG   1           3HG      ARG   1   3.390  -0.841   1.111
    7    HD2  ARG   1           2HD      ARG   1   2.539  -2.509  -0.592
    8    HD3  ARG   1           3HD      ARG   1   3.958  -2.107  -1.559
    9    HE   ARG   1           HE       ARG   1   3.880  -3.718   0.818
   10   HH11  ARG   1          1HH1      ARG   1   5.865  -1.691  -1.199
   11   HH12  ARG   1          2HH1      ARG   1   7.353  -2.416  -0.687
   12   HH21  ARG   1          1HH2      ARG   1   5.832  -4.681   1.500
   13   HH22  ARG   1          2HH2      ARG   1   7.333  -4.117   0.847
   14    H    GLY   2           H        GLY   2   3.136   0.510  -4.406
   15    HA2  GLY   2           2HA      GLY   2   0.225   0.806  -4.804
   16    HA3  GLY   2           3HA      GLY   2   1.444   1.248  -5.992
   17    H    GLY   3           H        GLY   3   1.492  -1.717  -4.102
   18    HA2  GLY   3           2HA      GLY   3   1.854  -3.333  -6.401
   19    HA3  GLY   3           3HA      GLY   3   1.530  -3.914  -4.774
   20    H    ARG   4           H        ARG   4  -0.971  -2.113  -4.890
   21    HA   ARG   4           HA       ARG   4  -2.648  -4.127  -6.215
   22    HB2  ARG   4           2HB      ARG   4  -4.482  -2.961  -4.826
   23    HB3  ARG   4           3HB      ARG   4  -3.325  -3.985  -3.986
   24    HG2  ARG   4           2HG      ARG   4  -2.524  -2.286  -2.781
   25    HG3  ARG   4           3HG      ARG   4  -2.492  -1.196  -4.168
   26    HD2  ARG   4           2HD      ARG   4  -4.035  -0.310  -2.577
   27    HD3  ARG   4           3HD      ARG   4  -4.964  -0.947  -3.934
   28    HE   ARG   4           HE       ARG   4  -4.706  -2.922  -1.936
   29   HH11  ARG   4          1HH1      ARG   4  -6.345   0.078  -2.597
   30   HH12  ARG   4          2HH1      ARG   4  -7.702  -0.289  -1.584
   31   HH21  ARG   4          1HH2      ARG   4  -6.487  -3.416  -0.599
   32   HH22  ARG   4          2HH2      ARG   4  -7.781  -2.277  -0.448
   33    H    LEU   5           H        LEU   5  -1.336  -2.133  -7.765
   34    HA   LEU   5           HA       LEU   5  -3.682  -0.669  -8.771
   35    HB2  LEU   5           2HB      LEU   5  -0.869   0.322  -8.405
   36    HB3  LEU   5           3HB      LEU   5  -2.006   1.101  -9.504
   37    HG   LEU   5           HG       LEU   5  -3.525   1.381  -7.477
   38   HD11  LEU   5          1HD1      LEU   5  -1.546   1.541  -5.508
   39   HD12  LEU   5          2HD1      LEU   5  -1.336  -0.034  -6.272
   40   HD13  LEU   5          3HD1      LEU   5  -2.898   0.410  -5.585
   41   HD21  LEU   5          3HD2      LEU   5  -2.656   3.376  -8.162
   42   HD22  LEU   5          1HD2      LEU   5  -0.987   2.818  -8.041
   43   HD23  LEU   5          2HD2      LEU   5  -1.880   3.250  -6.583
   44    H    TYR   6           H        TYR   6  -4.193  -1.629 -10.627
   45    HA   TYR   6           HA       TYR   6  -2.516  -3.182 -12.216
   46    HB2  TYR   6           2HB      TYR   6  -5.129  -2.860 -12.211
   47    HB3  TYR   6           3HB      TYR   6  -4.780  -1.675 -13.465
   48    HD1  TYR   6           HD1      TYR   6  -3.761  -2.390 -15.598
   49    HD2  TYR   6           HD2      TYR   6  -4.935  -5.210 -12.635
   50    HE1  TYR   6           HE1      TYR   6  -3.653  -4.187 -17.273
   51    HE2  TYR   6           HE2      TYR   6  -4.828  -7.015 -14.302
   52    HH   TYR   6           HH       TYR   6  -4.579  -7.511 -16.465
   53    H    ARG   7           H        ARG   7  -2.717   0.214 -11.927
   54    HA   ARG   7           HA       ARG   7  -2.112   1.278 -14.343
   55    HB2  ARG   7           2HB      ARG   7  -1.581   1.988 -11.586
   56    HB3  ARG   7           3HB      ARG   7  -0.275   2.521 -12.637
   57    HG2  ARG   7           2HG      ARG   7  -2.572   3.237 -14.005
   58    HG3  ARG   7           3HG      ARG   7  -2.945   3.581 -12.315
   59    HD2  ARG   7           2HD      ARG   7  -0.505   4.540 -13.806
   60    HD3  ARG   7           3HD      ARG   7  -1.935   5.509 -13.454
   61    HE   ARG   7           HE       ARG   7  -1.152   4.662 -11.011
   62   HH11  ARG   7          1HH1      ARG   7   0.504   6.239 -13.635
   63   HH12  ARG   7          2HH1      ARG   7   1.618   7.074 -12.603
   64   HH21  ARG   7          1HH2      ARG   7   0.309   5.755  -9.641
   65   HH22  ARG   7          2HH2      ARG   7   1.506   6.797 -10.332
   66    H    ARG   8           H        ARG   8   0.143  -0.420 -12.206
   67    HA   ARG   8           HA       ARG   8   2.108  -0.430 -14.401
   68    HB2  ARG   8           2HB      ARG   8   2.452  -0.478 -11.412
   69    HB3  ARG   8           3HB      ARG   8   3.735  -1.009 -12.490
   70    HG2  ARG   8           2HG      ARG   8   4.114   1.106 -13.306
   71    HG3  ARG   8           3HG      ARG   8   2.488   1.664 -12.910
   72    HD2  ARG   8           2HD      ARG   8   3.271   1.231 -10.449
   73    HD3  ARG   8           3HD      ARG   8   4.881   1.375 -11.152
   74    HE   ARG   8           HE       ARG   8   3.216   3.539 -11.937
   75   HH11  ARG   8          1HH1      ARG   8   5.097   2.308  -9.279
   76   HH12  ARG   8          2HH1      ARG   8   5.399   3.872  -8.598
   77   HH21  ARG   8          1HH2      ARG   8   3.607   5.604 -11.051
   78   HH22  ARG   8          2HH2      ARG   8   4.550   5.746  -9.606
   79    H    ARG   9           H        ARG   9   0.660  -2.388 -11.828
   80    HA   ARG   9           HA       ARG   9   1.361  -4.789 -13.382
   81    HB2  ARG   9           2HB      ARG   9   1.494  -4.373 -10.398
   82    HB3  ARG   9           3HB      ARG   9   1.455  -5.972 -11.128
   83    HG2  ARG   9           2HG      ARG   9   3.465  -4.479 -12.447
   84    HG3  ARG   9           3HG      ARG   9   3.678  -4.261 -10.709
   85    HD2  ARG   9           2HD      ARG   9   3.926  -6.561 -10.338
   86    HD3  ARG   9           3HD      ARG   9   3.240  -6.976 -11.908
   87    HE   ARG   9           HE       ARG   9   5.971  -6.294 -11.335
   88   HH11  ARG   9          1HH1      ARG   9   3.500  -6.385 -13.785
   89   HH12  ARG   9          2HH1      ARG   9   4.625  -6.457 -15.101
   90   HH21  ARG   9          1HH2      ARG   9   7.462  -6.388 -13.059
   91   HH22  ARG   9          2HH2      ARG   9   6.878  -6.459 -14.687
   92    H    PHE  10           H        PHE  10  -0.275  -5.228 -10.420
   93    HA   PHE  10           HA       PHE  10  -2.912  -5.180 -11.685
   94    HB2  PHE  10           2HB      PHE  10  -2.140  -7.462 -12.019
   95    HB3  PHE  10           3HB      PHE  10  -1.724  -7.600 -10.314
   96    HD1  PHE  10           HD2      PHE  10  -3.715  -7.167  -8.654
   97    HD2  PHE  10           HD1      PHE  10  -4.160  -8.284 -12.737
   98    HE1  PHE  10           HE2      PHE  10  -5.973  -8.015  -8.172
   99    HE2  PHE  10           HE1      PHE  10  -6.420  -9.133 -12.261
  100    HZ   PHE  10           HZ       PHE  10  -7.329  -9.000  -9.976
  101    H    VAL  11           H        VAL  11  -4.654  -5.031 -10.232
  102    HA   VAL  11           HA       VAL  11  -4.016  -3.699  -7.773
  103    HB   VAL  11           HB       VAL  11  -6.548  -3.720  -7.474
  104   HG11  VAL  11          1HG1      VAL  11  -4.855  -2.171  -9.106
  105   HG12  VAL  11          2HG1      VAL  11  -6.362  -2.389  -9.997
  106   HG13  VAL  11          3HG1      VAL  11  -6.388  -1.698  -8.374
  107   HG21  VAL  11          3HG2      VAL  11  -6.971  -4.246 -10.310
  108   HG22  VAL  11          1HG2      VAL  11  -6.447  -5.669  -9.408
  109   HG23  VAL  11          2HG2      VAL  11  -7.892  -4.790  -8.908
  110    H    VAL  12           H        VAL  12  -2.850  -5.969  -7.308
  111    HA   VAL  12           HA       VAL  12  -4.520  -8.015  -6.215
  112    HB   VAL  12           HB       VAL  12  -2.320  -8.814  -5.187
  113   HG11  VAL  12          1HG1      VAL  12  -2.267  -8.461  -8.175
  114   HG12  VAL  12          2HG1      VAL  12  -1.612  -9.796  -7.224
  115   HG13  VAL  12          3HG1      VAL  12  -3.358  -9.578  -7.356
  116   HG21  VAL  12          3HG2      VAL  12  -0.392  -7.683  -5.480
  117   HG22  VAL  12          1HG2      VAL  12  -0.844  -7.125  -7.091
  118   HG23  VAL  12          2HG2      VAL  12  -1.462  -6.293  -5.664
  119    H    GLY  13           H        GLY  13  -1.966  -7.330  -4.105
  120    HA2  GLY  13           2HA      GLY  13  -3.847  -6.151  -2.152
  121    HA3  GLY  13           3HA      GLY  13  -2.673  -7.384  -1.717
  122    H    ARG  14           H        ARG  14  -0.335  -6.725  -2.396
  123    HA   ARG  14           HA       ARG  14   0.502  -4.648  -0.801
  124    HB2  ARG  14           2HB      ARG  14   2.605  -4.684  -2.268
  125    HB3  ARG  14           3HB      ARG  14   2.149  -6.180  -1.465
  126    HG2  ARG  14           2HG      ARG  14   0.935  -5.983  -4.076
  127    HG3  ARG  14           3HG      ARG  14   2.691  -5.825  -4.162
  128    HD2  ARG  14           2HD      ARG  14   2.642  -7.886  -2.543
  129    HD3  ARG  14           3HD      ARG  14   1.028  -8.115  -3.215
  130    HE   ARG  14           HE       ARG  14   2.990  -7.747  -5.251
  131   HH11  ARG  14          1HH1      ARG  14   1.645 -10.079  -3.044
  132   HH12  ARG  14          2HH1      ARG  14   2.066 -11.444  -4.024
  133   HH21  ARG  14          1HH2      ARG  14   3.550  -9.536  -6.550
  134   HH22  ARG  14          2HH2      ARG  14   3.151 -11.134  -6.018
  Start of MODEL    8
    1    H1   ARG   1           H        ARG   1   2.215   0.535   0.684
    2    HA   ARG   1           HA       ARG   1   3.254   0.722  -1.643
    3    HB2  ARG   1           2HB      ARG   1   2.043  -1.774  -0.512
    4    HB3  ARG   1           3HB      ARG   1   2.817  -1.823  -2.090
    5    HG2  ARG   1           2HG      ARG   1   4.454  -0.487  -0.102
    6    HG3  ARG   1           3HG      ARG   1   4.052  -2.145   0.350
    7    HD2  ARG   1           2HD      ARG   1   5.009  -3.018  -1.625
    8    HD3  ARG   1           3HD      ARG   1   5.100  -1.424  -2.373
    9    HE   ARG   1           HE       ARG   1   6.646  -1.638   0.034
   10   HH11  ARG   1          1HH1      ARG   1   6.626  -2.209  -3.400
   11   HH12  ARG   1          2HH1      ARG   1   8.350  -2.135  -3.555
   12   HH21  ARG   1          1HH2      ARG   1   8.917  -1.538  -0.157
   13   HH22  ARG   1          2HH2      ARG   1   9.653  -1.754  -1.709
   14    H    GLY   2           H        GLY   2   2.897   0.285  -3.869
   15    HA2  GLY   2           2HA      GLY   2   0.089   0.681  -4.647
   16    HA3  GLY   2           3HA      GLY   2   1.489   1.086  -5.629
   17    H    GLY   3           H        GLY   3   1.343  -1.962  -3.963
   18    HA2  GLY   3           2HA      GLY   3   1.755  -3.445  -6.331
   19    HA3  GLY   3           3HA      GLY   3   1.337  -4.115  -4.761
   20    H    ARG   4           H        ARG   4  -1.115  -2.245  -4.892
   21    HA   ARG   4           HA       ARG   4  -2.768  -4.137  -6.411
   22    HB2  ARG   4           2HB      ARG   4  -4.643  -2.994  -5.055
   23    HB3  ARG   4           3HB      ARG   4  -3.559  -4.096  -4.216
   24    HG2  ARG   4           2HG      ARG   4  -2.772  -2.489  -2.882
   25    HG3  ARG   4           3HG      ARG   4  -2.646  -1.324  -4.201
   26    HD2  ARG   4           2HD      ARG   4  -4.819  -0.585  -3.931
   27    HD3  ARG   4           3HD      ARG   4  -5.334  -2.073  -3.138
   28    HE   ARG   4           HE       ARG   4  -3.407  -0.625  -1.602
   29   HH11  ARG   4          1HH1      ARG   4  -6.784  -0.831  -2.422
   30   HH12  ARG   4          2HH1      ARG   4  -7.320  -0.085  -0.953
   31   HH21  ARG   4          1HH2      ARG   4  -4.100   0.358   0.336
   32   HH22  ARG   4          2HH2      ARG   4  -5.793   0.592   0.615
   33    H    LEU   5           H        LEU   5  -1.327  -2.095  -7.778
   34    HA   LEU   5           HA       LEU   5  -3.582  -0.519  -8.822
   35    HB2  LEU   5           2HB      LEU   5  -0.808   0.366  -8.135
   36    HB3  LEU   5           3HB      LEU   5  -1.714   1.189  -9.403
   37    HG   LEU   5           HG       LEU   5  -1.897   2.411  -7.329
   38   HD11  LEU   5          1HD1      LEU   5  -3.862   2.177  -8.908
   39   HD12  LEU   5          2HD1      LEU   5  -4.234   2.687  -7.261
   40   HD13  LEU   5          3HD1      LEU   5  -4.526   1.019  -7.754
   41   HD21  LEU   5          3HD2      LEU   5  -3.462   0.350  -5.933
   42   HD22  LEU   5          1HD2      LEU   5  -2.292   1.511  -5.306
   43   HD23  LEU   5          2HD2      LEU   5  -1.734   0.023  -6.071
   44    H    TYR   6           H        TYR   6  -4.016  -1.345 -10.759
   45    HA   TYR   6           HA       TYR   6  -2.296  -2.862 -12.340
   46    HB2  TYR   6           2HB      TYR   6  -4.885  -2.509 -12.462
   47    HB3  TYR   6           3HB      TYR   6  -4.473  -1.216 -13.583
   48    HD1  TYR   6           HD2      TYR   6  -3.360  -1.742 -15.724
   49    HD2  TYR   6           HD1      TYR   6  -4.683  -4.811 -13.091
   50    HE1  TYR   6           HE2      TYR   6  -3.184  -3.378 -17.552
   51    HE2  TYR   6           HE1      TYR   6  -4.510  -6.456 -14.912
   52    HH   TYR   6           HH       TYR   6  -3.004  -6.527 -17.190
   53    H    ARG   7           H        ARG   7  -2.416   0.514 -11.865
   54    HA   ARG   7           HA       ARG   7  -1.661   1.695 -14.183
   55    HB2  ARG   7           2HB      ARG   7  -1.250   2.229 -11.366
   56    HB3  ARG   7           3HB      ARG   7   0.120   2.783 -12.319
   57    HG2  ARG   7           2HG      ARG   7  -1.812   3.794 -13.824
   58    HG3  ARG   7           3HG      ARG   7  -2.685   3.735 -12.291
   59    HD2  ARG   7           2HD      ARG   7  -0.288   4.786 -11.528
   60    HD3  ARG   7           3HD      ARG   7  -0.476   5.463 -13.145
   61    HE   ARG   7           HE       ARG   7  -1.996   6.126 -10.802
   62   HH11  ARG   7          1HH1      ARG   7  -2.005   6.041 -14.282
   63   HH12  ARG   7          2HH1      ARG   7  -3.199   7.287 -14.439
   64   HH21  ARG   7          1HH2      ARG   7  -3.568   7.768 -10.996
   65   HH22  ARG   7          2HH2      ARG   7  -4.086   8.269 -12.570
   66    H    ARG   8           H        ARG   8   0.437  -0.185 -12.038
   67    HA   ARG   8           HA       ARG   8   2.509  -0.133 -14.132
   68    HB2  ARG   8           2HB      ARG   8   4.059  -0.806 -12.232
   69    HB3  ARG   8           3HB      ARG   8   3.435   0.838 -12.188
   70    HG2  ARG   8           2HG      ARG   8   1.724   0.109 -10.565
   71    HG3  ARG   8           3HG      ARG   8   2.450  -1.500 -10.567
   72    HD2  ARG   8           2HD      ARG   8   3.743  -0.775  -8.902
   73    HD3  ARG   8           3HD      ARG   8   4.593   0.181 -10.115
   74    HE   ARG   8           HE       ARG   8   2.339   1.604  -9.218
   75   HH11  ARG   8          1HH1      ARG   8   5.472   0.551  -8.125
   76   HH12  ARG   8          2HH1      ARG   8   5.671   1.865  -7.013
   77   HH21  ARG   8          1HH2      ARG   8   2.589   3.339  -7.758
   78   HH22  ARG   8          2HH2      ARG   8   4.030   3.450  -6.805
   79    H    ARG   9           H        ARG   9   0.877  -2.185 -11.750
   80    HA   ARG   9           HA       ARG   9   1.594  -4.517 -13.399
   81    HB2  ARG   9           2HB      ARG   9   1.600  -4.254 -10.397
   82    HB3  ARG   9           3HB      ARG   9   1.519  -5.817 -11.198
   83    HG2  ARG   9           2HG      ARG   9   3.696  -3.885 -11.872
   84    HG3  ARG   9           3HG      ARG   9   3.807  -4.903 -10.435
   85    HD2  ARG   9           2HD      ARG   9   3.333  -6.866 -11.973
   86    HD3  ARG   9           3HD      ARG   9   3.616  -5.755 -13.312
   87    HE   ARG   9           HE       ARG   9   5.785  -5.607 -11.543
   88   HH11  ARG   9          1HH1      ARG   9   4.321  -7.824 -13.793
   89   HH12  ARG   9          2HH1      ARG   9   5.808  -8.629 -14.169
   90   HH21  ARG   9          1HH2      ARG   9   7.750  -6.659 -12.030
   91   HH22  ARG   9          2HH2      ARG   9   7.758  -7.966 -13.165
   92    H    PHE  10           H        PHE  10  -0.206  -5.073 -10.555
   93    HA   PHE  10           HA       PHE  10  -2.771  -4.873 -11.947
   94    HB2  PHE  10           2HB      PHE  10  -2.048  -7.154 -12.375
   95    HB3  PHE  10           3HB      PHE  10  -1.721  -7.402 -10.663
   96    HD1  PHE  10           HD2      PHE  10  -3.780  -7.006  -9.078
   97    HD2  PHE  10           HD1      PHE  10  -4.051  -7.872 -13.236
   98    HE1  PHE  10           HE2      PHE  10  -6.081  -7.812  -8.756
   99    HE2  PHE  10           HE1      PHE  10  -6.354  -8.680 -12.921
  100    HZ   PHE  10           HZ       PHE  10  -7.372  -8.651 -10.679
  101    H    VAL  11           H        VAL  11  -4.584  -4.760 -10.575
  102    HA   VAL  11           HA       VAL  11  -4.040  -3.586  -8.016
  103    HB   VAL  11           HB       VAL  11  -6.580  -3.549  -7.842
  104   HG11  VAL  11          1HG1      VAL  11  -4.774  -1.970  -9.315
  105   HG12  VAL  11          2HG1      VAL  11  -6.240  -2.105 -10.287
