*HEADER    ANTIMICROBIAL PROTEIN                   25-NOV-11   2LM8              
*TITLE     STRUCTURE, ACTIVITY AND INTERACTIONS OF THE CYSTEINE DELETED ANALOG OF
*TITLE    2 TACHYPLESIN-1 WITH LIPOPOLYSACCHARIDE MICELLES                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CDT-LPS;                                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    ANTIMICROBIAL PROTEIN                                                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.JOSHI, S.BHATTACHARJYA, R.SARAVANAN                                 
*REVDAT   1   25-APR-12 2LM8    0                                                


  6 TYR  H       6 TYR  HB2     3.24            #peak     3 #SUP  0.63  #QF  0.63
 10 TYR  HA     11 ARG  H       3.25            #peak     6 #SUP  0.84  #QF  0.84
  6 TYR  HA      7 ARG  H       3.13            #peak     7 #SUP  0.76  #QF  0.76
  2 TRP  HA      3 PHE  H       3.55            #peak    11 #SUP  0.99  #QF  0.99
  2 TRP  HB2     3 PHE  H       3.78            #peak    13 #SUP  0.97  #QF  0.72
  3 PHE  H       3 PHE  HB2     3.90            #peak    14 #SUP  0.97  #QF  0.97
  3 PHE  HB3     4 ARG  H       3.38            #peak    15 #SUP  0.82  #QF  0.82
  3 PHE  HA      4 ARG  H       3.31            #peak    17 #SUP  0.84  #QF  0.84
  3 PHE  HB2     4 ARG  H       4.07            #peak    18 #SUP  0.90  #QF  0.90
  4 ARG  HA      5 VAL  H       3.25            #peak    19 #SUP  0.83  #QF  0.72
  5 VAL  HA      6 TYR  H       3.15            #peak    20 #SUP  0.81  #QF  0.81
  7 ARG  HA      8 GLY  H       3.45            #peak    21 #SUP  0.84  #QF  0.84
  8 GLY  QA      9 ILE  H       2.92            #peak    23 #SUP  0.97  #QF  0.97
 12 ARG  HA     13 ARG  H       3.25            #peak    26 #SUP  0.87  #QF  0.87
  8 GLY  H      10 TYR  HA      5.50            #peak    29 #SUP  0.63  #QF  0.63
  2 TRP  H       3 PHE  H       4.63            #peak    35 #SUP  0.99  #QF  0.99
 13 ARG  H      13 ARG  HB2     3.79            #peak    37 #SUP  0.91  #QF  0.91
 13 ARG  H      13 ARG  HB3     3.79            #peak    38 #SUP  0.94  #QF  0.94
 13 ARG  H      13 ARG  QG      3.21            #peak    39 #SUP  0.92  #QF  0.92
 12 ARG  QG     13 ARG  H       2.79            #peak    40 #SUP  0.46  #QF  0.46
  7 ARG  H       7 ARG  QG      3.36            #peak    41 #SUP  0.72  #QF  0.72
  7 ARG  H       7 ARG  HB2     3.24            #peak    43 #SUP  0.82  #QF  0.82
  5 VAL  HB     12 ARG  H       5.50            #peak    45 #SUP  0.96  #QF  0.96
  5 VAL  HB      6 TYR  H       4.05            #peak    46 #SUP  0.98  #QF  0.98
  5 VAL  H       5 VAL  HB      3.75            #peak    47 #SUP  0.97  #QF  0.97
  5 VAL  H       5 VAL  HG12    3.86            #peak    48 #SUP  0.76  #QF  0.76
 11 ARG  H      11 ARG  HB2     3.49            #peak    49 #SUP  0.98  #QF  0.98
 11 ARG  H      11 ARG  HB3     4.00            #peak    50 #SUP  0.94  #QF  0.94
 11 ARG  H      11 ARG  QG      3.62            #peak    51 #SUP  0.90  #QF  0.90
  5 VAL  HG12   11 ARG  H       4.43            #peak    52 #SUP  0.88  #QF  0.88
  9 ILE  H       9 ILE  HB      3.30            #peak    55 #SUP  0.70  #QF  0.70
  9 ILE  H       9 ILE  HG21    3.72            #peak    56 #SUP  0.97  #QF  0.97
  9 ILE  H       9 ILE  HG23    3.91            #peak    57 #SUP  0.95  #QF  0.95
  9 ILE  HG23   10 TYR  H       5.04            #peak    58 #SUP  0.94  #QF  0.94
  7 ARG  H       9 ILE  HG23    5.39            #peak    59 #SUP  0.57  #QF  0.57
  2 TRP  H       2 TRP  HB3     3.60            #peak    60 #SUP  0.89  #QF  0.89
  6 TYR  HB2     7 ARG  H       4.11            #peak    61 #SUP  0.96  #QF  0.96
  6 TYR  H       7 ARG  QD      5.50            #peak    63 #SUP  0.93  #QF  0.93
  4 ARG  H       4 ARG  QG      4.33            #peak    67 #SUP  0.77  #QF  0.77
  4 ARG  QG      5 VAL  H       4.51            #peak    68 #SUP  0.93  #QF  0.93
  4 ARG  H      13 ARG  QD      4.64            #peak    71 #SUP  0.46  #QF  0.46
  2 TRP  HB3     3 PHE  H       3.85            #peak    72 #SUP  0.96  #QF  0.96
  7 ARG  H       7 ARG  QD      3.64            #peak    76 #SUP  0.93  #QF  0.93
  6 TYR  HB3     8 GLY  H       5.31            #peak    77 #SUP  0.83  #QF  0.83
 13 ARG  H      13 ARG  QD      4.54            #peak    82 #SUP  0.88  #QF  0.88
  7 ARG  QD      8 GLY  H       4.92            #peak    84 #SUP  0.99  #QF  0.99
  6 TYR  HB3     7 ARG  H       3.47            #peak    86 #SUP  0.82  #QF  0.82
  5 VAL  H      13 ARG  QD      4.43            #peak    88 #SUP  0.34  #QF  0.34
  4 ARG  H       4 ARG  QD      4.26            #peak    89 #SUP  0.85  #QF  0.85
  4 ARG  QD      5 VAL  H       5.06            #peak    90 #SUP  0.69  #QF  0.69
  7 ARG  HB2     8 GLY  H       4.46            #peak    93 #SUP  0.98  #QF  0.98
  5 VAL  HG13   12 ARG  H       3.55            #peak    96 #SUP  0.70  #QF  0.70
  5 VAL  HG13   13 ARG  H       4.25            #peak    97 #SUP  0.43  #QF  0.43
  5 VAL  HG13   11 ARG  H       4.13            #peak    98 #SUP  0.88  #QF  0.88
  9 ILE  HA     10 TYR  H       2.74            #peak   101 #SUP  0.34  #QF  0.34
  9 ILE  HG21   10 TYR  H       4.79            #peak   104 #SUP  0.93  #QF  0.93
  9 ILE  HG21   11 ARG  H       4.67            #peak   108 #SUP  0.79  #QF  0.79
  6 TYR  H       7 ARG  HA      5.33            #peak   109 #SUP  0.97  #QF  0.97
  8 GLY  H       9 ILE  HA      5.30            #peak   114 #SUP  0.97  #QF  0.97
  1 LYS  HB3     2 TRP  H       4.16            #peak   115 #SUP  0.98  #QF  0.98
  2 TRP  H       5 VAL  HG13    5.50            #peak   119 #SUP  0.55  #QF  0.55
  5 VAL  H       6 TYR  H       4.75            #peak   121 #SUP  1.00
  6 TYR  H       9 ILE  H       4.48            #peak   122 #SUP  0.75  #QF  0.75
  6 TYR  H       8 GLY  H       5.50            #peak   123 #SUP  0.99  #QF  0.99
 10 TYR  H      11 ARG  H       4.61            #peak   126 #SUP  0.94  #QF  0.94
  8 GLY  H      10 TYR  H       5.50            #peak   127 #SUP  0.93  #QF  0.93
 11 ARG  H      12 ARG  H       4.59            #peak   128 #SUP  0.91  #QF  0.91
  7 ARG  H       8 GLY  H       4.55            #peak   131 #SUP  0.94  #QF  0.94