  106   HG13  VAL  11          3HG1      VAL  11  -6.329  -1.492  -8.636
  107   HG21  VAL  11          3HG2      VAL  11  -6.381  -5.365  -9.946
  108   HG22  VAL  11          1HG2      VAL  11  -7.849  -4.601  -9.337
  109   HG23  VAL  11          2HG2      VAL  11  -6.971  -3.877 -10.684
  110    H    VAL  12           H        VAL  12  -2.952  -5.908  -7.624
  111    HA   VAL  12           HA       VAL  12  -4.722  -7.967  -6.732
  112    HB   VAL  12           HB       VAL  12  -2.597  -8.880  -5.645
  113   HG11  VAL  12          1HG1      VAL  12  -2.389  -8.359  -8.602
  114   HG12  VAL  12          2HG1      VAL  12  -1.805  -9.760  -7.701
  115   HG13  VAL  12          3HG1      VAL  12  -3.538  -9.497  -7.901
  116   HG21  VAL  12          3HG2      VAL  12  -0.631  -7.785  -5.776
  117   HG22  VAL  12          1HG2      VAL  12  -0.986  -7.126  -7.373
  118   HG23  VAL  12          2HG2      VAL  12  -1.657  -6.360  -5.933
  119    H    GLY  13           H        GLY  13  -2.264  -7.470  -4.463
  120    HA2  GLY  13           2HA      GLY  13  -4.212  -6.350  -2.543
  121    HA3  GLY  13           3HA      GLY  13  -3.093  -7.637  -2.121
  122    H    ARG  14           H        ARG  14  -0.708  -7.007  -2.643
  123    HA   ARG  14           HA       ARG  14   0.100  -5.050  -0.892
  124    HB2  ARG  14           2HB      ARG  14   2.270  -5.056  -2.259
  125    HB3  ARG  14           3HB      ARG  14   1.741  -6.584  -1.567
  126    HG2  ARG  14           2HG      ARG  14   0.671  -6.184  -4.226
  127    HG3  ARG  14           3HG      ARG  14   2.435  -6.110  -4.200
  128    HD2  ARG  14           2HD      ARG  14   0.988  -8.305  -2.770
  129    HD3  ARG  14           3HD      ARG  14   1.250  -8.400  -4.511
  130    HE   ARG  14           HE       ARG  14   3.711  -7.825  -3.471
  131   HH11  ARG  14          1HH1      ARG  14   1.340 -10.327  -2.977
  132   HH12  ARG  14          2HH1      ARG  14   2.511 -11.535  -2.565
  133   HH21  ARG  14          1HH2      ARG  14   5.262  -9.408  -2.930
  134   HH22  ARG  14          2HH2      ARG  14   4.741 -11.012  -2.537
  Start of MODEL    9
    1    H1   ARG   1           H        ARG   1   5.165  -0.689  -1.014
    2    HA   ARG   1           HA       ARG   1   3.349  -2.062  -0.960
    3    HB2  ARG   1           2HB      ARG   1   1.307  -1.219   0.327
    4    HB3  ARG   1           3HB      ARG   1   2.802  -1.413   1.233
    5    HG2  ARG   1           2HG      ARG   1   2.404   1.252   0.075
    6    HG3  ARG   1           3HG      ARG   1   1.228   0.786   1.305
    7    HD2  ARG   1           2HD      ARG   1   3.416   0.009   2.576
    8    HD3  ARG   1           3HD      ARG   1   4.159   1.225   1.538
    9    HE   ARG   1           HE       ARG   1   3.143   2.860   2.781
   10   HH11  ARG   1          1HH1      ARG   1   1.665  -0.210   3.494
   11   HH12  ARG   1          2HH1      ARG   1   0.726   0.402   4.816
   12   HH21  ARG   1          1HH2      ARG   1   1.912   3.677   4.518
   13   HH22  ARG   1          2HH2      ARG   1   0.867   2.613   5.397
   14    H    GLY   2           H        GLY   2   3.681  -1.030  -3.315
   15    HA2  GLY   2           2HA      GLY   2   1.031  -0.006  -4.132
   16    HA3  GLY   2           3HA      GLY   2   2.528   0.466  -4.923
   17    H    GLY   3           H        GLY   3   1.556  -2.777  -3.884
   18    HA2  GLY   3           2HA      GLY   3   2.000  -3.703  -6.626
   19    HA3  GLY   3           3HA      GLY   3   1.906  -4.716  -5.193
   20    H    ARG   4           H        ARG   4  -0.583  -2.691  -4.803
   21    HA   ARG   4           HA       ARG   4  -2.449  -4.542  -6.123
   22    HB2  ARG   4           2HB      ARG   4  -4.089  -3.404  -4.440
   23    HB3  ARG   4           3HB      ARG   4  -2.976  -4.641  -3.873
   24    HG2  ARG   4           2HG      ARG   4  -1.820  -3.203  -2.590
   25    HG3  ARG   4           3HG      ARG   4  -1.960  -1.885  -3.756
   26    HD2  ARG   4           2HD      ARG   4  -4.204  -2.846  -1.987
   27    HD3  ARG   4           3HD      ARG   4  -3.159  -1.475  -1.615
   28    HE   ARG   4           HE       ARG   4  -5.364  -1.509  -3.424
   29   HH11  ARG   4          1HH1      ARG   4  -2.255  -0.064  -2.816
   30   HH12  ARG   4          2HH1      ARG   4  -2.616   1.391  -3.685
   31   HH21  ARG   4          1HH2      ARG   4  -5.851   0.402  -4.570
   32   HH22  ARG   4          2HH2      ARG   4  -4.662   1.656  -4.682
   33    H    LEU   5           H        LEU   5  -1.212  -2.424  -7.572
   34    HA   LEU   5           HA       LEU   5  -3.591  -0.812  -8.203
   35    HB2  LEU   5           2HB      LEU   5  -1.984   1.020  -8.853
   36    HB3  LEU   5           3HB      LEU   5  -2.170   0.718  -7.127
   37    HG   LEU   5           HG       LEU   5  -0.006  -0.841  -7.768
   38   HD11  LEU   5          1HD1      LEU   5   0.669  -0.167  -9.803
   39   HD12  LEU   5          2HD1      LEU   5   1.339   1.200  -8.914
   40   HD13  LEU   5          3HD1      LEU   5  -0.225   1.351  -9.716
   41   HD21  LEU   5          3HD2      LEU   5   1.304   1.008  -6.706
   42   HD22  LEU   5          1HD2      LEU   5  -0.122   0.500  -5.801
   43   HD23  LEU   5          2HD2      LEU   5  -0.162   1.989  -6.747
   44    H    TYR   6           H        TYR   6  -4.283  -1.547 -10.102
   45    HA   TYR   6           HA       TYR   6  -2.799  -2.955 -11.986
   46    HB2  TYR   6           2HB      TYR   6  -5.387  -2.572 -11.731
   47    HB3  TYR   6           3HB      TYR   6  -5.102  -1.253 -12.861
   48    HD1  TYR   6           HD2      TYR   6  -4.285  -1.731 -15.142
   49    HD2  TYR   6           HD1      TYR   6  -5.305  -4.858 -12.442
   50    HE1  TYR   6           HE2      TYR   6  -4.375  -3.316 -17.020
   51    HE2  TYR   6           HE1      TYR   6  -5.397  -6.452 -14.313
   52    HH   TYR   6           HH       TYR   6  -5.591  -6.551 -16.640
   53    H    ARG   7           H        ARG   7  -2.855   0.395 -11.318
   54    HA   ARG   7           HA       ARG   7  -2.404   1.699 -13.649
   55    HB2  ARG   7           2HB      ARG   7  -1.761   2.140 -10.900
   56    HB3  ARG   7           3HB      ARG   7  -0.376   2.609 -11.877
   57    HG2  ARG   7           2HG      ARG   7  -2.078   3.913 -13.293
   58    HG3  ARG   7           3HG      ARG   7  -3.159   3.705 -11.913
   59    HD2  ARG   7           2HD      ARG   7  -0.638   4.556 -10.929
   60    HD3  ARG   7           3HD      ARG   7  -1.074   5.607 -12.276
   61    HE   ARG   7           HE       ARG   7  -3.245   5.231 -10.464
   62   HH11  ARG   7          1HH1      ARG   7  -0.284   6.992 -10.965
   63   HH12  ARG   7          2HH1      ARG   7  -0.763   8.334  -9.979
   64   HH21  ARG   7          1HH2      ARG   7  -3.886   6.991  -9.164
   65   HH22  ARG   7          2HH2      ARG   7  -2.812   8.332  -8.954
   66    H    ARG   8           H        ARG   8  -0.048  -0.277 -11.892
   67    HA   ARG   8           HA       ARG   8   1.739  -0.100 -14.228
   68    HB2  ARG   8           2HB      ARG   8   2.379  -0.651 -11.326
   69    HB3  ARG   8           3HB      ARG   8   3.545  -0.790 -12.635
   70    HG2  ARG   8           2HG      ARG   8   2.850   1.674 -13.134
   71    HG3  ARG   8           3HG      ARG   8   2.299   1.646 -11.458
   72    HD2  ARG   8           2HD      ARG   8   4.405   2.184 -10.935
   73    HD3  ARG   8           3HD      ARG   8   4.780   0.497 -11.286
   74    HE   ARG   8           HE       ARG   8   4.955   1.730 -13.705
   75   HH11  ARG   8          1HH1      ARG   8   6.404   2.262 -10.585
   76   HH12  ARG   8          2HH1      ARG   8   7.867   2.926 -11.232
   77   HH21  ARG   8          1HH2      ARG   8   6.876   2.603 -14.570
   78   HH22  ARG   8          2HH2      ARG   8   8.135   3.121 -13.499
   79    H    ARG   9           H        ARG   9   0.439  -2.291 -11.764
   80    HA   ARG   9           HA       ARG   9   0.927  -4.524 -13.621
   81    HB2  ARG   9           2HB      ARG   9   1.333  -4.426 -10.636
   82    HB3  ARG   9           3HB      ARG   9   1.148  -5.943 -11.506
   83    HG2  ARG   9           2HG      ARG   9   3.215  -3.955 -12.349
   84    HG3  ARG   9           3HG      ARG   9   3.516  -5.058 -11.005
   85    HD2  ARG   9           2HD      ARG   9   2.853  -6.931 -12.577
   86    HD3  ARG   9           3HD      ARG   9   2.932  -5.741 -13.875
   87    HE   ARG   9           HE       ARG   9   5.317  -5.822 -12.294
   88   HH11  ARG   9          1HH1      ARG   9   3.616  -7.324 -14.934
   89   HH12  ARG   9          2HH1      ARG   9   5.052  -7.938 -15.682
   90   HH21  ARG   9          1HH2      ARG   9   7.216  -6.625 -13.270
   91   HH22  ARG   9          2HH2      ARG   9   7.100  -7.540 -14.735
   92    H    PHE  10           H        PHE  10  -0.477  -5.241 -10.594
   93    HA   PHE  10           HA       PHE  10  -3.205  -4.983 -11.615
   94    HB2  PHE  10           2HB      PHE  10  -2.528  -7.233 -12.265
   95    HB3  PHE  10           3HB      PHE  10  -2.009  -7.577 -10.619
   96    HD1  PHE  10           HD1      PHE  10  -3.870  -7.275  -8.789
   97    HD2  PHE  10           HD2      PHE  10  -4.619  -7.911 -12.930
   98    HE1  PHE  10           HE1      PHE  10  -6.123  -8.106  -8.250
   99    HE2  PHE  10           HE2      PHE  10  -6.873  -8.742 -12.399
  100    HZ   PHE  10           HZ       PHE  10  -7.628  -8.839 -10.056
  101    H    VAL  11           H        VAL  11  -4.816  -4.963 -10.007
  102    HA   VAL  11           HA       VAL  11  -3.928  -3.938  -7.479
  103    HB   VAL  11           HB       VAL  11  -6.416  -3.911  -6.961
  104   HG11  VAL  11          1HG1      VAL  11  -4.827  -2.258  -8.594
  105   HG12  VAL  11          2HG1      VAL  11  -6.414  -2.352  -9.360
  106   HG13  VAL  11          3HG1      VAL  11  -6.272  -1.818  -7.685
  107   HG21  VAL  11          3HG2      VAL  11  -6.739  -4.500  -9.892
  108   HG22  VAL  11          1HG2      VAL  11  -6.885  -5.749  -8.654
  109   HG23  VAL  11          2HG2      VAL  11  -7.988  -4.373  -8.654
  110    H    VAL  12           H        VAL  12  -2.810  -6.282  -7.387
  111    HA   VAL  12           HA       VAL  12  -4.474  -8.375  -6.354
  112    HB   VAL  12           HB       VAL  12  -2.258  -9.432  -5.730
  113   HG11  VAL  12          1HG1      VAL  12  -2.397  -8.603  -8.617
  114   HG12  VAL  12          2HG1      VAL  12  -1.813 -10.125  -7.942
  115   HG13  VAL  12          3HG1      VAL  12  -3.534  -9.743  -7.899
  116   HG21  VAL  12          3HG2      VAL  12  -0.819  -7.552  -7.472
  117   HG22  VAL  12          1HG2      VAL  12  -1.270  -6.915  -5.891
  118   HG23  VAL  12          2HG2      VAL  12  -0.288  -8.375  -6.006
  119    H    GLY  13           H        GLY  13  -1.721  -8.244  -4.472
  120    HA2  GLY  13           2HA      GLY  13  -3.223  -7.059  -2.219
  121    HA3  GLY  13           3HA      GLY  13  -2.226  -8.495  -2.046
  122    H    ARG  14           H        ARG  14   0.089  -7.940  -3.207
  123    HA   ARG  14           HA       ARG  14   1.503  -6.438  -1.394
  124    HB2  ARG  14           2HB      ARG  14   3.242  -6.244  -3.273
  125    HB3  ARG  14           3HB      ARG  14   2.764  -7.858  -2.768
  126    HG2  ARG  14           2HG      ARG  14   1.080  -6.891  -4.902
  127    HG3  ARG  14           3HG      ARG  14   2.786  -6.848  -5.352
  128    HD2  ARG  14           2HD      ARG  14   2.804  -9.252  -4.313
  129    HD3  ARG  14           3HD      ARG  14   1.068  -9.176  -4.617
  130    HE   ARG  14           HE       ARG  14   2.536  -8.420  -6.924
  131   HH11  ARG  14          1HH1      ARG  14   1.586 -11.189  -5.040
  132   HH12  ARG  14          2HH1      ARG  14   1.655 -12.287  -6.379
  133   HH21  ARG  14          1HH2      ARG  14   2.630  -9.855  -8.694
  134   HH22  ARG  14          2HH2      ARG  14   2.249 -11.527  -8.457
  Start of MODEL   10
    1    H1   ARG   1           H        ARG   1   5.039   1.576  -2.102
    2    HA   ARG   1           HA       ARG   1   4.303  -0.598  -2.311
    3    HB2  ARG   1           2HB      ARG   1   2.492   0.224  -0.047
    4    HB3  ARG   1           3HB      ARG   1   2.337  -1.334  -0.848
    5    HG2  ARG   1           2HG      ARG   1   4.999  -1.271  -0.273
    6    HG3  ARG   1           3HG      ARG   1   4.305  -0.407   1.100
    7    HD2  ARG   1           2HD      ARG   1   2.596  -2.453   0.988
    8    HD3  ARG   1           3HD      ARG   1   4.006  -3.238   0.278
    9    HE   ARG   1           HE       ARG   1   4.816  -1.927   2.608
   10   HH11  ARG   1          1HH1      ARG   1   2.805  -4.598   1.639
   11   HH12  ARG   1          2HH1      ARG   1   3.045  -5.481   3.110
   12   HH21  ARG   1          1HH2      ARG   1   5.139  -3.080   4.549
   13   HH22  ARG   1          2HH2      ARG   1   4.372  -4.616   4.765
   14    H    GLY   2           H        GLY   2   3.733   0.200  -4.418
   15    HA2  GLY   2           2HA      GLY   2   0.842   0.699  -4.757
   16    HA3  GLY   2           3HA      GLY   2   2.087   1.272  -5.858
   17    H    GLY   3           H        GLY   3   2.131  -1.957  -4.518
   18    HA2  GLY   3           2HA      GLY   3   2.245  -3.122  -7.123
   19    HA3  GLY   3           3HA      GLY   3   2.180  -3.992  -5.597
   20    H    ARG   4           H        ARG   4  -0.351  -2.068  -5.284
   21    HA   ARG   4           HA       ARG   4  -2.179  -4.043  -6.462
   22    HB2  ARG   4           2HB      ARG   4  -3.838  -2.883  -4.846
   23    HB3  ARG   4           3HB      ARG   4  -2.629  -3.973  -4.180
   24    HG2  ARG   4           2HG      ARG   4  -1.618  -2.345  -3.026
   25    HG3  ARG   4           3HG      ARG   4  -1.768  -1.182  -4.344
   26    HD2  ARG   4           2HD      ARG   4  -3.141  -0.256  -2.739
   27    HD3  ARG   4           3HD      ARG   4  -4.288  -1.186  -3.702
   28    HE   ARG   4           HE       ARG   4  -3.359  -2.815  -1.629
   29   HH11  ARG   4          1HH1      ARG   4  -5.276   0.056  -2.085
   30   HH12  ARG   4          2HH1      ARG   4  -6.242  -0.207  -0.671
   31   HH21  ARG   4          1HH2      ARG   4  -4.625  -3.172   0.235
   32   HH22  ARG   4          2HH2      ARG   4  -5.870  -2.043   0.648
   33    H    LEU   5           H        LEU   5  -1.022  -1.999  -8.079
   34    HA   LEU   5           HA       LEU   5  -3.456  -0.505  -8.788
   35    HB2  LEU   5           2HB      LEU   5  -0.698   0.599  -9.204
   36    HB3  LEU   5           3HB      LEU   5  -2.243   1.445  -9.273
   37    HG   LEU   5           HG       LEU   5  -0.984   0.359  -6.755
   38   HD11  LEU   5          1HD1      LEU   5  -0.526   2.709  -6.222
   39   HD12  LEU   5          2HD1      LEU   5  -1.095   3.176  -7.824
   40   HD13  LEU   5          3HD1      LEU   5   0.348   2.175  -7.658
   41   HD21  LEU   5          3HD2      LEU   5  -3.108   0.529  -6.048
   42   HD22  LEU   5          1HD2      LEU   5  -3.588   1.541  -7.411
   43   HD23  LEU   5          2HD2      LEU   5  -2.777   2.262  -6.020
   44    H    TYR   6           H        TYR   6  -4.156  -1.400 -10.615
   45    HA   TYR   6           HA       TYR   6  -2.658  -2.901 -12.416
   46    HB2  TYR   6           2HB      TYR   6  -5.245  -2.606 -12.147
   47    HB3  TYR   6           3HB      TYR   6  -5.040  -1.334 -13.346
   48    HD1  TYR   6           HD2      TYR   6  -4.251  -1.891 -15.619
   49    HD2  TYR   6           HD1      TYR   6  -5.083  -4.919 -12.748
   50    HE1  TYR   6           HE2      TYR   6  -4.314  -3.569 -17.416
   51    HE2  TYR   6           HE1      TYR   6  -5.147  -6.606 -14.537
   52    HH   TYR   6           HH       TYR   6  -4.073  -6.777 -16.944
   53    H    ARG   7           H        ARG   7  -2.801   0.484 -11.993
   54    HA   ARG   7           HA       ARG   7  -2.436   1.631 -14.417
   55    HB2  ARG   7           2HB      ARG   7  -1.243   2.164 -11.739
   56    HB3  ARG   7           3HB      ARG   7  -0.583   3.029 -13.121
   57    HG2  ARG   7           2HG      ARG   7  -3.237   3.396 -13.508
   58    HG3  ARG   7           3HG      ARG   7  -3.153   3.342 -11.747
   59    HD2  ARG   7           2HD      ARG   7  -1.124   4.972 -12.124
   60    HD3  ARG   7           3HD      ARG   7  -1.942   5.285 -13.654
   61    HE   ARG   7           HE       ARG   7  -2.733   6.197 -11.074
   62   HH11  ARG   7          1HH1      ARG   7  -3.950   5.187 -14.175
   63   HH12  ARG   7          2HH1      ARG   7  -5.414   6.105 -14.046
   64   HH21  ARG   7          1HH2      ARG   7  -4.657   7.410 -10.892
   65   HH22  ARG   7          2HH2      ARG   7  -5.814   7.370 -12.178
   66    H    ARG   8           H        ARG   8   0.012  -0.157 -12.589
   67    HA   ARG   8           HA       ARG   8   1.738  -0.099 -14.975
   68    HB2  ARG   8           2HB      ARG   8   2.346  -0.126 -12.046
   69    HB3  ARG   8           3HB      ARG   8   3.496  -0.846 -13.166
   70    HG2  ARG   8           2HG      ARG   8   3.492   1.331 -14.414
   71    HG3  ARG   8           3HG      ARG   8   2.556   2.007 -13.079
   72    HD2  ARG   8           2HD      ARG   8   4.558   0.880 -11.696
   73    HD3  ARG   8           3HD      ARG   8   5.404   1.221 -13.205
   74    HE   ARG   8           HE       ARG   8   4.064   3.538 -12.541
   75   HH11  ARG   8          1HH1      ARG   8   6.509   1.515 -11.109
   76   HH12  ARG   8          2HH1      ARG   8   7.275   2.818 -10.261
   77   HH21  ARG   8          1HH2      ARG   8   5.064   5.261 -11.430
   78   HH22  ARG   8          2HH2      ARG   8   6.452   4.948 -10.444
   79    H    ARG   9           H        ARG   9   0.552  -2.144 -12.336
   80    HA   ARG   9           HA       ARG   9   1.058  -4.489 -14.043
   81    HB2  ARG   9           2HB      ARG   9   1.514  -4.183 -11.078
   82    HB3  ARG   9           3HB      ARG   9   1.376  -5.756 -11.854
   83    HG2  ARG   9           2HG      ARG   9   3.345  -5.444 -13.088
   84    HG3  ARG   9           3HG      ARG   9   3.370  -3.709 -12.763
   85    HD2  ARG   9           2HD      ARG   9   4.995  -4.538 -11.326
   86    HD3  ARG   9           3HD      ARG   9   3.576  -4.403 -10.289
   87    HE   ARG   9           HE       ARG   9   3.458  -6.952 -11.215
   88   HH11  ARG   9          1HH1      ARG   9   5.907  -5.069  -9.609
   89   HH12  ARG   9          2HH1      ARG   9   6.619  -6.433  -8.814
   90   HH21  ARG   9          1HH2      ARG   9   4.387  -8.756 -10.174
   91   HH22  ARG   9          2HH2      ARG   9   5.755  -8.530  -9.137
   92    H    PHE  10           H        PHE  10  -0.260  -5.024 -10.941
   93    HA   PHE  10           HA       PHE  10  -3.015  -4.913 -11.916
   94    HB2  PHE  10           2HB      PHE  10  -2.297  -7.187 -12.410
   95    HB3  PHE  10           3HB      PHE  10  -1.721  -7.390 -10.759
   96    HD1  PHE  10           HD1      PHE  10  -3.538  -7.001  -8.901
   97    HD2  PHE  10           HD2      PHE  10  -4.385  -7.970 -12.957
   98    HE1  PHE  10           HE1      PHE  10  -5.749  -7.849  -8.233
   99    HE2  PHE  10           HE2      PHE  10  -6.598  -8.819 -12.296
  100    HZ   PHE  10           HZ       PHE  10  -7.282  -8.758  -9.931
  101    H    VAL  11           H        VAL  11  -4.593  -4.816 -10.278
  102    HA   VAL  11           HA       VAL  11  -3.688  -3.571  -7.859
  103    HB   VAL  11           HB       VAL  11  -6.168  -3.594  -7.286
  104   HG11  VAL  11          1HG1      VAL  11  -4.666  -2.004  -9.053
  105   HG12  VAL  11          2HG1      VAL  11  -6.256  -2.210  -9.791
  106   HG13  VAL  11          3HG1      VAL  11  -6.118  -1.554  -8.159
  107   HG21  VAL  11          3HG2      VAL  11  -6.533  -4.385 -10.161
  108   HG22  VAL  11          1HG2      VAL  11  -6.590  -5.562  -8.850
  109   HG23  VAL  11          2HG2      VAL  11  -7.753  -4.238  -8.897
  110    H    VAL  12           H        VAL  12  -2.486  -5.859  -7.607
  111    HA   VAL  12           HA       VAL  12  -4.051  -7.922  -6.380
  112    HB   VAL  12           HB       VAL  12  -1.785  -8.843  -5.717
  113   HG11  VAL  12          1HG1      VAL  12  -2.014  -8.255  -8.658
  114   HG12  VAL  12          2HG1      VAL  12  -1.349  -9.691  -7.878
  115   HG13  VAL  12          3HG1      VAL  12  -3.084  -9.381  -7.824
  116   HG21  VAL  12          3HG2      VAL  12   0.134  -7.734  -6.110
  117   HG22  VAL  12          1HG2      VAL  12  -0.447  -7.065  -7.635
  118   HG23  VAL  12          2HG2      VAL  12  -0.901  -6.306  -6.109
  119    H    GLY  13           H        GLY  13  -1.274  -7.541  -4.568
  120    HA2  GLY  13           2HA      GLY  13  -2.779  -6.228  -2.389
  121    HA3  GLY  13           3HA      GLY  13  -1.740  -7.620  -2.119
  122    H    ARG  14           H        ARG  14   0.527  -7.062  -3.429
  123    HA   ARG  14           HA       ARG  14   1.954  -5.426  -1.747
  124    HB2  ARG  14           2HB      ARG  14   3.588  -5.250  -3.751
  125    HB3  ARG  14           3HB      ARG  14   3.252  -6.834  -3.068
  126    HG2  ARG  14           2HG      ARG  14   1.368  -6.230  -5.150
  127    HG3  ARG  14           3HG      ARG  14   3.023  -6.043  -5.735
  128    HD2  ARG  14           2HD      ARG  14   2.016  -8.345  -5.982
  129    HD3  ARG  14           3HD      ARG  14   3.576  -8.269  -5.165
  130    HE   ARG  14           HE       ARG  14   1.915  -8.203  -3.090
  131   HH11  ARG  14          1HH1      ARG  14   1.918 -10.223  -5.924
  132   HH12  ARG  14          2HH1      ARG  14   1.188 -11.574  -5.122
  133   HH21  ARG  14          1HH2      ARG  14   0.954  -9.974  -2.022
  134   HH22  ARG  14          2HH2      ARG  14   0.639 -11.431  -2.902
  Start of MODEL   11
    1    H1   ARG   1           H        ARG   1   4.451   1.325  -0.961
    2    HA   ARG   1           HA       ARG   1   3.714  -0.905  -1.324
    3    HB2  ARG   1           2HB      ARG   1   1.345  -0.104   0.378
    4    HB3  ARG   1           3HB      ARG   1   1.609  -1.690  -0.334
    5    HG2  ARG   1           2HG      ARG   1   3.903  -0.941   1.201
    6    HG3  ARG   1           3HG      ARG   1   2.444  -0.762   2.178
    7    HD2  ARG   1           2HD      ARG   1   1.836  -3.023   1.856
    8    HD3  ARG   1           3HD      ARG   1   3.015  -3.231   0.562
    9    HE   ARG   1           HE       ARG   1   4.231  -2.533   3.054
   10   HH11  ARG   1          1HH1      ARG   1   2.926  -5.166   1.187
   11   HH12  ARG   1          2HH1      ARG   1   3.875  -6.375   1.986
   12   HH21  ARG   1          1HH2      ARG   1   5.486  -4.115   4.113
   13   HH22  ARG   1          2HH2      ARG   1   5.331  -5.776   3.651
   14    H    GLY   2           H        GLY   2   3.650  -0.134  -3.453
   15    HA2  GLY   2           2HA      GLY   2   0.977   0.762  -4.346
   16    HA3  GLY   2           3HA      GLY   2   2.472   1.320  -5.082
   17    H    GLY   3           H        GLY   3   1.634  -1.981  -4.111
   18    HA2  GLY   3           2HA      GLY   3   2.119  -2.811  -6.890
   19    HA3  GLY   3           3HA      GLY   3   2.226  -3.852  -5.478
   20    H    ARG   4           H        ARG   4  -0.469  -2.010  -5.070
   21    HA   ARG   4           HA       ARG   4  -2.177  -4.127  -6.191
   22    HB2  ARG   4           2HB      ARG   4  -3.867  -2.994  -4.523
   23    HB3  ARG   4           3HB      ARG   4  -2.669  -4.144  -3.944
   24    HG2  ARG   4           2HG      ARG   4  -2.789  -2.233  -2.470
   25    HG3  ARG   4           3HG      ARG   4  -1.219  -2.285  -3.276
   26    HD2  ARG   4           2HD      ARG   4  -2.078  -0.014  -3.234
   27    HD3  ARG   4           3HD      ARG   4  -2.004  -0.615  -4.890
   28    HE   ARG   4           HE       ARG   4  -4.567  -1.092  -3.824
   29   HH11  ARG   4          1HH1      ARG   4  -2.539   1.511  -4.932
   30   HH12  ARG   4          2HH1      ARG   4  -3.866   2.514  -5.415
   31   HH21  ARG   4          1HH2      ARG   4  -6.323   0.218  -4.455
   32   HH22  ARG   4          2HH2      ARG   4  -6.019   1.778  -5.142
   33    H    LEU   5           H        LEU   5  -1.193  -1.978  -7.800
   34    HA   LEU   5           HA       LEU   5  -3.744  -0.669  -8.460
   35    HB2  LEU   5           2HB      LEU   5  -2.232   1.232  -9.326
   36    HB3  LEU   5           3HB      LEU   5  -2.575   1.124  -7.601
   37    HG   LEU   5           HG       LEU   5  -0.167  -0.319  -8.216
   38   HD11  LEU   5          1HD1      LEU   5   1.230   1.415  -9.037
   39   HD12  LEU   5          2HD1      LEU   5  -0.074   2.599  -8.947
   40   HD13  LEU   5          3HD1      LEU   5  -0.145   1.298 -10.136
   41   HD21  LEU   5          3HD2      LEU   5   0.682   1.590  -6.646
   42   HD22  LEU   5          1HD2      LEU   5  -0.399   0.342  -6.025
   43   HD23  LEU   5          2HD2      LEU   5  -1.040   1.928  -6.456
   44    H    TYR   6           H        TYR   6  -4.397  -1.567 -10.301
   45    HA   TYR   6           HA       TYR   6  -2.807  -2.930 -12.137
   46    HB2  TYR   6           2HB      TYR   6  -5.397  -2.864 -11.843
   47    HB3  TYR   6           3HB      TYR   6  -5.322  -1.534 -12.994
   48    HD1  TYR   6           HD2      TYR   6  -4.531  -1.935 -15.299
   49    HD2  TYR   6           HD1      TYR   6  -5.046  -5.130 -12.536
   50    HE1  TYR   6           HE2      TYR   6  -4.482  -3.544 -17.159
   51    HE2  TYR   6           HE1      TYR   6  -4.998  -6.748 -14.388
   52    HH   TYR   6           HH       TYR   6  -5.557  -6.141 -17.375
   53    H    ARG   7           H        ARG   7  -3.188   0.423 -11.651
   54    HA   ARG   7           HA       ARG   7  -2.947   1.634 -14.064
   55    HB2  ARG   7           2HB      ARG   7  -2.282   2.295 -11.368
   56    HB3  ARG   7           3HB      ARG   7  -0.972   2.839 -12.407
   57    HG2  ARG   7           2HG      ARG   7  -2.656   4.013 -13.811
   58    HG3  ARG   7           3HG      ARG   7  -3.882   3.573 -12.620
   59    HD2  ARG   7           2HD      ARG   7  -3.215   5.158 -11.183
   60    HD3  ARG   7           3HD      ARG   7  -1.508   4.814 -11.457
   61    HE   ARG   7           HE       ARG   7  -1.444   6.555 -12.931
   62   HH11  ARG   7          1HH1      ARG   7  -4.760   5.601 -12.467
   63   HH12  ARG   7          2HH1      ARG   7  -5.404   6.916 -13.394
   64   HH21  ARG   7          1HH2      ARG   7  -2.280   8.290 -14.153
   65   HH22  ARG   7          2HH2      ARG   7  -3.992   8.444 -14.353
   66    H    ARG   8           H        ARG   8  -0.335   0.039 -12.277
   67    HA   ARG   8           HA       ARG   8   1.344   0.243 -14.689
   68    HB2  ARG   8           2HB      ARG   8   3.278  -0.067 -13.176
   69    HB3  ARG   8           3HB      ARG   8   2.351   1.381 -12.804
   70    HG2  ARG   8           2HG      ARG   8   1.203   0.086 -11.002
   71    HG3  ARG   8           3HG      ARG   8   2.339  -1.228 -11.311
   72    HD2  ARG   8           2HD      ARG   8   3.003   0.246  -9.425
   73    HD3  ARG   8           3HD      ARG   8   4.201   0.161 -10.717
   74    HE   ARG   8           HE       ARG   8   2.411   2.368 -11.027
   75   HH11  ARG   8          1HH1      ARG   8   5.273   1.267  -9.378
   76   HH12  ARG   8          2HH1      ARG   8   5.911   2.861  -9.146
   77   HH21  ARG   8          1HH2      ARG   8   3.240   4.472 -10.727
   78   HH22  ARG   8          2HH2      ARG   8   4.753   4.683  -9.913
   79    H    ARG   9           H        ARG   9   0.340  -1.896 -12.054
   80    HA   ARG   9           HA       ARG   9   1.044  -4.188 -13.763
   81    HB2  ARG   9           2HB      ARG   9   1.478  -3.834 -10.802
   82    HB3  ARG   9           3HB      ARG   9   1.438  -5.423 -11.556
   83    HG2  ARG   9           2HG      ARG   9   3.274  -3.307 -12.596
   84    HG3  ARG   9           3HG      ARG   9   3.708  -4.254 -11.171
   85    HD2  ARG   9           2HD      ARG   9   2.717  -5.823 -13.448
   86    HD3  ARG   9           3HD      ARG   9   4.238  -4.979 -13.736
   87    HE   ARG   9           HE       ARG   9   3.852  -7.278 -12.116
   88   HH11  ARG   9          1HH1      ARG   9   5.693  -4.332 -12.349
   89   HH12  ARG   9          2HH1      ARG   9   7.041  -4.950 -11.453
   90   HH21  ARG   9          1HH2      ARG   9   5.621  -8.103 -10.935
   91   HH22  ARG   9          2HH2      ARG   9   6.999  -7.095 -10.650
   92    H    PHE  10           H        PHE  10  -0.229  -4.869 -10.678
   93    HA   PHE  10           HA       PHE  10  -2.987  -4.951 -11.644
   94    HB2  PHE  10           2HB      PHE  10  -2.086  -7.149 -12.201
   95    HB3  PHE  10           3HB      PHE  10  -1.510  -7.354 -10.550
   96    HD1  PHE  10           HD1      PHE  10  -3.367  -7.151  -8.702
   97    HD2  PHE  10           HD2      PHE  10  -4.103  -8.073 -12.791
   98    HE1  PHE  10           HE1      PHE  10  -5.514  -8.181  -8.080
   99    HE2  PHE  10           HE2      PHE  10  -6.251  -9.103 -12.176
  100    HZ   PHE  10           HZ       PHE  10  -6.959  -9.158  -9.818
  101    H    VAL  11           H        VAL  11  -4.559  -5.011 -10.001
  102    HA   VAL  11           HA       VAL  11  -3.732  -3.780  -7.546
  103    HB   VAL  11           HB       VAL  11  -6.196  -3.964  -6.970
  104   HG11  VAL  11          1HG1      VAL  11  -4.818  -2.264  -8.745
  105   HG12  VAL  11          2HG1      VAL  11  -6.410  -2.554  -9.448
  106   HG13  VAL  11          3HG1      VAL  11  -6.272  -1.911  -7.811
  107   HG21  VAL  11          3HG2      VAL  11  -6.510  -4.767  -9.852
  108   HG22  VAL  11          1HG2      VAL  11  -6.529  -5.934  -8.530
  109   HG23  VAL  11          2HG2      VAL  11  -7.751  -4.665  -8.603
  110    H    VAL  12           H        VAL  12  -2.383  -5.995  -7.372
  111    HA   VAL  12           HA       VAL  12  -3.806  -8.192  -6.207
  112    HB   VAL  12           HB       VAL  12  -1.496  -9.000  -5.589
  113   HG11  VAL  12          1HG1      VAL  12  -1.739  -8.272  -8.497
  114   HG12  VAL  12          2HG1      VAL  12  -0.984  -9.701  -7.788
  115   HG13  VAL  12          3HG1      VAL  12  -2.737  -9.510  -7.734
  116   HG21  VAL  12          3HG2      VAL  12  -0.230  -7.069  -7.394
  117   HG22  VAL  12          1HG2      VAL  12  -0.774  -6.389  -5.861
  118   HG23  VAL  12          2HG2      VAL  12   0.348  -7.749  -5.873
  119    H    GLY  13           H        GLY  13  -1.074  -7.745  -4.371
  120    HA2  GLY  13           2HA      GLY  13  -2.642  -6.564  -2.160
  121    HA3  GLY  13           3HA      GLY  13  -1.544  -7.916  -1.929
  122    H    ARG  14           H        ARG  14   0.694  -7.199  -3.239
  123    HA   ARG  14           HA       ARG  14   2.046  -5.563  -1.489
  124    HB2  ARG  14           2HB      ARG  14   3.673  -5.246  -3.480
  125    HB3  ARG  14           3HB      ARG  14   3.407  -6.866  -2.852
  126    HG2  ARG  14           2HG      ARG  14   1.501  -6.277  -4.918
  127    HG3  ARG  14           3HG      ARG  14   3.146  -5.995  -5.492
  128    HD2  ARG  14           2HD      ARG  14   2.246  -8.331  -5.820
  129    HD3  ARG  14           3HD      ARG  14   3.800  -8.212  -4.996
  130    HE   ARG  14           HE       ARG  14   2.130  -8.291  -2.926
  131   HH11  ARG  14          1HH1      ARG  14   2.247 -10.217  -5.824
  132   HH12  ARG  14          2HH1      ARG  14   1.582 -11.628  -5.069
  133   HH21  ARG  14          1HH2      ARG  14   1.254 -10.142  -1.921
  134   HH22  ARG  14          2HH2      ARG  14   1.017 -11.583  -2.849
  Start of MODEL   12
    1    H1   ARG   1           H        ARG   1   4.459  -0.731   0.016
    2    HA   ARG   1           HA       ARG   1   3.533  -2.359  -1.274
    3    HB2  ARG   1           2HB      ARG   1   1.680  -2.243   1.051
    4    HB3  ARG   1           3HB      ARG   1   1.134  -3.109  -0.379
    5    HG2  ARG   1           2HG      ARG   1   2.117  -4.779   0.862
    6    HG3  ARG   1           3HG      ARG   1   3.426  -4.307  -0.223
    7    HD2  ARG   1           2HD      ARG   1   3.507  -2.656   2.102
    8    HD3  ARG   1           3HD      ARG   1   3.413  -4.343   2.605
    9    HE   ARG   1           HE       ARG   1   5.335  -4.269   0.644
   10   HH11  ARG   1          1HH1      ARG   1   4.835  -2.743   3.732
   11   HH12  ARG   1          2HH1      ARG   1   6.526  -2.596   4.080
   12   HH21  ARG   1          1HH2      ARG   1   7.564  -4.082   1.090
   13   HH22  ARG   1          2HH2      ARG   1   8.077  -3.357   2.575
   14    H    GLY   2           H        GLY   2   3.358  -0.833  -2.997
   15    HA2  GLY   2           2HA      GLY   2   0.581   0.051  -3.496
   16    HA3  GLY   2           3HA      GLY   2   1.992   0.957  -4.023
   17    H    GLY   3           H        GLY   3   1.504  -2.541  -4.217
   18    HA2  GLY   3           2HA      GLY   3   1.934  -2.345  -7.115
   19    HA3  GLY   3           3HA      GLY   3   2.146  -3.791  -6.139
   20    H    ARG   4           H        ARG   4  -0.675  -1.768  -5.814
   21    HA   ARG   4           HA       ARG   4  -2.266  -3.860  -7.149
   22    HB2  ARG   4           2HB      ARG   4  -3.748  -2.283  -5.209
   23    HB3  ARG   4           3HB      ARG   4  -3.611  -4.029  -5.365
   24    HG2  ARG   4           2HG      ARG   4  -2.723  -3.665  -3.278
   25    HG3  ARG   4           3HG      ARG   4  -1.275  -3.680  -4.287
   26    HD2  ARG   4           2HD      ARG   4  -0.768  -1.683  -3.453
   27    HD3  ARG   4           3HD      ARG   4  -2.160  -1.036  -4.320
   28    HE   ARG   4           HE       ARG   4  -2.884  -2.174  -1.803
   29   HH11  ARG   4          1HH1      ARG   4  -1.562   0.660  -3.333
   30   HH12  ARG   4          2HH1      ARG   4  -2.070   1.736  -2.074
   31   HH21  ARG   4          1HH2      ARG   4  -3.558  -0.768  -0.139
   32   HH22  ARG   4          2HH2      ARG   4  -3.205   0.923  -0.257
   33    H    LEU   5           H        LEU   5  -1.220  -1.640  -8.520
   34    HA   LEU   5           HA       LEU   5  -3.670  -0.092  -9.055
   35    HB2  LEU   5           2HB      LEU   5  -0.797   0.739  -9.000
   36    HB3  LEU   5           3HB      LEU   5  -1.954   1.608 -10.007
   37    HG   LEU   5           HG       LEU   5  -1.629   2.771  -7.913