  3 PHE  H       4 ARG  H       4.80            #peak   133 #SUP  1.00
  8 GLY  H       9 ILE  H       3.73            #peak   136 #SUP  0.91  #QF  0.91
  7 ARG  HA      9 ILE  H       4.52            #peak   137 #SUP  0.81  #QF  0.81
  4 ARG  H      13 ARG  HA      5.16            #peak   138 #SUP  0.81  #QF  0.81
  6 TYR  H       9 ILE  HG21    4.57            #peak   141 #SUP  0.87  #QF  0.87
  5 VAL  HG13    6 TYR  H       4.46            #peak   142 #SUP  0.88  #QF  0.88
  9 ILE  HB     10 TYR  H       4.25            #peak   143 #SUP  0.96  #QF  0.96
 11 ARG  HB3    12 ARG  H       2.40            #peak   144 #SUP  0.25  #QF  0.25
  9 ILE  HG23   11 ARG  H       5.50            #peak   145 #SUP  0.95  #QF  0.95
  6 TYR  H       9 ILE  HG23    5.50            #peak   146 #SUP  0.99  #QF  0.99
  1 LYS  HB2     2 TRP  H       4.16            #peak   147 #SUP  0.94  #QF  0.94
  3 PHE  H      13 ARG  HA      5.24            #peak   148 #SUP  0.61  #QF  0.61
  8 GLY  H       9 ILE  HG21    5.43            #peak   156 #SUP  0.98  #QF  0.98
  2 TRP  HE1     3 PHE  HB3     5.50            #peak   162 #SUP  0.99  #QF  0.94
  2 TRP  HE1    11 ARG  HA      5.50            #peak   170 #SUP  0.93  #QF  0.70
  2 TRP  HE1    13 ARG  HA      5.50            #peak   170 #SUP  0.93  #QF  0.70
  2 TRP  HE1     5 VAL  HA      5.37            #peak   171 #SUP  0.94  #QF  0.71
  2 TRP  HB3     2 TRP  HE1     5.07            #peak   173 #SUP  1.00
  2 TRP  HE1    11 ARG  QD      4.47            #peak   174 #SUP  0.85  #QF  0.85
  2 TRP  HE1     3 PHE  HB2     5.50            #peak   175 #SUP  0.98  #QF  0.98
  2 TRP  HE1     5 VAL  HB      5.50            #peak   176 #SUP  0.99  #QF  0.99
  2 TRP  HE1    11 ARG  HB2     5.04            #peak   178 #SUP  0.91  #QF  0.91
  2 TRP  HE1    11 ARG  HB3     4.15            #peak   179 #SUP  0.81  #QF  0.81
  2 TRP  HE1    11 ARG  QG      4.36            #peak   180 #SUP  0.48  #QF  0.48
  2 TRP  HE1     9 ILE  HG21    4.79            #peak   182 #SUP  0.60  #QF  0.60
  2 TRP  HE1     5 VAL  HG12    4.32            #peak   183 #SUP  0.89  #QF  0.89
  2 TRP  HE1     5 VAL  HG13    4.51            #peak   184 #SUP  0.91  #QF  0.91
  2 TRP  HE1     3 PHE  H       5.35            #peak   185 #SUP  0.99  #QF  0.99
  2 TRP  HE1     4 ARG  H       5.47            #peak   186 #SUP  0.79  #QF  0.79
  2 TRP  HE1    12 ARG  H       5.50            #peak   187 #SUP  0.87  #QF  0.87
  2 TRP  HE1     6 TYR  H       5.24            #peak   188 #SUP  0.65  #QF  0.65
  2 TRP  HA      2 TRP  HD1     4.40            #peak   199 #SUP  0.90  #QF  0.90
  2 TRP  HA      2 TRP  HE3     4.23            #peak   200 #SUP  0.97  #QF  0.97
  2 TRP  HE3     3 PHE  HA      5.33            #peak   201 #SUP  0.87  #QF  0.87
  2 TRP  HB3     2 TRP  HE3     4.09            #peak   204 #SUP  0.97  #QF  0.97
  2 TRP  HE3    11 ARG  QD      4.59            #peak   205 #SUP  0.75  #QF  0.75
  2 TRP  HE3     3 PHE  HB2     4.95            #peak   206 #SUP  0.77  #QF  0.77
  2 TRP  HB2     2 TRP  HE3     3.98            #peak   207 #SUP  0.98  #QF  0.98
  2 TRP  HZ2     5 VAL  HG13    4.50            #peak   214 #SUP  0.89  #QF  0.89
  2 TRP  HZ2     9 ILE  HG21    4.59            #peak   216 #SUP  0.74  #QF  0.74
  2 TRP  HZ2     3 PHE  HB3     4.39            #peak   219 #SUP  0.46  #QF  0.46
  2 TRP  HZ2    11 ARG  QD      4.31            #peak   220 #SUP  0.85  #QF  0.85
  2 TRP  H      11 ARG  QD      5.33            #peak   221 #SUP  0.50  #QF  0.50
  3 PHE  HA      3 PHE  HD1     4.25            #peak   223 #SUP  0.97  #QF  0.97
  3 PHE  HD1     4 ARG  HA      4.60            #peak   225 #SUP  0.48  #QF  0.48
  3 PHE  HB3     3 PHE  HD1     3.23            #peak   227 #SUP  0.83  #QF  0.83
  2 TRP  HD1     3 PHE  HA      5.50            #peak   234 #SUP  0.83  #QF  0.83
  2 TRP  HB3     2 TRP  HD1     2.89            #peak   236 #SUP  0.75  #QF  0.75
  9 ILE  H      10 TYR  H       4.28            #peak   240 #SUP  0.97  #QF  0.97
  7 ARG  HB3     8 GLY  H       3.83            #peak   242 #SUP  0.85  #QF  0.85
  5 VAL  HG13   11 ARG  HA      4.86            #peak   245 #SUP  0.86  #QF  0.77
  5 VAL  HG13   13 ARG  HA      5.21            #peak   245 #SUP  0.86  #QF  0.77
 11 ARG  HA     11 ARG  QG      3.61            #peak   247 #SUP  0.75  #QF  0.75
 11 ARG  HA     11 ARG  HB3     2.70            #peak   248 #SUP  0.77  #QF  0.77
  7 ARG  HA      7 ARG  QD      3.16            #peak   250 #SUP  0.33  #QF  0.33
  2 TRP  HD1    11 ARG  HB3     2.70            #peak   254 #SUP  0.45  #QF  0.45
  5 VAL  H       6 TYR  HA      5.46            #peak   257 #SUP  0.60  #QF  0.60
  3 PHE  HA      3 PHE  HE1     4.52            #peak   258 #SUP  0.90  #QF  0.90
 11 ARG  HA     11 ARG  HH11    3.62            #peak   260 #SUP  0.57  #QF  0.57
 11 ARG  HB3    11 ARG  HH11    2.70            #peak   267 #SUP  0.53  #QF  0.53
 11 ARG  QG     11 ARG  HH11    2.91            #peak   268 #SUP  0.37  #QF  0.37
  9 ILE  HA     10 TYR  HD1     4.21            #peak   274 #SUP  0.39  #QF  0.39
  1 LYS  QB      2 TRP  H       3.63            #peak   147
  1 LYS  QB      2 TRP  HA      4.54            #peak   160
  2 TRP  HZ2     9 ILE  QG1     5.20            #peak   215
  4 ARG  H       4 ARG  QB      3.08            #peak    65
  4 ARG  QB      5 VAL  H       4.15            #peak    69
 10 TYR  H      10 TYR  QB      3.46            #peak     1
 10 TYR  QB     11 ARG  H       3.73            #peak    91
 12 ARG  H      12 ARG  QB      3.16            #peak    44
 13 ARG  H      13 ARG  QB      3.09            #peak    38
 13 ARG  HA     13 ARG  QB      2.56            #peak   249

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           H        LYS   1   1.806   0.000   0.856
    2    HA   LYS   1           HA       LYS   1   1.415  -0.226  -2.049
    3    HB2  LYS   1           2HB      LYS   1   3.239   1.682  -0.586
    4    HB3  LYS   1           3HB      LYS   1   3.428   1.299  -2.292
    5    HG2  LYS   1           2HG      LYS   1   2.176   3.181  -2.474
    6    HG3  LYS   1           3HG      LYS   1   0.877   1.991  -2.360
    7    HD2  LYS   1           2HD      LYS   1   1.170   2.448   0.228