   38   HD11  LEU   5          1HD1      LEU   5  -4.299   1.592  -7.451
   39   HD12  LEU   5          2HD1      LEU   5  -3.999   2.278  -9.047
   40   HD13  LEU   5          3HD1      LEU   5  -3.811   3.280  -7.608
   41   HD21  LEU   5          3HD2      LEU   5  -2.897   0.714  -6.244
   42   HD22  LEU   5          1HD2      LEU   5  -1.563   1.811  -5.884
   43   HD23  LEU   5          2HD2      LEU   5  -1.264   0.328  -6.791
   44    H    TYR   6           H        TYR   6  -4.552  -0.860 -10.860
   45    HA   TYR   6           HA       TYR   6  -3.481  -2.443 -12.792
   46    HB2  TYR   6           2HB      TYR   6  -5.903  -1.375 -12.458
   47    HB3  TYR   6           3HB      TYR   6  -5.337  -0.320 -13.749
   48    HD1  TYR   6           HD2      TYR   6  -4.889  -1.209 -15.977
   49    HD2  TYR   6           HD1      TYR   6  -6.335  -3.722 -12.863
   50    HE1  TYR   6           HE2      TYR   6  -5.472  -2.925 -17.640
   51    HE2  TYR   6           HE1      TYR   6  -6.921  -5.445 -14.517
   52    HH   TYR   6           HH       TYR   6  -6.959  -6.002 -16.662
   53    H    ARG   7           H        ARG   7  -3.103   1.014 -12.456
   54    HA   ARG   7           HA       ARG   7  -2.241   1.795 -14.938
   55    HB2  ARG   7           2HB      ARG   7  -1.813   2.706 -12.190
   56    HB3  ARG   7           3HB      ARG   7  -0.494   3.127 -13.274
   57    HG2  ARG   7           2HG      ARG   7  -3.046   3.675 -14.496
   58    HG3  ARG   7           3HG      ARG   7  -2.896   4.485 -12.936
   59    HD2  ARG   7           2HD      ARG   7  -1.349   5.915 -13.700
   60    HD3  ARG   7           3HD      ARG   7  -0.489   4.653 -14.582
   61    HE   ARG   7           HE       ARG   7  -1.643   5.231 -16.478
   62   HH11  ARG   7          1HH1      ARG   7  -3.153   6.705 -13.709
   63   HH12  ARG   7          2HH1      ARG   7  -4.217   7.694 -14.653
   64   HH21  ARG   7          1HH2      ARG   7  -3.039   6.529 -17.731
   65   HH22  ARG   7          2HH2      ARG   7  -4.152   7.593 -16.940
   66    H    ARG   8           H        ARG   8  -0.199   0.455 -12.342
   67    HA   ARG   8           HA       ARG   8   1.829  -0.169 -14.386
   68    HB2  ARG   8           2HB      ARG   8   2.045   0.631 -11.509
   69    HB3  ARG   8           3HB      ARG   8   3.310  -0.357 -12.228
   70    HG2  ARG   8           2HG      ARG   8   3.253   1.499 -14.087
   71    HG3  ARG   8           3HG      ARG   8   2.559   2.463 -12.782
   72    HD2  ARG   8           2HD      ARG   8   5.006   0.874 -12.211
   73    HD3  ARG   8           3HD      ARG   8   5.171   2.333 -13.187
   74    HE   ARG   8           HE       ARG   8   3.724   3.163 -11.052
   75   HH11  ARG   8          1HH1      ARG   8   6.742   1.463 -11.403
   76   HH12  ARG   8          2HH1      ARG   8   7.420   2.098  -9.941
   77   HH21  ARG   8          1HH2      ARG   8   4.605   4.005  -9.124
   78   HH22  ARG   8          2HH2      ARG   8   6.203   3.543  -8.644
   79    H    ARG   9           H        ARG   9   0.569  -1.362 -11.269
   80    HA   ARG   9           HA       ARG   9   0.941  -4.102 -12.284
   81    HB2  ARG   9           2HB      ARG   9   1.448  -3.054  -9.497
   82    HB3  ARG   9           3HB      ARG   9   1.368  -4.764  -9.896
   83    HG2  ARG   9           2HG      ARG   9   3.292  -2.876 -11.221
   84    HG3  ARG   9           3HG      ARG   9   3.672  -3.756  -9.739
   85    HD2  ARG   9           2HD      ARG   9   2.667  -5.202 -12.161
   86    HD3  ARG   9           3HD      ARG   9   4.369  -4.762 -12.020
   87    HE   ARG   9           HE       ARG   9   2.986  -6.827 -10.577
   88   HH11  ARG   9          1HH1      ARG   9   5.707  -4.655 -10.563
   89   HH12  ARG   9          2HH1      ARG   9   6.652  -5.637  -9.494
   90   HH21  ARG   9          1HH2      ARG   9   4.221  -8.129  -9.168
   91   HH22  ARG   9          2HH2      ARG   9   5.806  -7.613  -8.702
   92    H    PHE  10           H        PHE  10  -0.963  -5.040 -12.564
   93    HA   PHE  10           HA       PHE  10  -3.439  -4.228 -12.013
   94    HB2  PHE  10           2HB      PHE  10  -3.593  -6.218 -13.092
   95    HB3  PHE  10           3HB      PHE  10  -2.224  -6.907 -12.227
   96    HD1  PHE  10           HD1      PHE  10  -5.707  -5.782 -11.491
   97    HD2  PHE  10           HD2      PHE  10  -2.665  -8.692 -10.865
   98    HE1  PHE  10           HE1      PHE  10  -7.255  -7.095 -10.101
   99    HE2  PHE  10           HE2      PHE  10  -4.208 -10.010  -9.475
  100    HZ   PHE  10           HZ       PHE  10  -6.506  -9.213  -9.091
  101    H    VAL  11           H        VAL  11  -4.981  -4.383 -10.365
  102    HA   VAL  11           HA       VAL  11  -4.043  -3.906  -7.754
  103    HB   VAL  11           HB       VAL  11  -6.138  -2.960  -8.372
  104   HG11  VAL  11          1HG1      VAL  11  -8.052  -4.192  -9.075
  105   HG12  VAL  11          2HG1      VAL  11  -6.687  -4.742 -10.050
  106   HG13  VAL  11          3HG1      VAL  11  -7.271  -5.730  -8.710
  107   HG21  VAL  11          3HG2      VAL  11  -7.266  -3.312  -6.425
  108   HG22  VAL  11          1HG2      VAL  11  -7.150  -5.068  -6.547
  109   HG23  VAL  11          2HG2      VAL  11  -5.757  -4.127  -6.013
  110    H    VAL  12           H        VAL  12  -2.686  -6.039  -7.974
  111    HA   VAL  12           HA       VAL  12  -3.890  -8.537  -7.538
  112    HB   VAL  12           HB       VAL  12  -1.620  -9.119  -6.484
  113   HG11  VAL  12          1HG1      VAL  12  -1.588  -7.987  -9.277
  114   HG12  VAL  12          2HG1      VAL  12  -0.570  -9.276  -8.634
  115   HG13  VAL  12          3HG1      VAL  12  -2.301  -9.540  -8.843
  116   HG21  VAL  12          3HG2      VAL  12  -0.007  -7.568  -6.253
  117   HG22  VAL  12          1HG2      VAL  12  -0.460  -6.731  -7.737
  118   HG23  VAL  12          2HG2      VAL  12  -1.352  -6.427  -6.246
  119    H    GLY  13           H        GLY  13  -1.686  -7.913  -5.022
  120    HA2  GLY  13           2HA      GLY  13  -3.893  -7.745  -3.066
  121    HA3  GLY  13           3HA      GLY  13  -2.556  -8.866  -2.854
  122    H    ARG  14           H        ARG  14  -0.335  -7.773  -2.908
  123    HA   ARG  14           HA       ARG  14  -0.059  -6.092  -0.747
  124    HB2  ARG  14           2HB      ARG  14   2.206  -5.507  -1.799
  125    HB3  ARG  14           3HB      ARG  14   1.881  -7.201  -1.456
  126    HG2  ARG  14           2HG      ARG  14   1.052  -6.418  -4.130
  127    HG3  ARG  14           3HG      ARG  14   2.775  -6.172  -3.839
  128    HD2  ARG  14           2HD      ARG  14   1.432  -8.740  -3.079
  129    HD3  ARG  14           3HD      ARG  14   1.975  -8.458  -4.733
  130    HE   ARG  14           HE       ARG  14   4.042  -7.916  -2.858
  131   HH11  ARG  14          1HH1      ARG  14   2.354 -10.507  -4.458
  132   HH12  ARG  14          2HH1      ARG  14   3.683 -11.613  -4.352
  133   HH21  ARG  14          1HH2      ARG  14   5.799  -9.363  -2.713
  134   HH22  ARG  14          2HH2      ARG  14   5.642 -10.961  -3.358
  Start of MODEL   13
    1    H1   ARG   1           H        ARG   1   0.782  -1.110   0.924
    2    HA   ARG   1           HA       ARG   1   3.157  -1.166  -0.457
    3    HB2  ARG   1           2HB      ARG   1   2.222  -3.800  -0.053
    4    HB3  ARG   1           3HB      ARG   1   1.935  -3.424  -1.746
    5    HG2  ARG   1           2HG      ARG   1   4.098  -4.472  -1.452
    6    HG3  ARG   1           3HG      ARG   1   4.286  -2.808  -2.008
    7    HD2  ARG   1           2HD      ARG   1   4.237  -2.969   0.880
    8    HD3  ARG   1           3HD      ARG   1   5.505  -3.986   0.197
    9    HE   ARG   1           HE       ARG   1   5.837  -1.658  -1.119
   10   HH11  ARG   1          1HH1      ARG   1   5.538  -2.447   2.258
   11   HH12  ARG   1          2HH1      ARG   1   6.528  -1.128   2.788
   12   HH21  ARG   1          1HH2      ARG   1   7.143   0.083  -0.434
   13   HH22  ARG   1          2HH2      ARG   1   7.439   0.311   1.256
   14    H    GLY   2           H        GLY   2   2.900  -0.850  -2.793
   15    HA2  GLY   2           2HA      GLY   2   0.151   0.008  -3.462
   16    HA3  GLY   2           3HA      GLY   2   1.582   0.904  -3.949
   17    H    GLY   3           H        GLY   3   1.107  -2.602  -4.038
   18    HA2  GLY   3           2HA      GLY   3   1.726  -2.524  -6.904
   19    HA3  GLY   3           3HA      GLY   3   1.829  -3.937  -5.864
   20    H    ARG   4           H        ARG   4  -0.960  -1.855  -5.789
   21    HA   ARG   4           HA       ARG   4  -2.500  -3.945  -7.184
   22    HB2  ARG   4           2HB      ARG   4  -4.083  -2.298  -5.392
   23    HB3  ARG   4           3HB      ARG   4  -3.959  -4.050  -5.488
   24    HG2  ARG   4           2HG      ARG   4  -3.214  -3.632  -3.355
   25    HG3  ARG   4           3HG      ARG   4  -1.700  -3.698  -4.260
   26    HD2  ARG   4           2HD      ARG   4  -1.214  -1.591  -3.734
   27    HD3  ARG   4           3HD      ARG   4  -2.793  -1.032  -4.285
   28    HE   ARG   4           HE       ARG   4  -2.905  -2.292  -1.720
   29   HH11  ARG   4          1HH1      ARG   4  -2.182   0.682  -3.378
   30   HH12  ARG   4          2HH1      ARG   4  -2.522   1.682  -2.004
   31   HH21  ARG   4          1HH2      ARG   4  -3.356  -0.987   0.095
   32   HH22  ARG   4          2HH2      ARG   4  -3.189   0.732  -0.029
   33    H    LEU   5           H        LEU   5  -1.317  -1.783  -8.533
   34    HA   LEU   5           HA       LEU   5  -3.690  -0.198  -9.267
   35    HB2  LEU   5           2HB      LEU   5  -0.886   0.737  -9.738
   36    HB3  LEU   5           3HB      LEU   5  -2.374   1.680  -9.682
   37    HG   LEU   5           HG       LEU   5  -0.995   0.427  -7.308
   38   HD11  LEU   5          1HD1      LEU   5  -0.319   2.623  -6.701
   39   HD12  LEU   5          2HD1      LEU   5  -1.251   3.341  -8.014
   40   HD13  LEU   5          3HD1      LEU   5   0.175   2.369  -8.375
   41   HD21  LEU   5          3HD2      LEU   5  -3.352   0.500  -6.914
   42   HD22  LEU   5          1HD2      LEU   5  -3.459   2.145  -7.542
   43   HD23  LEU   5          2HD2      LEU   5  -2.611   1.833  -6.027
   44    H    TYR   6           H        TYR   6  -4.469  -1.027 -11.095
   45    HA   TYR   6           HA       TYR   6  -3.307  -2.669 -12.916
   46    HB2  TYR   6           2HB      TYR   6  -5.725  -1.563 -12.768
   47    HB3  TYR   6           3HB      TYR   6  -5.062  -0.536 -14.035
   48    HD1  TYR   6           HD2      TYR   6  -4.491  -1.462 -16.217
   49    HD2  TYR   6           HD1      TYR   6  -6.155  -3.914 -13.164
   50    HE1  TYR   6           HE2      TYR   6  -4.989  -3.196 -17.889
   51    HE2  TYR   6           HE1      TYR   6  -6.656  -5.656 -14.827
   52    HH   TYR   6           HH       TYR   6  -5.336  -6.010 -17.572
   53    H    ARG   7           H        ARG   7  -2.908   0.797 -12.666
   54    HA   ARG   7           HA       ARG   7  -1.865   1.486 -15.102
   55    HB2  ARG   7           2HB      ARG   7  -1.018   2.386 -12.348
   56    HB3  ARG   7           3HB      ARG   7  -0.448   3.143 -13.829
   57    HG2  ARG   7           2HG      ARG   7  -2.517   4.042 -14.325
   58    HG3  ARG   7           3HG      ARG   7  -3.377   2.874 -13.319
   59    HD2  ARG   7           2HD      ARG   7  -3.502   4.750 -12.003
   60    HD3  ARG   7           3HD      ARG   7  -2.028   4.008 -11.383
   61    HE   ARG   7           HE       ARG   7  -0.862   5.815 -12.142
   62   HH11  ARG   7          1HH1      ARG   7  -3.920   5.684 -13.801
   63   HH12  ARG   7          2HH1      ARG   7  -3.694   7.199 -14.610
   64   HH21  ARG   7          1HH2      ARG   7  -0.553   7.811 -13.201
   65   HH22  ARG   7          2HH2      ARG   7  -1.778   8.408 -14.269
   66    H    ARG   8           H        ARG   8  -0.028   0.190 -12.337
   67    HA   ARG   8           HA       ARG   8   2.128  -0.515 -14.217
   68    HB2  ARG   8           2HB      ARG   8   2.419  -0.220 -11.230
   69    HB3  ARG   8           3HB      ARG   8   3.696  -0.312 -12.435
   70    HG2  ARG   8           2HG      ARG   8   2.559   1.868 -13.349
   71    HG3  ARG   8           3HG      ARG   8   1.942   1.974 -11.699
   72    HD2  ARG   8           2HD      ARG   8   4.829   1.814 -12.552
   73    HD3  ARG   8           3HD      ARG   8   4.004   3.213 -11.867
   74    HE   ARG   8           HE       ARG   8   3.712   1.251  -9.989
   75   HH11  ARG   8          1HH1      ARG   8   6.412   2.736 -11.610
   76   HH12  ARG   8          2HH1      ARG   8   7.501   2.511 -10.281
   77   HH21  ARG   8          1HH2      ARG   8   5.136   0.949  -8.233
   78   HH22  ARG   8          2HH2      ARG   8   6.774   1.494  -8.361
   79    H    ARG   9           H        ARG   9   0.644  -1.608 -11.162
   80    HA   ARG   9           HA       ARG   9   1.035  -4.379 -12.083
   81    HB2  ARG   9           2HB      ARG   9   1.133  -3.524  -9.192
   82    HB3  ARG   9           3HB      ARG   9   1.575  -5.085  -9.871
   83    HG2  ARG   9           2HG      ARG   9   3.251  -3.398 -11.206
   84    HG3  ARG   9           3HG      ARG   9   3.138  -2.632  -9.621
   85    HD2  ARG   9           2HD      ARG   9   4.643  -4.101  -8.897
   86    HD3  ARG   9           3HD      ARG   9   3.414  -5.351  -9.087
   87    HE   ARG   9           HE       ARG   9   4.473  -5.134 -11.569
   88   HH11  ARG   9          1HH1      ARG   9   5.845  -5.616  -8.405
   89   HH12  ARG   9          2HH1      ARG   9   7.195  -6.533  -8.987
   90   HH21  ARG   9          1HH2      ARG   9   6.246  -6.341 -12.347
   91   HH22  ARG   9          2HH2      ARG   9   7.422  -6.944 -11.229
   92    H    PHE  10           H        PHE  10  -0.860  -5.300 -12.459
   93    HA   PHE  10           HA       PHE  10  -3.354  -4.438 -12.098
   94    HB2  PHE  10           2HB      PHE  10  -3.466  -6.457 -13.128
   95    HB3  PHE  10           3HB      PHE  10  -2.170  -7.140 -12.152
   96    HD1  PHE  10           HD1      PHE  10  -5.675  -5.938 -11.684
   97    HD2  PHE  10           HD2      PHE  10  -2.734  -8.879 -10.776
   98    HE1  PHE  10           HE1      PHE  10  -7.335  -7.187 -10.365
   99    HE2  PHE  10           HE2      PHE  10  -4.390 -10.132  -9.457
  100    HZ   PHE  10           HZ       PHE  10  -6.694  -9.287  -9.250
  101    H    VAL  11           H        VAL  11  -5.004  -4.521 -10.553
  102    HA   VAL  11           HA       VAL  11  -4.232  -3.981  -7.899
  103    HB   VAL  11           HB       VAL  11  -6.265  -3.021  -8.684
  104   HG11  VAL  11          1HG1      VAL  11  -7.421  -5.782  -9.014
  105   HG12  VAL  11          2HG1      VAL  11  -8.149  -4.243  -9.478
  106   HG13  VAL  11          3HG1      VAL  11  -6.733  -4.846 -10.340
  107   HG21  VAL  11          3HG2      VAL  11  -7.525  -3.296  -6.807
  108   HG22  VAL  11          1HG2      VAL  11  -7.431  -5.056  -6.868
  109   HG23  VAL  11          2HG2      VAL  11  -6.060  -4.120  -6.272
  110    H    VAL  12           H        VAL  12  -2.903  -6.142  -7.970
  111    HA   VAL  12           HA       VAL  12  -4.176  -8.606  -7.545
  112    HB   VAL  12           HB       VAL  12  -1.993  -9.193  -6.324
  113   HG11  VAL  12          1HG1      VAL  12  -1.753  -8.144  -9.140
  114   HG12  VAL  12          2HG1      VAL  12  -0.804  -9.431  -8.393
  115   HG13  VAL  12          3HG1      VAL  12  -2.522  -9.671  -8.711
  116   HG21  VAL  12          3HG2      VAL  12  -0.397  -7.652  -5.994
  117   HG22  VAL  12          1HG2      VAL  12  -0.677  -6.890  -7.560
  118   HG23  VAL  12          2HG2      VAL  12  -1.701  -6.480  -6.183
  119    H    GLY  13           H        GLY  13  -2.135  -7.944  -4.904
  120    HA2  GLY  13           2HA      GLY  13  -4.465  -7.685  -3.107
  121    HA3  GLY  13           3HA      GLY  13  -3.165  -8.819  -2.774
  122    H    ARG  14           H        ARG  14  -0.927  -7.764  -2.707
  123    HA   ARG  14           HA       ARG  14  -0.768  -6.024  -0.581
  124    HB2  ARG  14           2HB      ARG  14   1.573  -5.507  -1.494
  125    HB3  ARG  14           3HB      ARG  14   1.196  -7.184  -1.125
  126    HG2  ARG  14           2HG      ARG  14   0.533  -6.534  -3.860
  127    HG3  ARG  14           3HG      ARG  14   2.225  -6.185  -3.497
  128    HD2  ARG  14           2HD      ARG  14   2.186  -8.540  -2.386
  129    HD3  ARG  14           3HD      ARG  14   0.758  -8.787  -3.390
  130    HE   ARG  14           HE       ARG  14   2.654  -7.839  -5.112
  131   HH11  ARG  14          1HH1      ARG  14   2.446 -10.518  -2.898
  132   HH12  ARG  14          2HH1      ARG  14   3.489 -11.539  -3.831
  133   HH21  ARG  14          1HH2      ARG  14   4.029  -9.174  -6.349
  134   HH22  ARG  14          2HH2      ARG  14   4.390 -10.773  -5.793
  Start of MODEL   14
    1    H1   ARG   1           H        ARG   1   5.744   0.183  -2.424
    2    HA   ARG   1           HA       ARG   1   4.481  -1.709  -2.454