    8    HD3  LYS   1           3HD      LYS   1   1.821   3.981  -0.358
    9    HE2  LYS   1           2HE      LYS   1  -0.194   4.579  -1.377
   10    HE3  LYS   1           3HE      LYS   1  -0.801   2.924  -1.358
   11    HZ1  LYS   1           3HZ      LYS   1  -0.324   4.505   1.104
   12    HZ2  LYS   1           1HZ      LYS   1  -1.152   3.037   0.965
   13    HZ3  LYS   1           2HZ      LYS   1  -1.819   4.448   0.314
   14    H    TRP   2           H        TRP   2   3.525  -0.827  -3.161
   15    HA   TRP   2           HA       TRP   2   4.953  -2.794  -1.494
   16    HB2  TRP   2           2HB      TRP   2   4.737  -4.351  -3.115
   17    HB3  TRP   2           3HB      TRP   2   3.438  -3.319  -3.707
   18    HD1  TRP   2           HD1      TRP   2   4.304  -1.422  -5.626
   19    HE1  TRP   2           HE1      TRP   2   5.941  -1.806  -7.575
   20    HE3  TRP   2           HE3      TRP   2   6.646  -5.626  -3.901
   21    HZ2  TRP   2           HZ2      TRP   2   7.958  -3.648  -8.286
   22    HZ3  TRP   2           HZ3      TRP   2   8.418  -6.637  -5.276
   23    HH2  TRP   2           HH2      TRP   2   9.059  -5.668  -7.423
   24    H    PHE   3           H        PHE   3   7.102  -3.437  -2.802
   25    HA   PHE   3           HA       PHE   3   8.888  -1.346  -2.468
   26    HB2  PHE   3           2HB      PHE   3   8.984  -4.062  -3.465
   27    HB3  PHE   3           3HB      PHE   3  10.063  -3.018  -4.384
   28    HD1  PHE   3           HD1      PHE   3  11.286  -1.239  -2.642
   29    HD2  PHE   3           HD2      PHE   3  10.049  -5.226  -1.815
   30    HE1  PHE   3           HE1      PHE   3  12.958  -1.380  -0.842
   31    HE2  PHE   3           HE2      PHE   3  11.718  -5.374  -0.013
   32    HZ   PHE   3           HZ       PHE   3  13.174  -3.449   0.476
   33    H    ARG   4           H        ARG   4  10.480  -0.812  -4.447
   34    HA   ARG   4           HA       ARG   4   9.188   1.081  -6.011
   35    HB2  ARG   4           2HB      ARG   4  11.861  -0.231  -6.091
   36    HB3  ARG   4           3HB      ARG   4  11.357   0.682  -7.507
   37    HG2  ARG   4           2HG      ARG   4  12.464   2.291  -6.317
   38    HG3  ARG   4           3HG      ARG   4  10.811   2.538  -5.750
   39    HD2  ARG   4           2HD      ARG   4  12.225   2.557  -3.837
   40    HD3  ARG   4           3HD      ARG   4  11.345   1.029  -3.823
   41    HE   ARG   4           HE       ARG   4  13.739   0.551  -5.126
   42   HH11  ARG   4          1HH1      ARG   4  12.694   1.576  -1.967
   43   HH12  ARG   4          2HH1      ARG   4  14.060   0.892  -1.150
   44   HH21  ARG   4          1HH2      ARG   4  15.542  -0.353  -4.062
   45   HH22  ARG   4          2HH2      ARG   4  15.680  -0.204  -2.343
   46    H    VAL   5           H        VAL   5   8.017   0.999  -7.816
   47    HA   VAL   5           HA       VAL   5   7.281  -1.478  -8.984
   48    HB   VAL   5           HB       VAL   5   5.977  -0.188 -10.560
   49   HG11  VAL   5          1HG1      VAL   5   5.960   0.843  -7.736
   50   HG12  VAL   5          2HG1      VAL   5   4.738   1.302  -8.924
   51   HG13  VAL   5          3HG1      VAL   5   4.925  -0.389  -8.458
   52   HG21  VAL   5          3HG2      VAL   5   7.522   1.525 -11.187
   53   HG22  VAL   5          1HG2      VAL   5   6.094   2.309 -10.512
   54   HG23  VAL   5          2HG2      VAL   5   7.561   2.166  -9.544
   55    H    TYR   6           H        TYR   6   7.271  -1.546 -11.537
   56    HA   TYR   6           HA       TYR   6   9.713  -0.601 -12.752
   57    HB2  TYR   6           2HB      TYR   6   9.329  -3.463 -11.962
   58    HB3  TYR   6           3HB      TYR   6  10.216  -3.087 -13.435
   59    HD1  TYR   6           HD2      TYR   6  12.283  -1.663 -13.281
   60    HD2  TYR   6           HD1      TYR   6  10.336  -3.226  -9.836
   61    HE1  TYR   6           HE2      TYR   6  14.321  -1.274 -11.960
   62    HE2  TYR   6           HE1      TYR   6  12.368  -2.839  -8.505
   63    HH   TYR   6           HH       TYR   6  15.221  -2.540  -9.548
   64    H    ARG   7           H        ARG   7   9.885  -1.443 -15.055
   65    HA   ARG   7           HA       ARG   7   7.362  -1.029 -16.341
   66    HB2  ARG   7           2HB      ARG   7   9.914  -1.927 -17.671
   67    HB3  ARG   7           3HB      ARG   7   8.576  -1.039 -18.388
   68    HG2  ARG   7           2HG      ARG   7  10.402   0.034 -16.248
   69    HG3  ARG   7           3HG      ARG   7  10.558   0.360 -17.975
   70    HD2  ARG   7           2HD      ARG   7   8.107   1.001 -16.343
   71    HD3  ARG   7           3HD      ARG   7   9.397   2.153 -16.683
   72    HE   ARG   7           HE       ARG   7   7.322   1.314 -18.466
   73   HH11  ARG   7          1HH1      ARG   7  10.589   2.501 -18.281
   74   HH12  ARG   7          2HH1      ARG   7  10.563   3.201 -19.866
   75   HH21  ARG   7          1HH2      ARG   7   7.275   2.231 -20.554
   76   HH22  ARG   7          2HH2      ARG   7   8.677   3.047 -21.158
   77    H    GLY   8           H        GLY   8   5.881  -2.591 -16.420
   78    HA2  GLY   8           2HA      GLY   8   5.617  -4.720 -17.862
   79    HA3  GLY   8           3HA      GLY   8   6.778  -5.378 -16.718
   80    H    ILE   9           H        ILE   9   5.472  -3.663 -14.577
   81    HA   ILE   9           HA       ILE   9   2.972  -5.171 -14.248
   82    HB   ILE   9           HB       ILE   9   4.666  -6.360 -12.962
   83   HG12  ILE   9          2HG1      ILE   9   3.587  -6.232 -10.732
   84   HG13  ILE   9          3HG1      ILE   9   2.776  -4.751 -11.230
   85   HG21  ILE   9          1HG2      ILE   9   5.065  -3.920 -11.266
   86   HG22  ILE   9          2HG2      ILE   9   6.035  -5.390 -11.339
   87   HG23  ILE   9          3HG2      ILE   9   6.077  -4.239 -12.674
   88   HD11  ILE   9          3HD1      ILE   9   2.433  -7.390 -12.625
   89   HD12  ILE   9          1HD1      ILE   9   1.377  -6.808 -11.339
   90   HD13  ILE   9          2HD1      ILE   9   1.492  -5.917 -12.856
   91    H    TYR  10           H        TYR  10   1.317  -3.928 -13.665
   92    HA   TYR  10           HA       TYR  10   1.732  -1.132 -13.142