    3    HB2  ARG   1           2HB      ARG   1   2.679  -1.821  -0.646
    4    HB3  ARG   1           3HB      ARG   1   4.334  -1.567  -0.110
    5    HG2  ARG   1           2HG      ARG   1   3.906   0.497   0.682
    6    HG3  ARG   1           3HG      ARG   1   2.760   0.871  -0.606
    7    HD2  ARG   1           2HD      ARG   1   1.011   0.242   0.633
    8    HD3  ARG   1           3HD      ARG   1   1.814  -1.237   1.157
    9    HE   ARG   1           HE       ARG   1   2.950   0.935   2.516
   10   HH11  ARG   1          1HH1      ARG   1  -0.042  -0.837   2.344
   11   HH12  ARG   1          2HH1      ARG   1  -0.480  -0.512   3.988
   12   HH21  ARG   1          1HH2      ARG   1   2.385   1.369   4.682
   13   HH22  ARG   1          2HH2      ARG   1   0.901   0.743   5.317
   14    H    GLY   2           H        GLY   2   3.823  -0.711  -4.616
   15    HA2  GLY   2           2HA      GLY   2   0.918  -0.180  -4.633
   16    HA3  GLY   2           3HA      GLY   2   2.041   0.417  -5.846
   17    H    GLY   3           H        GLY   3   2.016  -2.849  -4.524
   18    HA2  GLY   3           2HA      GLY   3   2.037  -4.010  -7.123
   19    HA3  GLY   3           3HA      GLY   3   1.884  -4.877  -5.602
   20    H    ARG   4           H        ARG   4  -0.499  -2.978  -5.068
   21    HA   ARG   4           HA       ARG   4  -2.448  -4.663  -6.476
   22    HB2  ARG   4           2HB      ARG   4  -4.027  -3.691  -4.696
   23    HB3  ARG   4           3HB      ARG   4  -2.819  -4.856  -4.172
   24    HG2  ARG   4           2HG      ARG   4  -1.833  -3.386  -2.821
   25    HG3  ARG   4           3HG      ARG   4  -1.871  -2.110  -4.040
   26    HD2  ARG   4           2HD      ARG   4  -4.115  -1.533  -3.471
   27    HD3  ARG   4           3HD      ARG   4  -4.278  -2.953  -2.439
   28    HE   ARG   4           HE       ARG   4  -3.073  -0.442  -1.750
   29   HH11  ARG   4          1HH1      ARG   4  -3.139  -3.856  -1.067
   30   HH12  ARG   4          2HH1      ARG   4  -2.551  -3.676   0.552
   31   HH21  ARG   4          1HH2      ARG   4  -2.298  -0.192   0.381
   32   HH22  ARG   4          2HH2      ARG   4  -2.074  -1.591   1.375
   33    H    LEU   5           H        LEU   5  -1.195  -2.477  -7.823
   34    HA   LEU   5           HA       LEU   5  -3.557  -0.787  -8.293
   35    HB2  LEU   5           2HB      LEU   5  -0.674   0.044  -8.105
   36    HB3  LEU   5           3HB      LEU   5  -1.897   1.037  -8.895
   37    HG   LEU   5           HG       LEU   5  -3.142   0.938  -6.650
   38   HD11  LEU   5          1HD1      LEU   5  -2.245  -0.250  -5.011
   39   HD12  LEU   5          2HD1      LEU   5  -0.823   0.791  -5.045
   40   HD13  LEU   5          3HD1      LEU   5  -0.872  -0.668  -6.035
   41   HD21  LEU   5          3HD2      LEU   5  -2.175   2.937  -6.011
   42   HD22  LEU   5          1HD2      LEU   5  -1.717   2.834  -7.712
   43   HD23  LEU   5          2HD2      LEU   5  -0.549   2.415  -6.457
   44    H    TYR   6           H        TYR   6  -4.309  -1.411 -10.211
   45    HA   TYR   6           HA       TYR   6  -2.927  -2.733 -12.214
   46    HB2  TYR   6           2HB      TYR   6  -5.493  -2.219 -11.877
   47    HB3  TYR   6           3HB      TYR   6  -5.149  -0.877 -12.962
   48    HD1  TYR   6           HD1      TYR   6  -4.403  -1.311 -15.274
   49    HD2  TYR   6           HD2      TYR   6  -5.549  -4.479 -12.674
   50    HE1  TYR   6           HE1      TYR   6  -4.611  -2.816 -17.209
   51    HE2  TYR   6           HE2      TYR   6  -5.760  -5.992 -14.602
   52    HH   TYR   6           HH       TYR   6  -4.659  -5.108 -17.762
   53    H    ARG   7           H        ARG   7  -2.862   0.588 -11.366
   54    HA   ARG   7           HA       ARG   7  -2.362   1.987 -13.628
   55    HB2  ARG   7           2HB      ARG   7  -1.493   2.185 -10.848
   56    HB3  ARG   7           3HB      ARG   7  -0.346   2.903 -11.971
   57    HG2  ARG   7           2HG      ARG   7  -3.194   3.592 -12.357
   58    HG3  ARG   7           3HG      ARG   7  -2.395   4.246 -10.926
   59    HD2  ARG   7           2HD      ARG   7  -1.430   4.532 -13.770
   60    HD3  ARG   7           3HD      ARG   7  -2.252   5.779 -12.834
   61    HE   ARG   7           HE       ARG   7   0.054   4.863 -11.469
   62   HH11  ARG   7          1HH1      ARG   7  -0.948   6.835 -14.157
   63   HH12  ARG   7          2HH1      ARG   7   0.450   7.857 -14.097
   64   HH21  ARG   7          1HH2      ARG   7   1.900   6.200 -11.380
   65   HH22  ARG   7          2HH2      ARG   7   2.070   7.494 -12.518
   66    H    ARG   8           H        ARG   8  -0.141  -0.241 -12.032
   67    HA   ARG   8           HA       ARG   8   1.709   0.062 -14.304
   68    HB2  ARG   8           2HB      ARG   8   2.179  -0.648 -11.420
   69    HB3  ARG   8           3HB      ARG   8   3.355  -1.057 -12.662
   70    HG2  ARG   8           2HG      ARG   8   2.351   1.745 -12.331
   71    HG3  ARG   8           3HG      ARG   8   3.681   1.116 -11.356
   72    HD2  ARG   8           2HD      ARG   8   4.553   0.367 -13.757
   73    HD3  ARG   8           3HD      ARG   8   3.570   1.745 -14.252
   74    HE   ARG   8           HE       ARG   8   5.378   2.297 -12.078
   75   HH11  ARG   8          1HH1      ARG   8   4.965   2.209 -15.533
   76   HH12  ARG   8          2HH1      ARG   8   6.235   3.345 -15.845
   77   HH21  ARG   8          1HH2      ARG   8   7.052   3.795 -12.475
   78   HH22  ARG   8          2HH2      ARG   8   7.422   4.246 -14.105
   79    H    ARG   9           H        ARG   9   0.364  -2.326 -12.038
   80    HA   ARG   9           HA       ARG   9   0.639  -4.351 -14.159
   81    HB2  ARG   9           2HB      ARG   9   0.765  -5.933 -12.029
   82    HB3  ARG   9           3HB      ARG   9   2.202  -5.193 -12.720
   83    HG2  ARG   9           2HG      ARG   9   0.776  -3.660 -10.631
   84    HG3  ARG   9           3HG      ARG   9   1.641  -5.111 -10.122
   85    HD2  ARG   9           2HD      ARG   9   3.372  -3.772 -11.865
   86    HD3  ARG   9           3HD      ARG   9   2.671  -2.520 -10.841
   87    HE   ARG   9           HE       ARG   9   3.885  -3.336  -9.088
   88   HH11  ARG   9          1HH1      ARG   9   3.738  -5.762 -11.581
   89   HH12  ARG   9          2HH1      ARG   9   4.847  -6.831 -10.788
   90   HH21  ARG   9          1HH2      ARG   9   5.346  -4.735  -8.034
   91   HH22  ARG   9          2HH2      ARG   9   5.760  -6.246  -8.770
   92    H    PHE  10           H        PHE  10  -0.667  -5.185 -11.079
   93    HA   PHE  10           HA       PHE  10  -3.416  -4.792 -11.984
   94    HB2  PHE  10           2HB      PHE  10  -2.885  -7.027 -12.769
   95    HB3  PHE  10           3HB      PHE  10  -2.268  -7.472 -11.181
   96    HD1  PHE  10           HD2      PHE  10  -3.989  -7.217  -9.214
   97    HD2  PHE  10           HD1      PHE  10  -5.041  -7.592 -13.322
   98    HE1  PHE  10           HE2      PHE  10  -6.228  -8.002  -8.566
   99    HE2  PHE  10           HE1      PHE  10  -7.283  -8.377 -12.679
  100    HZ   PHE  10           HZ       PHE  10  -7.879  -8.583 -10.299
  101    H    VAL  11           H        VAL  11  -4.966  -4.808 -10.311
  102    HA   VAL  11           HA       VAL  11  -3.950  -3.919  -7.782
  103    HB   VAL  11           HB       VAL  11  -6.424  -3.878  -7.161
  104   HG11  VAL  11          1HG1      VAL  11  -4.847  -2.161  -8.737
  105   HG12  VAL  11          2HG1      VAL  11  -6.456  -2.173  -9.460
  106   HG13  VAL  11          3HG1      VAL  11  -6.255  -1.747  -7.760
  107   HG21  VAL  11          3HG2      VAL  11  -6.851  -4.278 -10.111
  108   HG22  VAL  11          1HG2      VAL  11  -6.992  -5.595  -8.946
  109   HG23  VAL  11          2HG2      VAL  11  -8.059  -4.196  -8.828
  110    H    VAL  12           H        VAL  12  -2.884  -6.285  -7.830
  111    HA   VAL  12           HA       VAL  12  -4.532  -8.405  -6.854
  112    HB   VAL  12           HB       VAL  12  -2.279  -9.452  -6.254
  113   HG11  VAL  12          1HG1      VAL  12  -2.578  -8.620  -9.132
  114   HG12  VAL  12          2HG1      VAL  12  -1.872 -10.109  -8.500
  115   HG13  VAL  12          3HG1      VAL  12  -3.607  -9.825  -8.359
  116   HG21  VAL  12          3HG2      VAL  12  -0.936  -7.542  -8.045
  117   HG22  VAL  12          1HG2      VAL  12  -1.330  -6.927  -6.440
  118   HG23  VAL  12          2HG2      VAL  12  -0.333  -8.372  -6.611
  119    H    GLY  13           H        GLY  13  -1.709  -8.186  -5.009
  120    HA2  GLY  13           2HA      GLY  13  -3.261  -7.247  -2.675
  121    HA3  GLY  13           3HA      GLY  13  -2.128  -8.587  -2.588
  122    H    ARG  14           H        ARG  14   0.152  -7.942  -3.443
  123    HA   ARG  14           HA       ARG  14   1.309  -6.190  -1.671
  124    HB2  ARG  14           2HB      ARG  14   3.213  -6.083  -3.386
  125    HB3  ARG  14           3HB      ARG  14   2.760  -7.668  -2.773
  126    HG2  ARG  14           2HG      ARG  14   1.260  -6.986  -5.145
  127    HG3  ARG  14           3HG      ARG  14   3.000  -6.913  -5.427
  128    HD2  ARG  14           2HD      ARG  14   1.804  -9.249  -3.994
  129    HD3  ARG  14           3HD      ARG  14   1.731  -9.160  -5.753
  130    HE   ARG  14           HE       ARG  14   4.351  -8.695  -5.167
  131   HH11  ARG  14          1HH1      ARG  14   2.083 -11.226  -4.411
  132   HH12  ARG  14          2HH1      ARG  14   3.292 -12.466  -4.336
  133   HH21  ARG  14          1HH2      ARG  14   5.951 -10.318  -5.071
  134   HH22  ARG  14          2HH2      ARG  14   5.492 -11.947  -4.711
  Start of MODEL   15
    1    H1   ARG   1           H        ARG   1   5.008   0.276  -3.054
    2    HA   ARG   1           HA       ARG   1   4.351  -2.491  -2.589
    3    HB2  ARG   1           2HB      ARG   1   2.511  -1.833  -0.938
    4    HB3  ARG   1           3HB      ARG   1   4.159  -1.883  -0.326
    5    HG2  ARG   1           2HG      ARG   1   4.306   0.411  -0.146
    6    HG3  ARG   1           3HG      ARG   1   3.025   0.689  -1.328
    7    HD2  ARG   1           2HD      ARG   1   1.525  -0.511   0.436
    8    HD3  ARG   1           3HD      ARG   1   2.818  -0.077   1.553
    9    HE   ARG   1           HE       ARG   1   1.920   2.139  -0.020
   10   HH11  ARG   1          1HH1      ARG   1   1.266   0.229   2.816
   11   HH12  ARG   1          2HH1      ARG   1   0.410   1.496   3.631
   12   HH21  ARG   1          1HH2      ARG   1   0.795   3.815   1.043
   13   HH22  ARG   1          2HH2      ARG   1   0.142   3.535   2.621
   14    H    GLY   2           H        GLY   2   4.201  -1.171  -4.931
   15    HA2  GLY   2           2HA      GLY   2   1.410  -0.309  -5.248
   16    HA3  GLY   2           3HA      GLY   2   2.705  -0.036  -6.404
   17    H    GLY   3           H        GLY   3   2.524  -3.177  -5.026
   18    HA2  GLY   3           2HA      GLY   3   2.224  -4.446  -7.518
   19    HA3  GLY   3           3HA      GLY   3   2.053  -5.223  -5.951
   20    H    ARG   4           H        ARG   4  -0.120  -3.096  -5.416
   21    HA   ARG   4           HA       ARG   4  -2.271  -4.638  -6.689
   22    HB2  ARG   4           2HB      ARG   4  -3.680  -3.477  -4.879
   23    HB3  ARG   4           3HB      ARG   4  -2.565  -4.738  -4.369
   24    HG2  ARG   4           2HG      ARG   4  -1.388  -3.335  -3.102
   25    HG3  ARG   4           3HG      ARG   4  -1.364  -2.089  -4.352
   26    HD2  ARG   4           2HD      ARG   4  -3.522  -1.300  -3.707
   27    HD3  ARG   4           3HD      ARG   4  -3.762  -2.671  -2.626
   28    HE   ARG   4           HE       ARG   4  -1.468  -1.111  -1.932
   29   HH11  ARG   4          1HH1      ARG   4  -4.931  -1.324  -1.648
   30   HH12  ARG   4          2HH1      ARG   4  -4.998  -0.403  -0.182
   31   HH21  ARG   4          1HH2      ARG   4  -1.543   0.103  -0.002
   32   HH22  ARG   4          2HH2      ARG   4  -3.071   0.409   0.753
   33    H    LEU   5           H        LEU   5  -0.887  -2.619  -8.155
   34    HA   LEU   5           HA       LEU   5  -3.100  -0.726  -8.577
   35    HB2  LEU   5           2HB      LEU   5  -0.227   0.014  -9.022
   36    HB3  LEU   5           3HB      LEU   5  -1.633   1.074  -8.927
   37    HG   LEU   5           HG       LEU   5  -0.488  -0.452  -6.589
   38   HD11  LEU   5          1HD1      LEU   5  -0.238   2.500  -7.047
   39   HD12  LEU   5          2HD1      LEU   5   0.974   1.368  -7.646
   40   HD13  LEU   5          3HD1      LEU   5   0.643   1.472  -5.917
   41   HD21  LEU   5          3HD2      LEU   5  -2.395   0.096  -5.593
   42   HD22  LEU   5          1HD2      LEU   5  -2.935   0.991  -7.014
   43   HD23  LEU   5          2HD2      LEU   5  -1.959   1.795  -5.784
   44    H    TYR   6           H        TYR   6  -3.995  -1.359 -10.433
   45    HA   TYR   6           HA       TYR   6  -2.827  -2.847 -12.453
   46    HB2  TYR   6           2HB      TYR   6  -5.324  -2.050 -12.007
   47    HB3  TYR   6           3HB      TYR   6  -4.897  -0.837 -13.209
   48    HD1  TYR   6           HD1      TYR   6  -4.311  -1.522 -15.506
   49    HD2  TYR   6           HD2      TYR   6  -5.652  -4.344 -12.619
   50    HE1  TYR   6           HE1      TYR   6  -4.766  -3.136 -17.305
   51    HE2  TYR   6           HE2      TYR   6  -6.110  -5.967 -14.409
   52    HH   TYR   6           HH       TYR   6  -5.001  -6.188 -17.021
   53    H    ARG   7           H        ARG   7  -2.448   0.485 -11.724
   54    HA   ARG   7           HA       ARG   7  -1.929   1.760 -14.053
   55    HB2  ARG   7           2HB      ARG   7  -0.921   1.973 -11.318
   56    HB3  ARG   7           3HB      ARG   7   0.221   2.564 -12.517
   57    HG2  ARG   7           2HG      ARG   7  -1.299   4.182 -13.313
   58    HG3  ARG   7           3HG      ARG   7  -2.648   3.445 -12.447
   59    HD2  ARG   7           2HD      ARG   7  -1.538   4.014 -10.313
   60    HD3  ARG   7           3HD      ARG   7  -0.262   4.824 -11.221
   61    HE   ARG   7           HE       ARG   7  -2.822   5.840 -11.916
   62   HH11  ARG   7          1HH1      ARG   7  -0.376   5.945  -9.440
   63   HH12  ARG   7          2HH1      ARG   7  -0.814   7.529  -8.892
   64   HH21  ARG   7          1HH2      ARG   7  -3.408   7.926 -11.203
   65   HH22  ARG   7          2HH2      ARG   7  -2.539   8.655  -9.895
   66    H    ARG   8           H        ARG   8   0.163  -0.595 -12.466
   67    HA   ARG   8           HA       ARG   8   1.936  -0.524 -14.817
   68    HB2  ARG   8           2HB      ARG   8   2.458  -1.134 -11.924
   69    HB3  ARG   8           3HB      ARG   8   3.528  -1.754 -13.174
   70    HG2  ARG   8           2HG      ARG   8   4.069   0.467 -13.897
   71    HG3  ARG   8           3HG      ARG   8   2.866   1.158 -12.807
   72    HD2  ARG   8           2HD      ARG   8   4.668  -0.538 -11.350
   73    HD3  ARG   8           3HD      ARG   8   5.577   0.652 -12.282
   74    HE   ARG   8           HE       ARG   8   3.493   1.983 -10.992
   75   HH11  ARG   8          1HH1      ARG   8   6.405   0.252 -10.189
   76   HH12  ARG   8          2HH1      ARG   8   6.688   1.143  -8.731
   77   HH21  ARG   8          1HH2      ARG   8   3.856   3.165  -9.074
   78   HH22  ARG   8          2HH2      ARG   8   5.238   2.800  -8.097
   79    H    ARG   9           H        ARG   9   0.489  -2.714 -12.417
   80    HA   ARG   9           HA       ARG   9   0.507  -4.823 -14.473
   81    HB2  ARG   9           2HB      ARG   9   0.588  -6.341 -12.296
   82    HB3  ARG   9           3HB      ARG   9   2.053  -5.746 -13.065
   83    HG2  ARG   9           2HG      ARG   9   0.834  -4.045 -10.970
   84    HG3  ARG   9           3HG      ARG   9   1.621  -5.538 -10.456
   85    HD2  ARG   9           2HD      ARG   9   3.271  -4.211 -12.377
   86    HD3  ARG   9           3HD      ARG   9   2.819  -3.068 -11.112
   87    HE   ARG   9           HE       ARG   9   3.633  -5.457  -9.903
   88   HH11  ARG   9          1HH1      ARG   9   4.962  -2.832 -11.764
   89   HH12  ARG   9          2HH1      ARG   9   6.543  -2.968 -11.069
   90   HH21  ARG   9          1HH2      ARG   9   5.710  -5.646  -8.980
   91   HH22  ARG   9          2HH2      ARG   9   6.968  -4.570  -9.486
   92    H    PHE  10           H        PHE  10  -0.736  -5.445 -11.319
   93    HA   PHE  10           HA       PHE  10  -3.478  -4.848 -12.130
   94    HB2  PHE  10           2HB      PHE  10  -3.163  -7.145 -12.857
   95    HB3  PHE  10           3HB      PHE  10  -2.530  -7.590 -11.275
   96    HD1  PHE  10           HD2      PHE  10  -4.153  -7.120  -9.264
   97    HD2  PHE  10           HD1      PHE  10  -5.377  -7.542 -13.319
   98    HE1  PHE  10           HE2      PHE  10  -6.426  -7.687  -8.515
   99    HE2  PHE  10           HE1      PHE  10  -7.653  -8.109 -12.576
  100    HZ   PHE  10           HZ       PHE  10  -8.180  -8.183 -10.171
  101    H    VAL  11           H        VAL  11  -4.951  -4.670 -10.402
  102    HA   VAL  11           HA       VAL  11  -3.757  -3.803  -7.942
  103    HB   VAL  11           HB       VAL  11  -6.193  -3.518  -7.234
  104   HG11  VAL  11          1HG1      VAL  11  -4.521  -1.993  -8.899
  105   HG12  VAL  11          2HG1      VAL  11  -6.144  -1.878  -9.583
  106   HG13  VAL  11          3HG1      VAL  11  -5.860  -1.427  -7.902
  107   HG21  VAL  11          3HG2      VAL  11  -6.642  -5.123  -9.461
  108   HG22  VAL  11          1HG2      VAL  11  -7.855  -4.254  -8.520
  109   HG23  VAL  11          2HG2      VAL  11  -7.157  -3.512  -9.960
  110    H    VAL  12           H        VAL  12  -2.916  -6.259  -7.952
  111    HA   VAL  12           HA       VAL  12  -4.713  -8.185  -6.846
  112    HB   VAL  12           HB       VAL  12  -2.544  -9.421  -6.298
  113   HG11  VAL  12          1HG1      VAL  12  -2.876  -8.652  -9.189
  114   HG12  VAL  12          2HG1      VAL  12  -2.298 -10.184  -8.531
  115   HG13  VAL  12          3HG1      VAL  12  -3.990  -9.723  -8.340
  116   HG21  VAL  12          3HG2      VAL  12  -0.523  -8.540  -6.767
  117   HG22  VAL  12          1HG2      VAL  12  -1.107  -7.699  -8.203
  118   HG23  VAL  12          2HG2      VAL  12  -1.371  -7.003  -6.604
  119    H    GLY  13           H        GLY  13  -1.806  -8.176  -5.119
  120    HA2  GLY  13           2HA      GLY  13  -3.169  -7.031  -2.758
  121    HA3  GLY  13           3HA      GLY  13  -2.158  -8.466  -2.672
  122    H    ARG  14           H        ARG  14   0.132  -8.054  -3.641
  123    HA   ARG  14           HA       ARG  14   1.515  -6.364  -1.972
  124    HB2  ARG  14           2HB      ARG  14   3.348  -6.483  -3.763
  125    HB3  ARG  14           3HB      ARG  14   2.781  -8.000  -3.078
  126    HG2  ARG  14           2HG      ARG  14   1.247  -7.262  -5.410
  127    HG3  ARG  14           3HG      ARG  14   2.973  -7.347  -5.766
  128    HD2  ARG  14           2HD      ARG  14   1.576  -9.523  -4.246
  129    HD3  ARG  14           3HD      ARG  14   1.574  -9.488  -6.008
  130    HE   ARG  14           HE       ARG  14   4.203  -9.231  -5.316
  131   HH11  ARG  14          1HH1      ARG  14   1.687 -11.541  -4.645
  132   HH12  ARG  14          2HH1      ARG  14   2.775 -12.882  -4.503
  133   HH21  ARG  14          1HH2      ARG  14   5.647 -10.988  -5.131
  134   HH22  ARG  14          2HH2      ARG  14   5.027 -12.566  -4.778
  Start of MODEL   16
    1    H1   ARG   1           H        ARG   1   3.947   2.122  -2.780
    2    HA   ARG   1           HA       ARG   1   4.448  -0.538  -2.908
    3    HB2  ARG   1           2HB      ARG   1   2.863   0.128  -0.501
    4    HB3  ARG   1           3HB      ARG   1   2.273  -1.226  -1.455
    5    HG2  ARG   1           2HG      ARG   1   4.653  -2.132  -1.330
    6    HG3  ARG   1           3HG      ARG   1   4.911  -0.930  -0.064
    7    HD2  ARG   1           2HD      ARG   1   3.066  -1.880   1.222
    8    HD3  ARG   1           3HD      ARG   1   2.782  -3.066  -0.051
    9    HE   ARG   1           HE       ARG   1   5.379  -3.462   0.624
   10   HH11  ARG   1          1HH1      ARG   1   2.405  -3.344   2.429
   11   HH12  ARG   1          2HH1      ARG   1   2.945  -4.455   3.643
   12   HH21  ARG   1          1HH2      ARG   1   6.102  -4.927   2.217
   13   HH22  ARG   1          2HH2      ARG   1   5.049  -5.354   3.522
   14    H    GLY   2           H        GLY   2   3.833   0.254  -5.012
   15    HA2  GLY   2           2HA      GLY   2   0.962   0.690  -5.419
   16    HA3  GLY   2           3HA      GLY   2   2.231   1.018  -6.589
   17    H    GLY   3           H        GLY   3   2.402  -1.988  -4.932
   18    HA2  GLY   3           2HA      GLY   3   2.323  -3.508  -7.293
   19    HA3  GLY   3           3HA      GLY   3   2.181  -4.152  -5.664
   20    H    ARG   4           H        ARG   4  -0.232  -2.255  -5.379
   21    HA   ARG   4           HA       ARG   4  -2.151  -4.140  -6.556
   22    HB2  ARG   4           2HB      ARG   4  -3.745  -2.976  -4.907
   23    HB3  ARG   4           3HB      ARG   4  -2.520  -4.052  -4.247
   24    HG2  ARG   4           2HG      ARG   4  -1.546  -2.412  -3.095
   25    HG3  ARG   4           3HG      ARG   4  -1.616  -1.294  -4.458
   26    HD2  ARG   4           2HD      ARG   4  -2.950  -0.349  -2.747
   27    HD3  ARG   4           3HD      ARG   4  -4.066  -1.004  -3.945
   28    HE   ARG   4           HE       ARG   4  -3.526  -2.891  -1.888
   29   HH11  ARG   4          1HH1      ARG   4  -5.349  -0.015  -2.611
   30   HH12  ARG   4          2HH1      ARG   4  -6.597  -0.360  -1.460
   31   HH21  ARG   4          1HH2      ARG   4  -5.163  -3.356  -0.369
   32   HH22  ARG   4          2HH2      ARG   4  -6.490  -2.260  -0.184
   33    H    LEU   5           H        LEU   5  -0.945  -2.125  -8.177
   34    HA   LEU   5           HA       LEU   5  -3.337  -0.545  -8.842
   35    HB2  LEU   5           2HB      LEU   5  -0.534   0.456  -9.250
   36    HB3  LEU   5           3HB      LEU   5  -2.042   1.360  -9.366
   37    HG   LEU   5           HG       LEU   5  -0.888   0.260  -6.804
   38   HD11  LEU   5          1HD1      LEU   5  -0.987   3.148  -7.605
   39   HD12  LEU   5          2HD1      LEU   5   0.398   2.127  -7.989
   40   HD13  LEU   5          3HD1      LEU   5  -0.065   2.387  -6.308
   41   HD21  LEU   5          3HD2      LEU   5  -3.480   1.184  -7.482
   42   HD22  LEU   5          1HD2      LEU   5  -2.724   2.401  -6.453
   43   HD23  LEU   5          2HD2      LEU   5  -2.854   0.733  -5.895
   44    H    TYR   6           H        TYR   6  -4.090  -1.423 -10.657
   45    HA   TYR   6           HA       TYR   6  -2.682  -2.960 -12.489
   46    HB2  TYR   6           2HB      TYR   6  -5.258  -2.510 -12.186
   47    HB3  TYR   6           3HB      TYR   6  -4.981  -1.285 -13.420
   48    HD1  TYR   6           HD2      TYR   6  -4.234  -1.949 -15.679
   49    HD2  TYR   6           HD1      TYR   6  -5.239  -4.843 -12.726
   50    HE1  TYR   6           HE2      TYR   6  -4.404  -3.668 -17.430
   51    HE2  TYR   6           HE1      TYR   6  -5.411  -6.570 -14.468
   52    HH   TYR   6           HH       TYR   6  -4.303  -6.825 -16.922
   53    H    ARG   7           H        ARG   7  -2.695   0.435 -12.059
   54    HA   ARG   7           HA       ARG   7  -2.280   1.560 -14.486
   55    HB2  ARG   7           2HB      ARG   7  -1.482   2.156 -11.777
   56    HB3  ARG   7           3HB      ARG   7  -0.224   2.641 -12.906
   57    HG2  ARG   7           2HG      ARG   7  -2.731   3.468 -13.956
   58    HG3  ARG   7           3HG      ARG   7  -2.630   3.977 -12.270
   59    HD2  ARG   7           2HD      ARG   7  -0.258   4.791 -12.914
   60    HD3  ARG   7           3HD      ARG   7  -0.851   4.686 -14.571
   61    HE   ARG   7           HE       ARG   7  -2.757   6.139 -13.299
   62   HH11  ARG   7          1HH1      ARG   7   0.699   6.421 -13.599
   63   HH12  ARG   7          2HH1      ARG   7   0.699   8.150 -13.480
   64   HH21  ARG   7          1HH2      ARG   7  -2.771   8.414 -13.142
   65   HH22  ARG   7          2HH2      ARG   7  -1.275   9.282 -13.220
   66    H    ARG   8           H        ARG   8   0.044  -0.384 -12.675
   67    HA   ARG   8           HA       ARG   8   1.820  -0.341 -15.025
   68    HB2  ARG   8           2HB      ARG   8   3.493  -1.242 -13.191
   69    HB3  ARG   8           3HB      ARG   8   3.189   0.480 -13.377
   70    HG2  ARG   8           2HG      ARG   8   1.453  -1.009 -11.497
   71    HG3  ARG   8           3HG      ARG   8   3.130  -0.734 -11.021
   72    HD2  ARG   8           2HD      ARG   8   2.272   1.708 -12.040
   73    HD3  ARG   8           3HD      ARG   8   0.903   1.110 -11.103
   74    HE   ARG   8           HE       ARG   8   3.172   0.769  -9.542
   75   HH11  ARG   8          1HH1      ARG   8   1.371   3.388 -10.961
   76   HH12  ARG   8          2HH1      ARG   8   1.796   4.524  -9.724
   77   HH21  ARG   8          1HH2      ARG   8   3.740   2.255  -7.907
   78   HH22  ARG   8          2HH2      ARG   8   3.145   3.879  -7.988
   79    H    ARG   9           H        ARG   9   0.557  -2.407 -12.428
   80    HA   ARG   9           HA       ARG   9   0.905  -4.716 -14.222
   81    HB2  ARG   9           2HB      ARG   9   1.084  -5.973 -11.900
   82    HB3  ARG   9           3HB      ARG   9   2.498  -5.265 -12.669
   83    HG2  ARG   9           2HG      ARG   9   2.550  -3.463 -11.193
   84    HG3  ARG   9           3HG      ARG   9   0.883  -3.722 -10.676
   85    HD2  ARG   9           2HD      ARG   9   1.626  -4.936  -8.972
   86    HD3  ARG   9           3HD      ARG   9   2.297  -6.097 -10.117
   87    HE   ARG   9           HE       ARG   9   4.010  -3.847  -9.730
   88   HH11  ARG   9          1HH1      ARG   9   3.017  -6.892  -8.366
   89   HH12  ARG   9          2HH1      ARG   9   4.503  -7.142  -7.512
   90   HH21  ARG   9          1HH2      ARG   9   5.971  -4.165  -8.610
   91   HH22  ARG   9          2HH2      ARG   9   6.182  -5.590  -7.650
   92    H    PHE  10           H        PHE  10  -0.372  -5.183 -11.067
   93    HA   PHE  10           HA       PHE  10  -3.135  -4.972 -11.995
   94    HB2  PHE  10           2HB      PHE  10  -2.542  -7.273 -12.496
   95    HB3  PHE  10           3HB      PHE  10  -1.917  -7.499 -10.866
   96    HD1  PHE  10           HD2      PHE  10  -3.647  -7.040  -8.945
   97    HD2  PHE  10           HD1      PHE  10  -4.681  -7.961 -12.970
   98    HE1  PHE  10           HE2      PHE  10  -5.867  -7.794  -8.199
   99    HE2  PHE  10           HE1      PHE  10  -6.903  -8.716 -12.230
  100    HZ   PHE  10           HZ       PHE  10  -7.498  -8.634  -9.841
  101    H    VAL  11           H        VAL  11  -4.678  -4.811 -10.325
  102    HA   VAL  11           HA       VAL  11  -3.674  -3.594  -7.930
  103    HB   VAL  11           HB       VAL  11  -6.145  -3.523  -7.308
  104   HG11  VAL  11          1HG1      VAL  11  -4.608  -1.986  -9.091
  105   HG12  VAL  11          2HG1      VAL  11  -6.215  -2.124  -9.806
  106   HG13  VAL  11          3HG1      VAL  11  -6.027  -1.482  -8.174
  107   HG21  VAL  11          3HG2      VAL  11  -6.584  -4.286 -10.181
  108   HG22  VAL  11          1HG2      VAL  11  -6.674  -5.464  -8.871
  109   HG23  VAL  11          2HG2      VAL  11  -7.780  -4.091  -8.900
  110    H    VAL  12           H        VAL  12  -2.561  -5.927  -7.690
  111    HA   VAL  12           HA       VAL  12  -4.165  -7.941  -6.452
  112    HB   VAL  12           HB       VAL  12  -1.890  -8.862  -5.739
  113   HG11  VAL  12          1HG1      VAL  12  -2.208  -8.399  -8.696
  114   HG12  VAL  12          2HG1      VAL  12  -1.478  -9.787  -7.886
  115   HG13  VAL  12          3HG1      VAL  12  -3.218  -9.515  -7.777
  116   HG21  VAL  12          3HG2      VAL  12  -0.589  -7.164  -7.759
  117   HG22  VAL  12          1HG2      VAL  12  -0.991  -6.362  -6.240
  118   HG23  VAL  12          2HG2      VAL  12   0.033  -7.798  -6.235
  119    H    GLY  13           H        GLY  13  -1.341  -7.440  -4.663
  120    HA2  GLY  13           2HA      GLY  13  -2.906  -6.251  -2.454
  121    HA3  GLY  13           3HA      GLY  13  -1.746  -7.548  -2.208
  122    H    ARG  14           H        ARG  14   0.518  -6.968  -3.149
  123    HA   ARG  14           HA       ARG  14   1.645  -4.989  -1.613
  124    HB2  ARG  14           2HB      ARG  14   3.541  -5.056  -3.339
  125    HB3  ARG  14           3HB      ARG  14   3.122  -6.562  -2.532
  126    HG2  ARG  14           2HG      ARG  14   1.604  -6.201  -4.966
  127    HG3  ARG  14           3HG      ARG  14   3.344  -6.142  -5.258
  128    HD2  ARG  14           2HD      ARG  14   2.253  -8.290  -3.507
  129    HD3  ARG  14           3HD      ARG  14   2.031  -8.426  -5.250
  130    HE   ARG  14           HE       ARG  14   4.731  -7.835  -4.619
  131   HH11  ARG  14          1HH1      ARG  14   2.397 -10.417  -4.600
  132   HH12  ARG  14          2HH1      ARG  14   3.585 -11.668  -4.766
  133   HH21  ARG  14          1HH2      ARG  14   6.305  -9.472  -4.838
  134   HH22  ARG  14          2HH2      ARG  14   5.807 -11.128  -4.901
  Start of MODEL   17
    1    H1   ARG   1           H        ARG   1   4.471  -0.375  -1.532
    2    HA   ARG   1           HA       ARG   1   3.286  -2.724  -1.395
    3    HB2  ARG   1           2HB      ARG   1   1.826  -1.088   0.680
    4    HB3  ARG   1           3HB      ARG   1   1.520  -2.760   0.227
    5    HG2  ARG   1           2HG      ARG   1   4.190  -2.707   1.018
    6    HG3  ARG   1           3HG      ARG   1   3.340  -1.690   2.183
    7    HD2  ARG   1           2HD      ARG   1   1.906  -3.434   2.823
    8    HD3  ARG   1           3HD      ARG   1   2.308  -4.398   1.402
    9    HE   ARG   1           HE       ARG   1   4.643  -4.035   2.885
   10   HH11  ARG   1          1HH1      ARG   1   1.554  -5.614   3.180
   11   HH12  ARG   1          2HH1      ARG   1   2.147  -6.866   4.222
   12   HH21  ARG   1          1HH2      ARG   1   5.435  -5.677   4.256
   13   HH22  ARG   1          2HH2      ARG   1   4.355  -6.900   4.834
   14    H    GLY   2           H        GLY   2   3.494  -0.779  -3.262
   15    HA2  GLY   2           2HA      GLY   2   0.695   0.056  -3.714
   16    HA3  GLY   2           3HA      GLY   2   2.082   0.981  -4.269
   17    H    GLY   3           H        GLY   3   1.653  -2.524  -4.449
   18    HA2  GLY   3           2HA      GLY   3   2.017  -2.326  -7.356
   19    HA3  GLY   3           3HA      GLY   3   2.275  -3.766  -6.383
   20    H    ARG   4           H        ARG   4  -0.574  -1.796  -5.997
   21    HA   ARG   4           HA       ARG   4  -2.155  -3.916  -7.298
   22    HB2  ARG   4           2HB      ARG   4  -3.620  -2.359  -5.327
   23    HB3  ARG   4           3HB      ARG   4  -3.464  -4.104  -5.489
   24    HG2  ARG   4           2HG      ARG   4  -2.535  -3.734  -3.422
   25    HG3  ARG   4           3HG      ARG   4  -1.109  -3.724  -4.462
   26    HD2  ARG   4           2HD      ARG   4  -0.611  -1.692  -3.721
   27    HD3  ARG   4           3HD      ARG   4  -2.114  -1.090  -4.419
   28    HE   ARG   4           HE       ARG   4  -2.476  -2.319  -1.854
   29   HH11  ARG   4          1HH1      ARG   4  -1.599   0.621  -3.501
   30   HH12  ARG   4          2HH1      ARG   4  -2.051   1.649  -2.181
   31   HH21  ARG   4          1HH2      ARG   4  -3.075  -0.976  -0.110
   32   HH22  ARG   4          2HH2      ARG   4  -2.890   0.739  -0.253
   33    H    LEU   5           H        LEU   5  -1.183  -1.692  -8.704
   34    HA   LEU   5           HA       LEU   5  -3.666  -0.177  -9.179
   35    HB2  LEU   5           2HB      LEU   5  -0.797   0.701  -9.343
   36    HB3  LEU   5           3HB      LEU   5  -2.102   1.592 -10.124
   37    HG   LEU   5           HG       LEU   5  -2.568   1.070  -7.283
   38   HD11  LEU   5          1HD1      LEU   5  -0.306   2.897  -8.076
   39   HD12  LEU   5          2HD1      LEU   5  -0.120   1.343  -7.263
   40   HD13  LEU   5          3HD1      LEU   5  -0.958   2.667  -6.453
   41   HD21  LEU   5          3HD2      LEU   5  -2.745   3.380  -9.184
   42   HD22  LEU   5          1HD2      LEU   5  -2.922   3.612  -7.445
   43   HD23  LEU   5          2HD2      LEU   5  -4.037   2.555  -8.310
   44    H    TYR   6           H        TYR   6  -4.590  -0.950 -10.959
   45    HA   TYR   6           HA       TYR   6  -3.547  -2.534 -12.912
   46    HB2  TYR   6           2HB      TYR   6  -5.905  -0.893 -12.616
   47    HB3  TYR   6           3HB      TYR   6  -5.345  -0.867 -14.284
   48    HD1  TYR   6           HD1      TYR   6  -4.695  -3.275 -15.232
   49    HD2  TYR   6           HD2      TYR   6  -7.372  -2.562 -12.002
   50    HE1  TYR   6           HE1      TYR   6  -5.737  -5.469 -15.619
   51    HE2  TYR   6           HE2      TYR   6  -8.421  -4.755 -12.380
   52    HH   TYR   6           HH       TYR   6  -7.066  -7.091 -14.552
   53    H    ARG   7           H        ARG   7  -3.193   0.919 -12.578
   54    HA   ARG   7           HA       ARG   7  -2.441   1.720 -15.093
   55    HB2  ARG   7           2HB      ARG   7  -1.785   2.595 -12.343
   56    HB3  ARG   7           3HB      ARG   7  -0.691   3.146 -13.605
   57    HG2  ARG   7           2HG      ARG   7  -2.360   4.349 -14.697
   58    HG3  ARG   7           3HG      ARG   7  -3.654   3.476 -13.873
   59    HD2  ARG   7           2HD      ARG   7  -3.688   4.976 -12.234
   60    HD3  ARG   7           3HD      ARG   7  -1.962   4.757 -11.946
   61    HE   ARG   7           HE       ARG   7  -1.587   6.722 -13.041
   62   HH11  ARG   7          1HH1      ARG   7  -4.734   5.532 -13.935
   63   HH12  ARG   7          2HH1      ARG   7  -5.151   6.943 -14.850
   64   HH21  ARG   7          1HH2      ARG   7  -2.125   8.585 -14.242
   65   HH22  ARG   7          2HH2      ARG   7  -3.666   8.679 -15.024
   66    H    ARG   8           H        ARG   8  -0.273   0.427 -12.574
   67    HA   ARG   8           HA       ARG   8   1.674  -0.188 -14.698
   68    HB2  ARG   8           2HB      ARG   8   2.050   0.504 -11.790