   93    HB2  TYR  10           2HB      TYR  10  -0.616  -2.899 -13.620
   94    HB3  TYR  10           3HB      TYR  10  -0.898  -1.383 -12.771
   95    HD1  TYR  10           HD1      TYR  10   1.446  -2.166 -15.564
   96    HD2  TYR  10           HD2      TYR  10  -1.987  -0.001 -14.289
   97    HE1  TYR  10           HE1      TYR  10   1.406  -0.976 -17.716
   98    HE2  TYR  10           HE2      TYR  10  -2.038   1.195 -16.438
   99    HH   TYR  10           HH       TYR  10  -1.148   0.623 -18.884
  100    H    ARG  11           H        ARG  11   2.362  -0.483 -11.193
  101    HA   ARG  11           HA       ARG  11   0.771  -1.158  -8.880
  102    HB2  ARG  11           2HB      ARG  11   3.615  -2.075  -9.186
  103    HB3  ARG  11           3HB      ARG  11   2.956  -1.719  -7.595
  104    HG2  ARG  11           2HG      ARG  11   1.035  -3.328  -8.395
  105    HG3  ARG  11           3HG      ARG  11   2.300  -3.925  -9.472
  106    HD2  ARG  11           2HD      ARG  11   3.577  -4.731  -7.748
  107    HD3  ARG  11           3HD      ARG  11   2.947  -3.559  -6.592
  108    HE   ARG  11           HE       ARG  11   1.927  -6.168  -7.109
  109   HH11  ARG  11          1HH1      ARG  11   1.005  -2.938  -6.194
  110   HH12  ARG  11          2HH1      ARG  11  -0.415  -3.445  -5.340
  111   HH21  ARG  11          1HH2      ARG  11   0.061  -6.848  -5.988
  112   HH22  ARG  11          2HH2      ARG  11  -0.950  -5.670  -5.223
  113    H    ARG  12           H        ARG  12   1.985  -0.090  -6.855
  114    HA   ARG  12           HA       ARG  12   3.111   2.490  -7.691
  115    HB2  ARG  12           2HB      ARG  12   0.669   2.736  -7.263
  116    HB3  ARG  12           3HB      ARG  12   0.936   2.180  -5.616
  117    HG2  ARG  12           2HG      ARG  12   0.969   4.418  -5.257
  118    HG3  ARG  12           3HG      ARG  12   2.679   4.170  -5.616
  119    HD2  ARG  12           2HD      ARG  12   2.516   5.115  -7.708
  120    HD3  ARG  12           3HD      ARG  12   0.796   4.752  -7.852
  121    HE   ARG  12           HE       ARG  12   1.245   6.625  -5.779
  122   HH11  ARG  12          1HH1      ARG  12   1.177   6.336  -9.247
  123   HH12  ARG  12          2HH1      ARG  12   0.751   7.995  -9.508
  124   HH21  ARG  12          1HH2      ARG  12   0.683   8.811  -6.109
  125   HH22  ARG  12          2HH2      ARG  12   0.471   9.402  -7.722
  126    H    ARG  13           H        ARG  13   4.946   2.895  -6.662
  127    HA   ARG  13           HA       ARG  13   5.761   1.272  -4.426
  128    HB2  ARG  13           2HB      ARG  13   7.902   2.340  -4.644
  129    HB3  ARG  13           3HB      ARG  13   7.313   1.956  -6.256
  130    HG2  ARG  13           2HG      ARG  13   6.715   4.235  -6.655
  131    HG3  ARG  13           3HG      ARG  13   7.058   4.667  -4.979
  132    HD2  ARG  13           2HD      ARG  13   9.358   4.468  -5.270
  133    HD3  ARG  13           3HD      ARG  13   9.184   3.470  -6.713
  134    HE   ARG  13           HE       ARG  13   8.105   6.051  -7.150
  135   HH11  ARG  13          1HH1      ARG  13  11.129   4.352  -6.858
  136   HH12  ARG  13          2HH1      ARG  13  12.002   5.467  -7.856
  137   HH21  ARG  13          1HH2      ARG  13   9.243   7.527  -8.465
  138   HH22  ARG  13          2HH2      ARG  13  10.928   7.274  -8.769
  Start of MODEL    2
    1    H1   LYS   1           H        LYS   1   0.769  -0.957   0.170
    2    HA   LYS   1           HA       LYS   1   1.603   0.453  -2.142
    3    HB2  LYS   1           2HB      LYS   1   2.498   1.460   0.528
    4    HB3  LYS   1           3HB      LYS   1   3.626   1.504  -0.820
    5    HG2  LYS   1           2HG      LYS   1   2.541   3.623  -0.673
    6    HG3  LYS   1           3HG      LYS   1   1.942   2.795  -2.112
    7    HD2  LYS   1           2HD      LYS   1  -0.068   2.124  -0.895
    8    HD3  LYS   1           3HD      LYS   1   0.536   2.925   0.557
    9    HE2  LYS   1           2HE      LYS   1   0.298   4.493  -1.967
   10    HE3  LYS   1           3HE      LYS   1  -1.163   4.125  -1.053
   11    HZ1  LYS   1           3HZ      LYS   1  -0.465   6.151  -0.204
   12    HZ2  LYS   1           1HZ      LYS   1   1.173   5.728  -0.226
   13    HZ3  LYS   1           2HZ      LYS   1   0.139   5.048   0.927
   14    H    TRP   2           H        TRP   2   3.476  -0.403  -3.032
   15    HA   TRP   2           HA       TRP   2   4.722  -2.601  -1.516
   16    HB2  TRP   2           2HB      TRP   2   4.380  -4.076  -3.190
   17    HB3  TRP   2           3HB      TRP   2   3.132  -2.948  -3.712
   18    HD1  TRP   2           HD1      TRP   2   4.069  -1.029  -5.576
   19    HE1  TRP   2           HE1      TRP   2   5.640  -1.430  -7.575
   20    HE3  TRP   2           HE3      TRP   2   6.193  -5.428  -4.069
   21    HZ2  TRP   2           HZ2      TRP   2   7.529  -3.357  -8.404
   22    HZ3  TRP   2           HZ3      TRP   2   7.873  -6.486  -5.523
   23    HH2  TRP   2           HH2      TRP   2   8.525  -5.470  -7.645
   24    H    PHE   3           H        PHE   3   6.801  -3.315  -2.897
   25    HA   PHE   3           HA       PHE   3   8.715  -1.347  -2.524
   26    HB2  PHE   3           2HB      PHE   3   8.628  -4.022  -3.627
   27    HB3  PHE   3           3HB      PHE   3   9.748  -3.007  -4.529
   28    HD1  PHE   3           HD1      PHE   3  11.112  -1.374  -2.751
   29    HD2  PHE   3           HD2      PHE   3   9.655  -5.311  -2.046
   30    HE1  PHE   3           HE1      PHE   3  12.809  -1.685  -0.996
   31    HE2  PHE   3           HE2      PHE   3  11.349  -5.628  -0.291
   32    HZ   PHE   3           HZ       PHE   3  12.928  -3.814   0.237
   33    H    ARG   4           H        ARG   4  10.294  -0.829  -4.517
   34    HA   ARG   4           HA       ARG   4   9.084   1.197  -5.976
   35    HB2  ARG   4           2HB      ARG   4  11.654  -0.316  -6.318
   36    HB3  ARG   4           3HB      ARG   4  11.168   0.888  -7.505
   37    HG2  ARG   4           2HG      ARG   4  10.961   2.512  -5.578
   38    HG3  ARG   4           3HG      ARG   4  11.776   1.296  -4.593
   39    HD2  ARG   4           2HD      ARG   4  13.677   1.327  -6.136