   69    HB3  ARG   8           3HB      ARG   8   3.318  -0.268 -12.733
   70    HG2  ARG   8           2HG      ARG   8   2.214   2.057 -14.071
   71    HG3  ARG   8           3HG      ARG   8   2.880   2.440 -12.482
   72    HD2  ARG   8           2HD      ARG   8   4.587   0.643 -13.996
   73    HD3  ARG   8           3HD      ARG   8   4.298   2.162 -14.842
   74    HE   ARG   8           HE       ARG   8   4.931   2.885 -12.276
   75   HH11  ARG   8          1HH1      ARG   8   6.468   1.042 -14.799
   76   HH12  ARG   8          2HH1      ARG   8   8.075   1.452 -14.298
   77   HH21  ARG   8          1HH2      ARG   8   7.042   3.431 -11.607
   78   HH22  ARG   8          2HH2      ARG   8   8.401   2.810 -12.482
   79    H    ARG   9           H        ARG   9   0.527  -1.369 -11.535
   80    HA   ARG   9           HA       ARG   9   0.932  -4.112 -12.527
   81    HB2  ARG   9           2HB      ARG   9   1.435  -3.066  -9.735
   82    HB3  ARG   9           3HB      ARG   9   1.476  -4.765 -10.188
   83    HG2  ARG   9           2HG      ARG   9   3.186  -3.557 -11.995
   84    HG3  ARG   9           3HG      ARG   9   3.503  -2.721 -10.473
   85    HD2  ARG   9           2HD      ARG   9   3.481  -5.186  -9.525
   86    HD3  ARG   9           3HD      ARG   9   3.889  -5.582 -11.194
   87    HE   ARG   9           HE       ARG   9   5.971  -4.665 -10.875
   88   HH11  ARG   9          1HH1      ARG   9   3.891  -3.790  -8.224
   89   HH12  ARG   9          2HH1      ARG   9   5.174  -3.127  -7.266
   90   HH21  ARG   9          1HH2      ARG   9   7.668  -3.795  -9.624
   91   HH22  ARG   9          2HH2      ARG   9   7.321  -3.130  -8.064
   92    H    PHE  10           H        PHE  10  -0.969  -5.068 -12.769
   93    HA   PHE  10           HA       PHE  10  -3.442  -4.297 -12.151
   94    HB2  PHE  10           2HB      PHE  10  -3.596  -6.287 -13.230
   95    HB3  PHE  10           3HB      PHE  10  -2.190  -6.955 -12.408
   96    HD1  PHE  10           HD1      PHE  10  -5.671  -5.894 -11.571
   97    HD2  PHE  10           HD2      PHE  10  -2.559  -8.749 -11.036
   98    HE1  PHE  10           HE1      PHE  10  -7.154  -7.239 -10.140
   99    HE2  PHE  10           HE2      PHE  10  -4.038 -10.098  -9.605
  100    HZ   PHE  10           HZ       PHE  10  -6.339  -9.344  -9.156
  101    H    VAL  11           H        VAL  11  -4.937  -4.481 -10.464
  102    HA   VAL  11           HA       VAL  11  -3.939  -3.994  -7.877
  103    HB   VAL  11           HB       VAL  11  -6.066  -3.084  -8.437
  104   HG11  VAL  11          1HG1      VAL  11  -7.159  -5.872  -8.751
  105   HG12  VAL  11          2HG1      VAL  11  -7.976  -4.346  -9.095
  106   HG13  VAL  11          3HG1      VAL  11  -6.628  -4.873 -10.103
  107   HG21  VAL  11          3HG2      VAL  11  -7.136  -3.459  -6.462
  108   HG22  VAL  11          1HG2      VAL  11  -6.993  -5.212  -6.591
  109   HG23  VAL  11          2HG2      VAL  11  -5.603  -4.248  -6.092
  110    H    VAL  12           H        VAL  12  -2.552  -6.102  -8.136
  111    HA   VAL  12           HA       VAL  12  -3.700  -8.622  -7.676
  112    HB   VAL  12           HB       VAL  12  -1.395  -9.168  -6.683
  113   HG11  VAL  12          1HG1      VAL  12  -1.455  -8.022  -9.470
  114   HG12  VAL  12          2HG1      VAL  12  -0.393  -9.292  -8.859
  115   HG13  VAL  12          3HG1      VAL  12  -2.123  -9.592  -9.025
  116   HG21  VAL  12          3HG2      VAL  12   0.170  -7.581  -6.439
  117   HG22  VAL  12          1HG2      VAL  12  -0.268  -6.786  -7.951
  118   HG23  VAL  12          2HG2      VAL  12  -1.182  -6.449  -6.480
  119    H    GLY  13           H        GLY  13  -1.445  -7.966  -5.214
  120    HA2  GLY  13           2HA      GLY  13  -3.605  -7.841  -3.203
  121    HA3  GLY  13           3HA      GLY  13  -2.244  -8.938  -3.028
  122    H    ARG  14           H        ARG  14  -0.044  -7.805  -3.136
  123    HA   ARG  14           HA       ARG  14   0.256  -6.125  -0.977
  124    HB2  ARG  14           2HB      ARG  14   2.483  -5.498  -2.084
  125    HB3  ARG  14           3HB      ARG  14   2.198  -7.199  -1.740
  126    HG2  ARG  14           2HG      ARG  14   1.281  -6.435  -4.387
  127    HG3  ARG  14           3HG      ARG  14   3.003  -6.133  -4.145
  128    HD2  ARG  14           2HD      ARG  14   1.678  -8.747  -3.463
  129    HD3  ARG  14           3HD      ARG  14   2.391  -8.414  -5.040
  130    HE   ARG  14           HE       ARG  14   4.246  -7.882  -2.965
  131   HH11  ARG  14          1HH1      ARG  14   2.742 -10.488  -4.715
  132   HH12  ARG  14          2HH1      ARG  14   4.061 -11.585  -4.474
  133   HH21  ARG  14          1HH2      ARG  14   5.989  -9.316  -2.640
  134   HH22  ARG  14          2HH2      ARG  14   5.907 -10.918  -3.293
  Start of MODEL   18
    1    H1   ARG   1           H        ARG   1   5.328  -1.992  -2.153
    2    HA   ARG   1           HA       ARG   1   3.482  -3.629  -1.712
    3    HB2  ARG   1           2HB      ARG   1   1.844  -2.989  -0.019
    4    HB3  ARG   1           3HB      ARG   1   3.438  -3.173   0.699
    5    HG2  ARG   1           2HG      ARG   1   3.178  -0.470  -0.073
    6    HG3  ARG   1           3HG      ARG   1   1.694  -0.929   0.765
    7    HD2  ARG   1           2HD      ARG   1   3.518  -2.057   2.390
    8    HD3  ARG   1           3HD      ARG   1   4.458  -0.697   1.777
    9    HE   ARG   1           HE       ARG   1   1.972   0.282   2.559
   10   HH11  ARG   1          1HH1      ARG   1   4.774  -1.196   4.002
   11   HH12  ARG   1          2HH1      ARG   1   4.564  -0.409   5.531
   12   HH21  ARG   1          1HH2      ARG   1   1.684   1.325   4.567
   13   HH22  ARG   1          2HH2      ARG   1   2.806   1.025   5.852
   14    H    GLY   2           H        GLY   2   4.117  -1.769  -3.666
   15    HA2  GLY   2           2HA      GLY   2   1.535  -0.389  -4.077
   16    HA3  GLY   2           3HA      GLY   2   3.068   0.229  -4.673
   17    H    GLY   3           H        GLY   3   2.057  -3.143  -4.794
   18    HA2  GLY   3           2HA      GLY   3   2.330  -3.036  -7.711
   19    HA3  GLY   3           3HA      GLY   3   2.354  -4.490  -6.723
   20    H    ARG   4           H        ARG   4  -0.095  -2.108  -6.159
   21    HA   ARG   4           HA       ARG   4  -2.069  -3.910  -7.398
   22    HB2  ARG   4           2HB      ARG   4  -3.116  -2.018  -5.434
   23    HB3  ARG   4           3HB      ARG   4  -3.364  -3.754  -5.568
   24    HG2  ARG   4           2HG      ARG   4  -1.362  -4.213  -4.367
   25    HG3  ARG   4           3HG      ARG   4  -0.872  -2.518  -4.426
   26    HD2  ARG   4           2HD      ARG   4  -3.345  -3.535  -3.033
   27    HD3  ARG   4           3HD      ARG   4  -1.806  -3.229  -2.231
   28    HE   ARG   4           HE       ARG   4  -2.619  -0.926  -3.637
   29   HH11  ARG   4          1HH1      ARG   4  -3.421  -2.806  -0.818
   30   HH12  ARG   4          2HH1      ARG   4  -4.075  -1.460   0.054
   31   HH21  ARG   4          1HH2      ARG   4  -3.478   0.854  -2.498
   32   HH22  ARG   4          2HH2      ARG   4  -4.107   0.622  -0.902
   33    H    LEU   5           H        LEU   5  -0.744  -1.932  -8.905
   34    HA   LEU   5           HA       LEU   5  -2.940  -0.029  -9.396
   35    HB2  LEU   5           2HB      LEU   5   0.029   0.327  -9.505
   36    HB3  LEU   5           3HB      LEU   5  -1.024   1.338 -10.492
   37    HG   LEU   5           HG       LEU   5  -0.409   2.502  -8.466
   38   HD11  LEU   5          1HD1      LEU   5  -2.915   2.294  -9.452
   39   HD12  LEU   5          2HD1      LEU   5  -2.451   3.387  -8.148
   40   HD13  LEU   5          3HD1      LEU   5  -3.186   1.828  -7.773
   41   HD21  LEU   5          3HD2      LEU   5  -0.349   0.090  -7.257
   42   HD22  LEU   5          1HD2      LEU   5  -1.898   0.701  -6.674
   43   HD23  LEU   5          2HD2      LEU   5  -0.422   1.625  -6.391
   44    H    TYR   6           H        TYR   6  -4.024  -0.714 -11.122
   45    HA   TYR   6           HA       TYR   6  -3.294  -2.507 -13.038
   46    HB2  TYR   6           2HB      TYR   6  -5.360  -0.512 -12.747
   47    HB3  TYR   6           3HB      TYR   6  -4.848  -0.622 -14.427
   48    HD1  TYR   6           HD2      TYR   6  -4.612  -3.121 -15.317
   49    HD2  TYR   6           HD1      TYR   6  -7.042  -1.922 -12.037
   50    HE1  TYR   6           HE2      TYR   6  -5.991  -5.136 -15.610
   51    HE2  TYR   6           HE1      TYR   6  -8.427  -3.935 -12.320
   52    HH   TYR   6           HH       TYR   6  -8.942  -5.625 -13.785
   53    H    ARG   7           H        ARG   7  -2.397   0.856 -12.836
   54    HA   ARG   7           HA       ARG   7  -1.601   1.454 -15.391
   55    HB2  ARG   7           2HB      ARG   7  -0.518   2.222 -12.705
   56    HB3  ARG   7           3HB      ARG   7   0.313   2.749 -14.162
   57    HG2  ARG   7           2HG      ARG   7  -1.516   4.029 -14.877
   58    HG3  ARG   7           3HG      ARG   7  -2.615   3.240 -13.744
   59    HD2  ARG   7           2HD      ARG   7  -2.085   4.650 -12.095
   60    HD3  ARG   7           3HD      ARG   7  -0.358   4.500 -12.417
   61    HE   ARG   7           HE       ARG   7  -1.480   6.088 -14.421
   62   HH11  ARG   7          1HH1      ARG   7  -0.885   6.194 -10.993
   63   HH12  ARG   7          2HH1      ARG   7  -0.739   7.920 -10.940
   64   HH21  ARG   7          1HH2      ARG   7  -1.290   8.360 -14.364
   65   HH22  ARG   7          2HH2      ARG   7  -0.971   9.151 -12.858
   66    H    ARG   8           H        ARG   8   0.410  -0.096 -12.888
   67    HA   ARG   8           HA       ARG   8   2.169  -1.074 -15.039
   68    HB2  ARG   8           2HB      ARG   8   2.761  -0.448 -12.146
   69    HB3  ARG   8           3HB      ARG   8   3.875  -1.323 -13.188
   70    HG2  ARG   8           2HG      ARG   8   4.477   0.528 -14.333
   71    HG3  ARG   8           3HG      ARG   8   2.875   1.259 -14.211
   72    HD2  ARG   8           2HD      ARG   8   4.900   1.068 -11.984
   73    HD3  ARG   8           3HD      ARG   8   4.554   2.511 -12.935
   74    HE   ARG   8           HE       ARG   8   2.180   1.543 -11.758
   75   HH11  ARG   8          1HH1      ARG   8   5.158   3.153 -10.945
   76   HH12  ARG   8          2HH1      ARG   8   4.489   3.979  -9.577
   77   HH21  ARG   8          1HH2      ARG   8   1.289   2.625  -9.959
   78   HH22  ARG   8          2HH2      ARG   8   2.289   3.677  -9.016
   79    H    ARG   9           H        ARG   9   0.923  -1.961 -11.819
   80    HA   ARG   9           HA       ARG   9   0.872  -4.764 -12.722
   81    HB2  ARG   9           2HB      ARG   9   1.581  -3.741  -9.966
   82    HB3  ARG   9           3HB      ARG   9   1.382  -5.435 -10.392
   83    HG2  ARG   9           2HG      ARG   9   3.217  -5.019 -12.128
   84    HG3  ARG   9           3HG      ARG   9   3.534  -3.531 -11.234
   85    HD2  ARG   9           2HD      ARG   9   4.203  -4.672  -9.325
   86    HD3  ARG   9           3HD      ARG   9   3.370  -6.151  -9.800
   87    HE   ARG   9           HE       ARG   9   5.300  -5.783 -11.706
   88   HH11  ARG   9          1HH1      ARG   9   5.256  -6.096  -8.239
   89   HH12  ARG   9          2HH1      ARG   9   6.827  -6.822  -8.154
   90   HH21  ARG   9          1HH2      ARG   9   7.369  -6.738 -11.608
   91   HH22  ARG   9          2HH2      ARG   9   8.028  -7.186 -10.071
   92    H    PHE  10           H        PHE  10  -1.160  -5.418 -12.891
   93    HA   PHE  10           HA       PHE  10  -3.466  -4.248 -12.255
   94    HB2  PHE  10           2HB      PHE  10  -3.968  -6.221 -13.248
   95    HB3  PHE  10           3HB      PHE  10  -2.650  -7.072 -12.449
   96    HD1  PHE  10           HD2      PHE  10  -5.913  -5.487 -11.566
   97    HD2  PHE  10           HD1      PHE  10  -3.220  -8.730 -10.978
   98    HE1  PHE  10           HE2      PHE  10  -7.529  -6.548 -10.043
   99    HE2  PHE  10           HE1      PHE  10  -4.831  -9.797  -9.455
  100    HZ   PHE  10           HZ       PHE  10  -6.989  -8.705  -8.985
  101    H    VAL  11           H        VAL  11  -4.932  -4.140 -10.534
  102    HA   VAL  11           HA       VAL  11  -3.816  -3.711  -7.990
  103    HB   VAL  11           HB       VAL  11  -5.808  -2.533  -8.544
  104   HG11  VAL  11          1HG1      VAL  11  -6.652  -4.291 -10.126
  105   HG12  VAL  11          2HG1      VAL  11  -7.295  -5.146  -8.722
  106   HG13  VAL  11          3HG1      VAL  11  -7.887  -3.533  -9.122
  107   HG21  VAL  11          3HG2      VAL  11  -6.870  -2.682  -6.535
  108   HG22  VAL  11          1HG2      VAL  11  -6.979  -4.441  -6.598
  109   HG23  VAL  11          2HG2      VAL  11  -5.455  -3.667  -6.164
  110    H    VAL  12           H        VAL  12  -2.739  -5.995  -8.177
  111    HA   VAL  12           HA       VAL  12  -4.226  -8.307  -7.583
  112    HB   VAL  12           HB       VAL  12  -1.990  -9.149  -6.647
  113   HG11  VAL  12          1HG1      VAL  12  -1.991  -8.103  -9.474
  114   HG12  VAL  12          2HG1      VAL  12  -1.093  -9.487  -8.849
  115   HG13  VAL  12          3HG1      VAL  12  -2.853  -9.547  -8.945
  116   HG21  VAL  12          3HG2      VAL  12  -0.186  -7.812  -6.545
  117   HG22  VAL  12          1HG2      VAL  12  -0.599  -6.976  -8.042
  118   HG23  VAL  12          2HG2      VAL  12  -1.367  -6.503  -6.526
  119    H    GLY  13           H        GLY  13  -1.810  -7.921  -5.228
  120    HA2  GLY  13           2HA      GLY  13  -3.842  -7.372  -3.155
  121    HA3  GLY  13           3HA      GLY  13  -2.674  -8.673  -2.978
  122    H    ARG  14           H        ARG  14  -0.324  -7.926  -3.206
  123    HA   ARG  14           HA       ARG  14   0.319  -6.224  -1.131
  124    HB2  ARG  14           2HB      ARG  14   2.593  -6.064  -2.290
  125    HB3  ARG  14           3HB      ARG  14   2.015  -7.672  -1.875
  126    HG2  ARG  14           2HG      ARG  14   1.184  -6.879  -4.533
  127    HG3  ARG  14           3HG      ARG  14   2.937  -6.833  -4.339
  128    HD2  ARG  14           2HD      ARG  14   2.564  -9.166  -3.208
  129    HD3  ARG  14           3HD      ARG  14   1.058  -9.141  -4.125
  130    HE   ARG  14           HE       ARG  14   3.221  -8.498  -5.816
  131   HH11  ARG  14          1HH1      ARG  14   1.806 -11.187  -4.117
  132   HH12  ARG  14          2HH1      ARG  14   2.391 -12.371  -5.239
  133   HH21  ARG  14          1HH2      ARG  14   3.996 -10.047  -7.300
  134   HH22  ARG  14          2HH2      ARG  14   3.637 -11.722  -7.049
  Start of MODEL   19
    1    H1   ARG   1           H        ARG   1   2.561   0.256   0.489
    2    HA   ARG   1           HA       ARG   1   3.210   1.387  -1.973
    3    HB2  ARG   1           2HB      ARG   1   3.279  -1.271  -0.767
    4    HB3  ARG   1           3HB      ARG   1   2.999  -1.322  -2.502
    5    HG2  ARG   1           2HG      ARG   1   5.190  -1.137  -2.768
    6    HG3  ARG   1           3HG      ARG   1   5.053   0.520  -2.178
    7    HD2  ARG   1           2HD      ARG   1   6.502  -0.168  -0.604
    8    HD3  ARG   1           3HD      ARG   1   5.067  -0.856   0.155
    9    HE   ARG   1           HE       ARG   1   6.041  -2.759  -1.612
   10   HH11  ARG   1          1HH1      ARG   1   7.104  -1.118   1.268
   11   HH12  ARG   1          2HH1      ARG   1   8.098  -2.431   1.806
   12   HH21  ARG   1          1HH2      ARG   1   7.346  -4.495  -0.914
   13   HH22  ARG   1          2HH2      ARG   1   8.235  -4.351   0.564
   14    H    GLY   2           H        GLY   2   2.437   0.564  -4.135
   15    HA2  GLY   2           2HA      GLY   2  -0.515   0.445  -4.114
   16    HA3  GLY   2           3HA      GLY   2   0.428   1.248  -5.361
   17    H    GLY   3           H        GLY   3   1.140  -1.905  -3.949
   18    HA2  GLY   3           2HA      GLY   3   1.616  -3.169  -6.383
   19    HA3  GLY   3           3HA      GLY   3   1.233  -3.999  -4.882
   20    H    ARG   4           H        ARG   4  -1.395  -2.536  -4.781
   21    HA   ARG   4           HA       ARG   4  -2.833  -4.421  -6.482
   22    HB2  ARG   4           2HB      ARG   4  -4.833  -3.576  -5.166
   23    HB3  ARG   4           3HB      ARG   4  -3.608  -4.440  -4.246
   24    HG2  ARG   4           2HG      ARG   4  -3.363  -2.715  -2.886
   25    HG3  ARG   4           3HG      ARG   4  -2.982  -1.656  -4.246
   26    HD2  ARG   4           2HD      ARG   4  -5.441  -1.425  -4.644
   27    HD3  ARG   4           3HD      ARG   4  -5.709  -2.312  -3.144
   28    HE   ARG   4           HE       ARG   4  -4.005  -0.023  -2.830
   29   HH11  ARG   4          1HH1      ARG   4  -7.302  -1.136  -2.933
   30   HH12  ARG   4          2HH1      ARG   4  -7.914   0.183  -1.992
   31   HH21  ARG   4          1HH2      ARG   4  -4.798   1.719  -1.589
   32   HH22  ARG   4          2HH2      ARG   4  -6.489   1.807  -1.228
   33    H    LEU   5           H        LEU   5  -1.530  -2.226  -7.760
   34    HA   LEU   5           HA       LEU   5  -3.880  -0.799  -8.815
   35    HB2  LEU   5           2HB      LEU   5  -1.099   0.340  -8.637
   36    HB3  LEU   5           3HB      LEU   5  -2.566   1.175  -9.142
   37    HG   LEU   5           HG       LEU   5  -2.013   0.171  -6.350
   38   HD11  LEU   5          1HD1      LEU   5  -1.463   2.351  -5.730
   39   HD12  LEU   5          2HD1      LEU   5  -2.108   3.038  -7.221
   40   HD13  LEU   5          3HD1      LEU   5  -0.606   2.114  -7.254
   41   HD21  LEU   5          3HD2      LEU   5  -3.983   1.449  -5.735
   42   HD22  LEU   5          1HD2      LEU   5  -4.394   0.235  -6.947
   43   HD23  LEU   5          2HD2      LEU   5  -4.223   1.926  -7.417
   44    H    TYR   6           H        TYR   6  -4.262  -1.716 -10.730
   45    HA   TYR   6           HA       TYR   6  -2.491  -3.105 -12.333
   46    HB2  TYR   6           2HB      TYR   6  -5.028  -2.976 -12.525
   47    HB3  TYR   6           3HB      TYR   6  -4.788  -1.484 -13.429
   48    HD1  TYR   6           HD2      TYR   6  -3.682  -1.538 -15.636
   49    HD2  TYR   6           HD1      TYR   6  -4.589  -5.113 -13.515
   50    HE1  TYR   6           HE2      TYR   6  -3.377  -2.835 -17.703
   51    HE2  TYR   6           HE1      TYR   6  -4.284  -6.420 -15.576
   52    HH   TYR   6           HH       TYR   6  -2.705  -5.596 -18.059
   53    H    ARG   7           H        ARG   7  -2.702   0.261 -11.816
   54    HA   ARG   7           HA       ARG   7  -1.993   1.544 -14.065
   55    HB2  ARG   7           2HB      ARG   7  -1.068   1.837 -11.245
   56    HB3  ARG   7           3HB      ARG   7  -0.248   2.776 -12.486
   57    HG2  ARG   7           2HG      ARG   7  -2.785   3.323 -13.136
   58    HG3  ARG   7           3HG      ARG   7  -2.980   3.032 -11.406
   59    HD2  ARG   7           2HD      ARG   7  -0.819   4.832 -12.439
   60    HD3  ARG   7           3HD      ARG   7  -2.463   5.427 -12.213
   61    HE   ARG   7           HE       ARG   7  -1.881   4.263  -9.837
   62   HH11  ARG   7          1HH1      ARG   7  -0.282   6.651 -11.802
   63   HH12  ARG   7          2HH1      ARG   7   0.439   7.467 -10.455
   64   HH21  ARG   7          1HH2      ARG   7  -0.938   5.329  -8.055
   65   HH22  ARG   7          2HH2      ARG   7   0.066   6.714  -8.324
   66    H    ARG   8           H        ARG   8   0.180  -0.475 -12.133
   67    HA   ARG   8           HA       ARG   8   2.166  -0.300 -14.301
   68    HB2  ARG   8           2HB      ARG   8   2.629  -1.095 -11.421
   69    HB3  ARG   8           3HB      ARG   8   3.860  -0.887 -12.660
   70    HG2  ARG   8           2HG      ARG   8   2.922   1.534 -12.805
   71    HG3  ARG   8           3HG      ARG   8   2.273   1.174 -11.203
   72    HD2  ARG   8           2HD      ARG   8   4.824   0.286 -10.948
   73    HD3  ARG   8           3HD      ARG   8   5.045   1.629 -12.069
   74    HE   ARG   8           HE       ARG   8   3.467   2.629 -10.068
   75   HH11  ARG   8          1HH1      ARG   8   6.597   1.117 -10.249
   76   HH12  ARG   8          2HH1      ARG   8   7.228   1.959  -8.872
   77   HH21  ARG   8          1HH2      ARG   8   4.286   3.744  -8.254
   78   HH22  ARG   8          2HH2      ARG   8   5.912   3.453  -7.738
   79    H    ARG   9           H        ARG   9   0.658  -2.522 -11.981
   80    HA   ARG   9           HA       ARG   9   1.227  -4.720 -13.856
   81    HB2  ARG   9           2HB      ARG   9   1.451  -4.686 -10.853
   82    HB3  ARG   9           3HB      ARG   9   1.275  -6.186 -11.755
   83    HG2  ARG   9           2HG      ARG   9   3.420  -4.302 -12.573
   84    HG3  ARG   9           3HG      ARG   9   3.638  -5.234 -11.091
   85    HD2  ARG   9           2HD      ARG   9   4.142  -7.060 -12.254
   86    HD3  ARG   9           3HD      ARG   9   2.647  -6.932 -13.180
   87    HE   ARG   9           HE       ARG   9   4.442  -5.075 -14.219
   88   HH11  ARG   9          1HH1      ARG   9   4.137  -8.530 -13.911
   89   HH12  ARG   9          2HH1      ARG   9   5.043  -8.869 -15.349
   90   HH21  ARG   9          1HH2      ARG   9   5.636  -5.509 -16.114
   91   HH22  ARG   9          2HH2      ARG   9   5.896  -7.150 -16.600
   92    H    PHE  10           H        PHE  10  -0.380  -5.498 -10.953
   93    HA   PHE  10           HA       PHE  10  -3.029  -5.193 -12.166
   94    HB2  PHE  10           2HB      PHE  10  -2.786  -7.400 -12.763
   95    HB3  PHE  10           3HB      PHE  10  -1.680  -7.748 -11.438
   96    HD1  PHE  10           HD2      PHE  10  -5.191  -6.497 -11.677
   97    HD2  PHE  10           HD1      PHE  10  -2.497  -9.346 -10.022
   98    HE1  PHE  10           HE2      PHE  10  -7.041  -7.501 -10.403
   99    HE2  PHE  10           HE1      PHE  10  -4.343 -10.355  -8.746
  100    HZ   PHE  10           HZ       PHE  10  -6.618  -9.433  -8.935
  101    H    VAL  11           H        VAL  11  -4.737  -5.050 -10.701
  102    HA   VAL  11           HA       VAL  11  -4.087  -3.960  -8.164
  103    HB   VAL  11           HB       VAL  11  -6.571  -4.030  -7.771
  104   HG11  VAL  11          1HG1      VAL  11  -6.199  -2.814 -10.450
  105   HG12  VAL  11          2HG1      VAL  11  -6.869  -2.121  -8.972
  106   HG13  VAL  11          3HG1      VAL  11  -5.123  -2.281  -9.159
  107   HG21  VAL  11          3HG2      VAL  11  -7.148  -5.982  -9.059
  108   HG22  VAL  11          1HG2      VAL  11  -7.983  -4.583  -9.735
  109   HG23  VAL  11          2HG2      VAL  11  -6.552  -5.230 -10.539
  110    H    VAL  12           H        VAL  12  -2.811  -6.202  -7.886
  111    HA   VAL  12           HA       VAL  12  -4.136  -8.501  -7.050
  112    HB   VAL  12           HB       VAL  12  -2.029  -8.838  -5.590
  113   HG11  VAL  12          1HG1      VAL  12  -1.573  -8.412  -8.534
  114   HG12  VAL  12          2HG1      VAL  12  -0.786  -9.579  -7.470
  115   HG13  VAL  12          3HG1      VAL  12  -2.490  -9.770  -7.884
  116   HG21  VAL  12          3HG2      VAL  12  -0.670  -6.820  -7.242
  117   HG22  VAL  12          1HG2      VAL  12  -1.693  -6.179  -5.956
  118   HG23  VAL  12          2HG2      VAL  12  -0.385  -7.297  -5.568
  119    H    GLY  13           H        GLY  13  -2.244  -7.338  -4.459
  120    HA2  GLY  13           2HA      GLY  13  -4.680  -6.808  -2.873
  121    HA3  GLY  13           3HA      GLY  13  -3.378  -7.816  -2.262
  122    H    ARG  14           H        ARG  14  -1.135  -6.604  -2.520
  123    HA   ARG  14           HA       ARG  14  -1.194  -4.463  -0.702
  124    HB2  ARG  14           2HB      ARG  14   1.225  -4.166  -1.384
  125    HB3  ARG  14           3HB      ARG  14   0.785  -5.769  -0.810
  126    HG2  ARG  14           2HG      ARG  14   0.453  -5.589  -3.662
  127    HG3  ARG  14           3HG      ARG  14   2.086  -5.117  -3.185
  128    HD2  ARG  14           2HD      ARG  14   1.022  -7.512  -1.847
  129    HD3  ARG  14           3HD      ARG  14   1.283  -7.674  -3.583
  130    HE   ARG  14           HE       ARG  14   3.556  -6.506  -2.419
  131   HH11  ARG  14          1HH1      ARG  14   1.856  -9.542  -2.524
  132   HH12  ARG  14          2HH1      ARG  14   3.276 -10.496  -2.253
  133   HH21  ARG  14          1HH2      ARG  14   5.433  -7.751  -2.061
  134   HH22  ARG  14          2HH2      ARG  14   5.310  -9.476  -1.988
  Start of MODEL   20
    1    H1   ARG   1           H        ARG   1   4.577  -1.319  -0.219
    2    HA   ARG   1           HA       ARG   1   2.670  -2.535  -1.174
    3    HB2  ARG   1           2HB      ARG   1   0.819  -1.290  -0.096
    4    HB3  ARG   1           3HB      ARG   1   2.225  -1.459   0.947
    5    HG2  ARG   1           2HG      ARG   1   2.853   0.891   0.008
    6    HG3  ARG   1           3HG      ARG   1   1.135   0.974  -0.384
    7    HD2  ARG   1           2HD      ARG   1   0.532   1.202   1.768
    8    HD3  ARG   1           3HD      ARG   1   1.713   0.016   2.323
    9    HE   ARG   1           HE       ARG   1   2.866   2.526   1.519
   10   HH11  ARG   1          1HH1      ARG   1   1.431   0.730   4.133
   11   HH12  ARG   1          2HH1      ARG   1   2.182   1.680   5.372
   12   HH21  ARG   1          1HH2      ARG   1   3.861   3.785   3.141
   13   HH22  ARG   1          2HH2      ARG   1   3.563   3.418   4.806
   14    H    GLY   2           H        GLY   2   3.758  -1.336  -3.434
   15    HA2  GLY   2           2HA      GLY   2   1.467   0.075  -4.643
   16    HA3  GLY   2           3HA      GLY   2   3.124   0.168  -5.221
   17    H    GLY   3           H        GLY   3   1.929  -2.925  -4.272
   18    HA2  GLY   3           2HA      GLY   3   2.226  -3.883  -6.987
   19    HA3  GLY   3           3HA      GLY   3   1.902  -4.860  -5.563
   20    H    ARG   4           H        ARG   4  -0.238  -2.333  -5.559
   21    HA   ARG   4           HA       ARG   4  -2.284  -3.958  -6.923
   22    HB2  ARG   4           2HB      ARG   4  -3.153  -1.953  -4.929
   23    HB3  ARG   4           3HB      ARG   4  -3.767  -3.571  -5.244
   24    HG2  ARG   4           2HG      ARG   4  -1.848  -4.525  -4.060
   25    HG3  ARG   4           3HG      ARG   4  -1.255  -2.896  -3.728
   26    HD2  ARG   4           2HD      ARG   4  -3.835  -2.765  -2.834
   27    HD3  ARG   4           3HD      ARG   4  -3.391  -4.425  -2.438
   28    HE   ARG   4           HE       ARG   4  -1.319  -2.757  -1.597
   29   HH11  ARG   4          1HH1      ARG   4  -4.661  -3.383  -0.851
   30   HH12  ARG   4          2HH1      ARG   4  -4.511  -2.924   0.813
   31   HH21  ARG   4          1HH2      ARG   4  -1.109  -2.150   0.592
   32   HH22  ARG   4          2HH2      ARG   4  -2.491  -2.222   1.632
   33    H    LEU   5           H        LEU   5  -0.708  -2.130  -8.344
   34    HA   LEU   5           HA       LEU   5  -2.667  -0.011  -8.939
   35    HB2  LEU   5           2HB      LEU   5   0.234   0.247  -9.612
   36    HB3  LEU   5           3HB      LEU   5  -0.978   1.510  -9.401
   37    HG   LEU   5           HG       LEU   5   0.153  -0.145  -7.147
   38   HD11  LEU   5          1HD1      LEU   5   2.012   1.057  -7.614
   39   HD12  LEU   5          2HD1      LEU   5   1.143   2.296  -6.709
   40   HD13  LEU   5          3HD1      LEU   5   1.122   2.315  -8.472
   41   HD21  LEU   5          3HD2      LEU   5  -1.956   0.692  -6.513
   42   HD22  LEU   5          1HD2      LEU   5  -1.661   2.249  -7.289
   43   HD23  LEU   5          2HD2      LEU   5  -0.778   1.812  -5.825
   44    H    TYR   6           H        TYR   6  -3.751  -1.166 -10.522
   45    HA   TYR   6           HA       TYR   6  -2.735  -2.749 -12.518
   46    HB2  TYR   6           2HB      TYR   6  -5.194  -2.077 -11.934
   47    HB3  TYR   6           3HB      TYR   6  -4.952  -0.833 -13.156
   48    HD1  TYR   6           HD1      TYR   6  -5.139  -4.462 -12.559
   49    HD2  TYR   6           HD2      TYR   6  -4.858  -1.388 -15.487
   50    HE1  TYR   6           HE1      TYR   6  -5.673  -6.097 -14.317
   51    HE2  TYR   6           HE2      TYR   6  -5.393  -3.014 -17.254
   52    HH   TYR   6           HH       TYR   6  -6.541  -5.204 -17.454
   53    H    ARG   7           H        ARG   7  -2.520   0.688 -12.198
   54    HA   ARG   7           HA       ARG   7  -2.181   1.625 -14.735
   55    HB2  ARG   7           2HB      ARG   7  -1.143   2.366 -12.090
   56    HB3  ARG   7           3HB      ARG   7  -0.144   2.915 -13.429
   57    HG2  ARG   7           2HG      ARG   7  -1.888   4.198 -14.344
   58    HG3  ARG   7           3HG      ARG   7  -3.102   3.410 -13.335
   59    HD2  ARG   7           2HD      ARG   7  -1.892   4.384 -11.342
   60    HD3  ARG   7           3HD      ARG   7  -0.962   5.349 -12.488
   61    HE   ARG   7           HE       ARG   7  -3.730   5.670 -12.959
   62   HH11  ARG   7          1HH1      ARG   7  -1.217   6.561 -10.721
   63   HH12  ARG   7          2HH1      ARG   7  -1.990   8.035 -10.237
   64   HH21  ARG   7          1HH2      ARG   7  -4.757   7.607 -12.332
   65   HH22  ARG   7          2HH2      ARG   7  -4.004   8.628 -11.154
   66    H    ARG   8           H        ARG   8   0.266  -0.025 -12.762
   67    HA   ARG   8           HA       ARG   8   1.926  -0.298 -15.180
   68    HB2  ARG   8           2HB      ARG   8   2.676  -0.258 -12.257
   69    HB3  ARG   8           3HB      ARG   8   3.787  -0.765 -13.523
   70    HG2  ARG   8           2HG      ARG   8   3.210   1.544 -14.577
   71    HG3  ARG   8           3HG      ARG   8   2.694   1.946 -12.938
   72    HD2  ARG   8           2HD      ARG   8   5.383   0.733 -13.490
   73    HD3  ARG   8           3HD      ARG   8   5.115   2.472 -13.606
   74    HE   ARG   8           HE       ARG   8   4.160   1.504 -11.131
   75   HH11  ARG   8          1HH1      ARG   8   7.118   2.184 -12.835
   76   HH12  ARG   8          2HH1      ARG   8   8.028   2.500 -11.395
   77   HH21  ARG   8          1HH2      ARG   8   5.347   1.917  -9.228
   78   HH22  ARG   8          2HH2      ARG   8   7.020   2.346  -9.344
   79    H    ARG   9           H        ARG   9   0.573  -1.994 -12.405
   80    HA   ARG   9           HA       ARG   9   1.137  -4.537 -13.780
   81    HB2  ARG   9           2HB      ARG   9   1.232  -3.968 -10.814
   82    HB3  ARG   9           3HB      ARG   9   1.291  -5.581 -11.511
   83    HG2  ARG   9           2HG      ARG   9   3.356  -4.989 -12.689
   84    HG3  ARG   9           3HG      ARG   9   3.300  -3.384 -11.957
   85    HD2  ARG   9           2HD      ARG   9   4.827  -4.954 -10.791
   86    HD3  ARG   9           3HD      ARG   9   3.548  -4.316  -9.759
   87    HE   ARG   9           HE       ARG   9   2.695  -6.436  -9.551
   88   HH11  ARG   9          1HH1      ARG   9   5.023  -6.369 -12.139
   89   HH12  ARG   9          2HH1      ARG   9   5.048  -8.090 -12.336
   90   HH21  ARG   9          1HH2      ARG   9   2.719  -8.704  -9.802
   91   HH22  ARG   9          2HH2      ARG   9   3.737  -9.417 -11.007
   92    H    PHE  10           H        PHE  10  -0.425  -4.968 -10.857
   93    HA   PHE  10           HA       PHE  10  -3.112  -4.645 -11.952
   94    HB2  PHE  10           2HB      PHE  10  -2.485  -6.920 -12.586
   95    HB3  PHE  10           3HB      PHE  10  -2.042  -7.280 -10.921
   96    HD1  PHE  10           HD1      PHE  10  -3.971  -6.867  -9.167
   97    HD2  PHE  10           HD2      PHE  10  -4.561  -7.557 -13.325
   98    HE1  PHE  10           HE1      PHE  10  -6.272  -7.611  -8.713
   99    HE2  PHE  10           HE2      PHE  10  -6.863  -8.301 -12.878
  100    HZ   PHE  10           HZ       PHE  10  -7.722  -8.327 -10.570
  101    H    VAL  11           H        VAL  11  -4.756  -4.565 -10.382
  102    HA   VAL  11           HA       VAL  11  -3.885  -3.588  -7.827
  103    HB   VAL  11           HB       VAL  11  -5.810  -2.583  -8.972
  104   HG11  VAL  11          1HG1      VAL  11  -6.560  -5.019  -9.706
  105   HG12  VAL  11          2HG1      VAL  11  -7.564  -4.870  -8.262
  106   HG13  VAL  11          3HG1      VAL  11  -7.710  -3.690  -9.565
  107   HG21  VAL  11          3HG2      VAL  11  -7.456  -3.146  -6.878
  108   HG22  VAL  11          1HG2      VAL  11  -5.887  -3.632  -6.235
  109   HG23  VAL  11          2HG2      VAL  11  -6.127  -1.988  -6.828
  110    H    VAL  12           H        VAL  12  -2.887  -5.987  -7.723
  111    HA   VAL  12           HA       VAL  12  -4.685  -7.993  -6.738
  112    HB   VAL  12           HB       VAL  12  -2.569  -9.201  -6.112
  113   HG11  VAL  12          1HG1      VAL  12  -2.533  -8.251  -8.965
  114   HG12  VAL  12          2HG1      VAL  12  -2.071  -9.832  -8.332
  115   HG13  VAL  12          3HG1      VAL  12  -3.767  -9.346  -8.340
  116   HG21  VAL  12          3HG2      VAL  12  -0.897  -7.423  -7.716
  117   HG22  VAL  12          1HG2      VAL  12  -1.432  -6.712  -6.193
  118   HG23  VAL  12          2HG2      VAL  12  -0.548  -8.238  -6.192
  119    H    GLY  13           H        GLY  13  -2.010  -8.118  -4.792
  120    HA2  GLY  13           2HA      GLY  13  -3.446  -6.800  -2.569
  121    HA3  GLY  13           3HA      GLY  13  -2.590  -8.323  -2.382
  122    H    ARG  14           H        ARG  14  -0.232  -7.838  -3.684
  123    HA   ARG  14           HA       ARG  14   1.271  -6.495  -1.754
  124    HB2  ARG  14           2HB      ARG  14   3.100  -6.546  -3.515
  125    HB3  ARG  14           3HB      ARG  14   2.387  -8.097  -3.088
  126    HG2  ARG  14           2HG      ARG  14   0.929  -6.962  -5.266
  127    HG3  ARG  14           3HG      ARG  14   2.654  -6.950  -5.640
  128    HD2  ARG  14           2HD      ARG  14   1.204  -9.373  -4.596
  129    HD3  ARG  14           3HD      ARG  14   1.396  -9.029  -6.315
  130    HE   ARG  14           HE       ARG  14   3.897  -8.970  -4.972
  131   HH11  ARG  14          1HH1      ARG  14   1.475 -11.136  -6.221
  132   HH12  ARG  14          2HH1      ARG  14   2.588 -12.437  -6.486
  133   HH21  ARG  14          1HH2      ARG  14   5.372 -10.675  -5.316
  134   HH22  ARG  14          2HH2      ARG  14   4.804 -12.174  -5.969