   40    HD3  ARG   4           3HD      ARG   4  12.860   2.543  -7.117
   41    HE   ARG   4           HE       ARG   4  13.552   4.130  -5.631
   42   HH11  ARG   4          1HH1      ARG   4  13.725   1.011  -4.094
   43   HH12  ARG   4          2HH1      ARG   4  14.486   1.615  -2.660
   44   HH21  ARG   4          1HH2      ARG   4  14.554   4.937  -3.748
   45   HH22  ARG   4          2HH2      ARG   4  14.956   3.849  -2.464
   46    H    VAL   5           H        VAL   5   7.878   1.259  -7.759
   47    HA   VAL   5           HA       VAL   5   6.948  -1.111  -8.996
   48    HB   VAL   5           HB       VAL   5   5.736   0.322 -10.521
   49   HG11  VAL   5          1HG1      VAL   5   5.827   1.359  -7.694
   50   HG12  VAL   5          2HG1      VAL   5   4.586   1.806  -8.865
   51   HG13  VAL   5          3HG1      VAL   5   4.753   0.126  -8.354
   52   HG21  VAL   5          3HG2      VAL   5   6.250   2.925  -9.864
   53   HG22  VAL   5          1HG2      VAL   5   7.863   2.211  -9.842
   54   HG23  VAL   5          2HG2      VAL   5   6.868   2.097 -11.294
   55    H    TYR   6           H        TYR   6   7.442  -2.058 -10.928
   56    HA   TYR   6           HA       TYR   6   9.782  -0.979 -12.360
   57    HB2  TYR   6           2HB      TYR   6  10.000  -3.190 -10.998
   58    HB3  TYR   6           3HB      TYR   6   9.108  -3.904 -12.336
   59    HD1  TYR   6           HD2      TYR   6  12.206  -2.063 -11.471
   60    HD2  TYR   6           HD1      TYR   6  10.187  -4.439 -14.366
   61    HE1  TYR   6           HE2      TYR   6  14.300  -2.285 -12.740
   62    HE2  TYR   6           HE1      TYR   6  12.276  -4.669 -15.643
   63    HH   TYR   6           HH       TYR   6  14.545  -3.065 -15.764
   64    H    ARG   7           H        ARG   7   9.898  -1.481 -14.645
   65    HA   ARG   7           HA       ARG   7   7.420  -1.035 -15.963
   66    HB2  ARG   7           2HB      ARG   7  10.203  -1.629 -16.955
   67    HB3  ARG   7           3HB      ARG   7   8.845  -1.412 -18.051
   68    HG2  ARG   7           2HG      ARG   7   9.859   0.678 -17.978
   69    HG3  ARG   7           3HG      ARG   7   8.490   0.830 -16.874
   70    HD2  ARG   7           2HD      ARG   7   9.880   0.650 -14.973
   71    HD3  ARG   7           3HD      ARG   7  11.248   0.091 -15.934
   72    HE   ARG   7           HE       ARG   7  10.512   2.792 -15.425
   73   HH11  ARG   7          1HH1      ARG   7  11.918   0.692 -17.819
   74   HH12  ARG   7          2HH1      ARG   7  12.843   1.951 -18.569
   75   HH21  ARG   7          1HH2      ARG   7  11.725   4.457 -16.403
   76   HH22  ARG   7          2HH2      ARG   7  12.733   4.092 -17.762
   77    H    GLY   8           H        GLY   8   5.916  -2.563 -16.159
   78    HA2  GLY   8           2HA      GLY   8   5.676  -4.621 -17.718
   79    HA3  GLY   8           3HA      GLY   8   6.764  -5.351 -16.546
   80    H    ILE   9           H        ILE   9   5.426  -3.735 -14.378
   81    HA   ILE   9           HA       ILE   9   2.871  -5.185 -14.237
   82    HB   ILE   9           HB       ILE   9   4.481  -6.452 -12.919
   83   HG12  ILE   9          2HG1      ILE   9   3.301  -6.370 -10.730
   84   HG13  ILE   9          3HG1      ILE   9   2.525  -4.873 -11.234
   85   HG21  ILE   9          1HG2      ILE   9   4.838  -4.082 -11.116
   86   HG22  ILE   9          2HG2      ILE   9   5.784  -5.567 -11.193
   87   HG23  ILE   9          3HG2      ILE   9   5.914  -4.372 -12.483
   88   HD11  ILE   9          3HD1      ILE   9   2.211  -7.128 -13.086
   89   HD12  ILE   9          1HD1      ILE   9   1.440  -7.323 -11.511
   90   HD13  ILE   9          2HD1      ILE   9   1.036  -5.938 -12.526
   91    H    TYR  10           H        TYR  10   1.211  -3.935 -13.683
   92    HA   TYR  10           HA       TYR  10   1.618  -1.164 -13.091
   93    HB2  TYR  10           2HB      TYR  10  -0.773  -2.926 -13.480
   94    HB3  TYR  10           3HB      TYR  10  -0.983  -1.330 -12.769
   95    HD1  TYR  10           HD2      TYR  10  -0.516   0.689 -14.085
   96    HD2  TYR  10           HD1      TYR  10  -0.212  -3.190 -15.808
   97    HE1  TYR  10           HE2      TYR  10  -0.535   1.691 -16.330
   98    HE2  TYR  10           HE1      TYR  10  -0.229  -2.198 -18.058
   99    HH   TYR  10           HH       TYR  10  -1.106   1.004 -18.649
  100    H    ARG  11           H        ARG  11   2.249  -0.532 -11.137
  101    HA   ARG  11           HA       ARG  11   0.674  -1.275  -8.824
  102    HB2  ARG  11           2HB      ARG  11   3.557  -2.053  -9.148
  103    HB3  ARG  11           3HB      ARG  11   2.884  -1.748  -7.552
  104    HG2  ARG  11           2HG      ARG  11   1.125  -3.461  -8.080
  105    HG3  ARG  11           3HG      ARG  11   2.057  -3.858  -9.524
  106    HD2  ARG  11           2HD      ARG  11   3.790  -4.769  -8.321
  107    HD3  ARG  11           3HD      ARG  11   3.442  -3.802  -6.888
  108    HE   ARG  11           HE       ARG  11   2.452  -6.397  -7.462
  109   HH11  ARG  11          1HH1      ARG  11   1.560  -3.361  -6.010
  110   HH12  ARG  11          2HH1      ARG  11   0.403  -4.067  -4.932
  111   HH21  ARG  11          1HH2      ARG  11   0.931  -7.339  -6.047
  112   HH22  ARG  11          2HH2      ARG  11   0.047  -6.330  -4.953
  113    H    ARG  12           H        ARG  12   1.828  -0.164  -6.796
  114    HA   ARG  12           HA       ARG  12   2.912   2.439  -7.587
  115    HB2  ARG  12           2HB      ARG  12   0.474   2.718  -7.358
  116    HB3  ARG  12           3HB      ARG  12   0.561   2.083  -5.720
  117    HG2  ARG  12           2HG      ARG  12   1.887   3.972  -5.014
  118    HG3  ARG  12           3HG      ARG  12   1.937   4.587  -6.667
  119    HD2  ARG  12           2HD      ARG  12  -0.653   4.533  -6.488
  120    HD3  ARG  12           3HD      ARG  12  -0.358   4.483  -4.750
  121    HE   ARG  12           HE       ARG  12   0.179   6.697  -4.834
  122   HH11  ARG  12          1HH1      ARG  12   0.448   5.364  -8.039
  123   HH12  ARG  12          2HH1      ARG  12   0.758   6.894  -8.790
  124   HH21  ARG  12          1HH2      ARG  12   0.586   8.717  -5.812
  125   HH22  ARG  12          2HH2      ARG  12   0.838   8.801  -7.522
  126    H    ARG  13           H        ARG  13   4.520   3.114  -6.304
  127    HA   ARG  13           HA       ARG  13   5.695   1.466  -4.400
  128    HB2  ARG  13           2HB      ARG  13   5.967   4.471  -4.577
  129    HB3  ARG  13           3HB      ARG  13   7.108   3.358  -3.835
  130    HG2  ARG  13           2HG      ARG  13   7.294   2.292  -6.151
  131    HG3  ARG  13           3HG      ARG  13   6.496   3.752  -6.740
  132    HD2  ARG  13           2HD      ARG  13   8.331   4.992  -5.389
  133    HD3  ARG  13           3HD      ARG  13   9.179   3.448  -5.451
  134    HE   ARG  13           HE       ARG  13   8.290   4.248  -8.030
  135   HH11  ARG  13          1HH1      ARG  13  10.741   4.837  -5.628
  136   HH12  ARG  13          2HH1      ARG  13  11.921   5.376  -6.777
  137   HH21  ARG  13          1HH2      ARG  13   9.835   4.956  -9.551
  138   HH22  ARG  13          2HH2      ARG  13  11.405   5.444  -9.008
  Start of MODEL    3
    1    H1   LYS   1           H        LYS   1   0.810  -0.230   0.550
    2    HA   LYS   1           HA       LYS   1   1.707   0.273  -2.181
    3    HB2  LYS   1           2HB      LYS   1   2.896   1.117   0.469
    4    HB3  LYS   1           3HB      LYS   1   3.486   1.610  -1.113
    5    HG2  LYS   1           2HG      LYS   1   2.218   3.423  -0.595
    6    HG3  LYS   1           3HG      LYS   1   0.995   2.435  -1.398
    7    HD2  LYS   1           2HD      LYS   1   0.069   1.740   0.668
    8    HD3  LYS   1           3HD      LYS   1   1.447   2.365   1.577
    9    HE2  LYS   1           2HE      LYS   1  -0.138   4.258  -0.086
   10    HE3  LYS   1           3HE      LYS   1  -0.832   3.691   1.432
   11    HZ1  LYS   1           3HZ      LYS   1   0.998   5.728   1.094
   12    HZ2  LYS   1           1HZ      LYS   1   1.868   4.461   1.801
   13    HZ3  LYS   1           2HZ      LYS   1   0.478   5.057   2.557
   14    H    TRP   2           H        TRP   2   3.330  -0.789  -3.157
   15    HA   TRP   2           HA       TRP   2   4.718  -2.862  -1.591
   16    HB2  TRP   2           2HB      TRP   2   4.419  -4.334  -3.277
   17    HB3  TRP   2           3HB      TRP   2   3.157  -3.224  -3.806
   18    HD1  TRP   2           HD1      TRP   2   4.081  -1.279  -5.649
   19    HE1  TRP   2           HE1      TRP   2   5.679  -1.643  -7.634
   20    HE3  TRP   2           HE3      TRP   2   6.263  -5.651  -4.144
   21    HZ2  TRP   2           HZ2      TRP   2   7.608  -3.533  -8.454
   22    HZ3  TRP   2           HZ3      TRP   2   7.975  -6.672  -5.587
   23    HH2  TRP   2           HH2      TRP   2   8.632  -5.634  -7.697
   24    H    PHE   3           H        PHE   3   6.824  -3.534  -2.955
   25    HA   PHE   3           HA       PHE   3   8.700  -1.537  -2.551
   26    HB2  PHE   3           2HB      PHE   3   8.670  -4.207  -3.670
   27    HB3  PHE   3           3HB      PHE   3   9.781  -3.168  -4.555
   28    HD1  PHE   3           HD1      PHE   3  11.101  -1.523  -2.755
   29    HD2  PHE   3           HD2      PHE   3   9.701  -5.487  -2.085
   30    HE1  PHE   3           HE1      PHE   3  12.785  -1.816  -0.985
   31    HE2  PHE   3           HE2      PHE   3  11.382  -5.785  -0.314
   32    HZ   PHE   3           HZ       PHE   3  12.927  -3.948   0.239
   33    H    ARG   4           H        ARG   4  10.291  -0.981  -4.525
   34    HA   ARG   4           HA       ARG   4   9.063   1.033  -5.986
   35    HB2  ARG   4           2HB      ARG   4  11.581   0.549  -5.523
   36    HB3  ARG   4           3HB      ARG   4  11.508  -0.357  -7.028
   37    HG2  ARG   4           2HG      ARG   4  11.256   1.512  -8.306
   38    HG3  ARG   4           3HG      ARG   4  10.454   2.417  -7.021
   39    HD2  ARG   4           2HD      ARG   4  12.497   3.467  -7.092
   40    HD3  ARG   4           3HD      ARG   4  12.785   2.248  -5.852
   41    HE   ARG   4           HE       ARG   4  13.477   1.249  -8.408
   42   HH11  ARG   4          1HH1      ARG   4  14.570   3.429  -5.924
   43   HH12  ARG   4          2HH1      ARG   4  16.245   3.265  -6.334
   44   HH21  ARG   4          1HH2      ARG   4  15.680   1.024  -8.958
   45   HH22  ARG   4          2HH2      ARG   4  16.875   1.897  -8.061
   46    H    VAL   5           H        VAL   5   7.872   1.083  -7.780
   47    HA   VAL   5           HA       VAL   5   7.027  -1.311  -9.050
   48    HB   VAL   5           HB       VAL   5   5.743   0.098 -10.538
   49   HG11  VAL   5          1HG1      VAL   5   5.806   0.965  -7.662
   50   HG12  VAL   5          2HG1      VAL   5   4.597   1.563  -8.800
   51   HG13  VAL   5          3HG1      VAL   5   4.700  -0.162  -8.447
   52   HG21  VAL   5          3HG2      VAL   5   7.530   2.280  -9.505
   53   HG22  VAL   5          1HG2      VAL   5   7.211   1.811 -11.175
   54   HG23  VAL   5          2HG2      VAL   5   5.962   2.627 -10.235
   55    H    TYR   6           H        TYR   6   7.302  -1.928 -11.250
   56    HA   TYR   6           HA       TYR   6   9.657  -0.787 -12.588
   57    HB2  TYR   6           2HB      TYR   6   9.148  -3.641 -11.844
   58    HB3  TYR   6           3HB      TYR   6  10.052  -3.284 -13.311
   59    HD1  TYR   6           HD1      TYR   6  10.052  -3.023  -9.642
   60    HD2  TYR   6           HD2      TYR   6  12.289  -2.408 -13.209
   61    HE1  TYR   6           HE1      TYR   6  12.097  -2.742  -8.304
   62    HE2  TYR   6           HE2      TYR   6  14.340  -2.127 -11.881
   63    HH   TYR   6           HH       TYR   6  15.247  -2.217  -9.853
   64    H    ARG   7           H        ARG   7   9.803  -1.530 -14.905
   65    HA   ARG   7           HA       ARG   7   7.305  -1.014 -16.192
   66    HB2  ARG   7           2HB      ARG   7  10.061  -1.685 -17.212
   67    HB3  ARG   7           3HB      ARG   7   8.690  -1.476 -18.293
   68    HG2  ARG   7           2HG      ARG   7   9.737   0.599 -18.294
   69    HG3  ARG   7           3HG      ARG   7   8.391   0.804 -17.171
   70    HD2  ARG   7           2HD      ARG   7   9.814   0.645 -15.290
   71    HD3  ARG   7           3HD      ARG   7  11.157   0.050 -16.265
   72    HE   ARG   7           HE       ARG   7  10.364   2.790 -15.887
   73   HH11  ARG   7          1HH1      ARG   7  12.052   0.544 -17.943
   74   HH12  ARG   7          2HH1      ARG   7  13.058   1.757 -18.663
   75   HH21  ARG   7          1HH2      ARG   7  11.683   4.396 -16.827
   76   HH22  ARG   7          2HH2      ARG   7  12.848   3.948 -18.027
   77    H    GLY   8           H        GLY   8   5.769  -2.516 -16.334
   78    HA2  GLY   8           2HA      GLY   8   5.460  -4.607 -17.830
   79    HA3  GLY   8           3HA      GLY   8   6.560  -5.329 -16.665
   80    H    ILE   9           H        ILE   9   5.274  -3.608 -14.526
   81    HA   ILE   9           HA       ILE   9   2.701  -5.007 -14.294
   82    HB   ILE   9           HB       ILE   9   4.305  -6.297 -12.990
   83   HG12  ILE   9          2HG1      ILE   9   3.176  -6.157 -10.783
   84   HG13  ILE   9          3HG1      ILE   9   2.440  -4.637 -11.279
   85   HG21  ILE   9          1HG2      ILE   9   4.769  -3.908 -11.238
   86   HG22  ILE   9          2HG2      ILE   9   5.671  -5.421 -11.309
   87   HG23  ILE   9          3HG2      ILE   9   5.804  -4.252 -12.623
   88   HD11  ILE   9          3HD1      ILE   9   0.849  -5.665 -12.450
   89   HD12  ILE   9          1HD1      ILE   9   1.979  -6.825 -13.149
   90   HD13  ILE   9          2HD1      ILE   9   1.313  -7.102 -11.539
   91    H    TYR  10           H        TYR  10   1.087  -3.703 -13.731
   92    HA   TYR  10           HA       TYR  10   1.599  -0.938 -13.159
   93    HB2  TYR  10           2HB      TYR  10  -0.986  -2.505 -13.252
   94    HB3  TYR  10           3HB      TYR  10  -0.881  -0.756 -13.081
   95    HD1  TYR  10           HD1      TYR  10  -0.361  -3.589 -15.369
   96    HD2  TYR  10           HD2      TYR  10  -0.364   0.646 -14.965
   97    HE1  TYR  10           HE1      TYR  10  -0.312  -3.361 -17.818
   98    HE2  TYR  10           HE2      TYR  10  -0.316   0.886 -17.412
   99    HH   TYR  10           HH       TYR  10   0.348  -0.410 -19.375
  100    H    ARG  11           H        ARG  11   2.237  -0.329 -11.200
  101    HA   ARG  11           HA       ARG  11   0.608  -0.962  -8.904
  102    HB2  ARG  11           2HB      ARG  11   3.407  -2.004  -9.208
  103    HB3  ARG  11           3HB      ARG  11   2.771  -1.617  -7.615
  104    HG2  ARG  11           2HG      ARG  11   0.773  -3.134  -8.410
  105    HG3  ARG  11           3HG      ARG  11   2.006  -3.790  -9.490
  106    HD2  ARG  11           2HD      ARG  11   3.239  -4.666  -7.773
  107    HD3  ARG  11           3HD      ARG  11   2.690  -3.454  -6.617
  108    HE   ARG  11           HE       ARG  11   1.474  -5.991  -7.169
  109   HH11  ARG  11          1HH1      ARG  11   0.904  -2.748  -6.040
  110   HH12  ARG  11          2HH1      ARG  11  -0.497  -3.176  -5.116
  111   HH21  ARG  11          1HH2      ARG  11  -0.369  -6.568  -5.956
  112   HH22  ARG  11          2HH2      ARG  11  -1.220  -5.350  -5.068
  113    H    ARG  12           H        ARG  12   1.846   0.038  -6.861
  114    HA   ARG  12           HA       ARG  12   3.085   2.576  -7.665
  115    HB2  ARG  12           2HB      ARG  12   0.638   2.893  -7.241
  116    HB3  ARG  12           3HB      ARG  12   0.902   2.352  -5.589
  117    HG2  ARG  12           2HG      ARG  12   0.941   4.636  -5.352
  118    HG3  ARG  12           3HG      ARG  12   2.658   4.265  -5.522
  119    HD2  ARG  12           2HD      ARG  12   2.134   6.159  -6.904
  120    HD3  ARG  12           3HD      ARG  12   2.478   4.776  -7.941
  121    HE   ARG  12           HE       ARG  12  -0.297   4.956  -7.442
  122   HH11  ARG  12          1HH1      ARG  12   2.260   6.489  -9.239
  123   HH12  ARG  12          2HH1      ARG  12   1.212   7.063 -10.493
  124   HH21  ARG  12          1HH2      ARG  12  -1.688   5.706  -9.087
  125   HH22  ARG  12          2HH2      ARG  12  -1.034   6.618 -10.405
  126    H    ARG  13           H        ARG  13   4.886   2.987  -6.568
  127    HA   ARG  13           HA       ARG  13   5.657   1.272  -4.380
  128    HB2  ARG  13           2HB      ARG  13   7.816   2.269  -4.562
  129    HB3  ARG  13           3HB      ARG  13   7.222   2.029  -6.199
  130    HG2  ARG  13           2HG      ARG  13   6.630   4.374  -6.358
  131    HG3  ARG  13           3HG      ARG  13   7.142   4.633  -4.689
  132    HD2  ARG  13           2HD      ARG  13   9.404   3.637  -5.541
  133    HD3  ARG  13           3HD      ARG  13   8.789   4.109  -7.125
  134    HE   ARG  13           HE       ARG  13   9.237   6.281  -6.592
  135   HH11  ARG  13          1HH1      ARG  13   9.086   4.421  -3.654
  136   HH12  ARG  13          2HH1      ARG  13   9.594   5.733  -2.643
  137   HH21  ARG  13          1HH2      ARG  13   9.906   8.017  -5.272
  138   HH22  ARG  13          2HH2      ARG  13  10.059   7.778  -3.564
  Start of MODEL    4
    1    H1   LYS   1           H        LYS   1   0.134   0.107  -0.098
    2    HA   LYS   1           HA       LYS   1   1.016   0.875  -2.795
    3    HB2  LYS   1           2HB      LYS   1   2.679   2.402  -1.795
    4    HB3  LYS   1           3HB      LYS   1   1.026   2.903  -1.462
    5    HG2  LYS   1           2HG      LYS   1   1.157   2.159   0.783
    6    HG3  LYS   1           3HG      LYS   1   2.680   1.317   0.484
    7    HD2  LYS   1           2HD      LYS   1   3.794   3.449   0.087
    8    HD3  LYS   1           3HD      LYS   1   2.271   4.305   0.338
    9    HE2  LYS   1           2HE      LYS   1   3.246   2.476   2.475
   10    HE3  LYS   1           3HE      LYS   1   4.043   4.036   2.277
   11    HZ1  LYS   1           3HZ      LYS   1   1.551   3.457   3.480
   12    HZ2  LYS   1           1HZ      LYS   1   1.322   4.530   2.193
   13    HZ3  LYS   1           2HZ      LYS   1   2.396   4.922   3.438
   14    H    TRP   2           H        TRP   2   2.835  -0.116  -3.515
   15    HA   TRP   2           HA       TRP   2   4.142  -1.988  -1.653
   16    HB2  TRP   2           2HB      TRP   2   4.047  -3.625  -3.205
   17    HB3  TRP   2           3HB      TRP   2   2.792  -2.632  -3.941
   18    HD1  TRP   2           HD1      TRP   2   3.792  -0.828  -5.885
   19    HE1  TRP   2           HE1      TRP   2   5.567  -1.300  -7.688
   20    HE3  TRP   2           HE3      TRP   2   6.010  -4.927  -3.786
   21    HZ2  TRP   2           HZ2      TRP   2   7.634  -3.164  -8.158
   22    HZ3  TRP   2           HZ3      TRP   2   7.879  -5.996  -4.977
   23    HH2  TRP   2           HH2      TRP   2   8.673  -5.132  -7.118
   24    H    PHE   3           H        PHE   3   6.382  -2.683  -2.768
   25    HA   PHE   3           HA       PHE   3   8.135  -0.568  -2.411
   26    HB2  PHE   3           2HB      PHE   3   8.308  -3.331  -3.260
   27    HB3  PHE   3           3HB      PHE   3   9.448  -2.327  -4.150
   28    HD1  PHE   3           HD1      PHE   3  10.543  -0.459  -2.420
   29    HD2  PHE   3           HD2      PHE   3   9.249  -4.403  -1.478
   30    HE1  PHE   3           HE1      PHE   3  12.079  -0.500  -0.498
   31    HE2  PHE   3           HE2      PHE   3  10.782  -4.450   0.445
   32    HZ   PHE   3           HZ       PHE   3  12.200  -2.498   0.937
   33    H    ARG   4           H        ARG   4   9.865  -0.125  -4.294
   34    HA   ARG   4           HA       ARG   4   8.686   1.680  -6.041
   35    HB2  ARG   4           2HB      ARG   4  10.885   1.536  -7.298
   36    HB3  ARG   4           3HB      ARG   4  10.996   1.927  -5.587
   37    HG2  ARG   4           2HG      ARG   4  11.974  -0.062  -5.051
   38    HG3  ARG   4           3HG      ARG   4  11.207  -0.924  -6.386
   39    HD2  ARG   4           2HD      ARG   4  12.743  -0.101  -7.949
   40    HD3  ARG   4           3HD      ARG   4  13.280   1.188  -6.873
   41    HE   ARG   4           HE       ARG   4  14.751  -0.277  -5.906
   42   HH11  ARG   4          1HH1      ARG   4  12.429  -2.059  -7.790
   43   HH12  ARG   4          2HH1      ARG   4  13.261  -3.570  -7.627
   44   HH21  ARG   4          1HH2      ARG   4  15.856  -2.260  -5.685
   45   HH22  ARG   4          2HH2      ARG   4  15.210  -3.683  -6.429
   46    H    VAL   5           H        VAL   5   7.656   1.505  -7.924
   47    HA   VAL   5           HA       VAL   5   7.017  -1.037  -9.016
   48    HB   VAL   5           HB       VAL   5   5.813   0.162 -10.736
   49   HG11  VAL   5          1HG1      VAL   5   5.595   1.307  -7.967
   50   HG12  VAL   5          2HG1      VAL   5   4.464   1.730  -9.254
   51   HG13  VAL   5          3HG1      VAL   5   4.607   0.055  -8.719
   52   HG21  VAL   5          3HG2      VAL   5   5.909   2.640 -10.847
   53   HG22  VAL   5          1HG2      VAL   5   7.261   2.602  -9.716
   54   HG23  VAL   5          2HG2      VAL   5   7.422   1.860 -11.308
   55    H    TYR   6           H        TYR   6   7.654  -1.999 -10.933
   56    HA   TYR   6           HA       TYR   6  10.018  -0.829 -12.245
   57    HB2  TYR   6           2HB      TYR   6  10.279  -2.940 -10.674
   58    HB3  TYR   6           3HB      TYR   6   9.694  -3.795 -12.097
   59    HD1  TYR   6           HD2      TYR   6  12.439  -1.785 -10.714
   60    HD2  TYR   6           HD1      TYR   6  11.062  -4.007 -14.072
   61    HE1  TYR   6           HE2      TYR   6  14.714  -1.770 -11.650
   62    HE2  TYR   6           HE1      TYR   6  13.333  -3.999 -15.016
   63    HH   TYR   6           HH       TYR   6  15.421  -3.283 -14.785
   64    H    ARG   7           H        ARG   7  10.328  -1.420 -14.468
   65    HA   ARG   7           HA       ARG   7   7.967  -1.316 -15.996
   66    HB2  ARG   7           2HB      ARG   7  10.835  -1.898 -16.713
   67    HB3  ARG   7           3HB      ARG   7   9.559  -1.865 -17.922
   68    HG2  ARG   7           2HG      ARG   7  10.491   0.263 -18.016
   69    HG3  ARG   7           3HG      ARG   7   9.036   0.477 -17.040
   70    HD2  ARG   7           2HD      ARG   7  10.257   0.640 -15.051
   71    HD3  ARG   7           3HD      ARG   7  11.700  -0.070 -15.775
   72    HE   ARG   7           HE       ARG   7  12.290   2.002 -16.565
   73   HH11  ARG   7          1HH1      ARG   7   8.984   2.073 -15.476
   74   HH12  ARG   7          2HH1      ARG   7   8.841   3.794 -15.608
   75   HH21  ARG   7          1HH2      ARG   7  12.114   4.269 -16.743
   76   HH22  ARG   7          2HH2      ARG   7  10.621   5.042 -16.330
   77    H    GLY   8           H        GLY   8   6.532  -2.916 -16.131
   78    HA2  GLY   8           2HA      GLY   8   6.455  -5.134 -17.456
   79    HA3  GLY   8           3HA      GLY   8   7.505  -5.692 -16.162
   80    H    ILE   9           H        ILE   9   5.932  -3.854 -14.300
   81    HA   ILE   9           HA       ILE   9   3.458  -5.426 -14.114
   82    HB   ILE   9           HB       ILE   9   5.037  -6.451 -12.568
   83   HG12  ILE   9          2HG1      ILE   9   3.265  -4.882 -10.750
   84   HG13  ILE   9          3HG1      ILE   9   2.510  -5.851 -12.011
   85   HG21  ILE   9          1HG2      ILE   9   5.184  -3.873 -11.043
   86   HG22  ILE   9          2HG2      ILE   9   6.193  -5.310 -10.889
   87   HG23  ILE   9          3HG2      ILE   9   6.352  -4.269 -12.304
   88   HD11  ILE   9          3HD1      ILE   9   4.005  -6.700  -9.599
   89   HD12  ILE   9          1HD1      ILE   9   2.538  -7.362 -10.318
   90   HD13  ILE   9          2HD1      ILE   9   4.109  -7.710 -11.041
   91    H    TYR  10           H        TYR  10   1.715  -4.204 -13.811
   92    HA   TYR  10           HA       TYR  10   1.988  -1.364 -13.474
   93    HB2  TYR  10           2HB      TYR  10  -0.338  -3.223 -13.876
   94    HB3  TYR  10           3HB      TYR  10  -0.600  -1.535 -13.453
   95    HD1  TYR  10           HD1      TYR  10   0.671  -3.824 -16.035
   96    HD2  TYR  10           HD2      TYR  10  -0.197   0.222 -15.047
   97    HE1  TYR  10           HE1      TYR  10   0.895  -3.204 -18.405
   98    HE2  TYR  10           HE2      TYR  10   0.023   0.853 -17.414
   99    HH   TYR  10           HH       TYR  10   0.200  -1.466 -19.927
  100    H    ARG  11           H        ARG  11   2.389  -0.538 -11.532
  101    HA   ARG  11           HA       ARG  11   0.586  -1.073  -9.347
  102    HB2  ARG  11           2HB      ARG  11   3.435  -1.998  -9.312
  103    HB3  ARG  11           3HB      ARG  11   2.675  -1.462  -7.819
  104    HG2  ARG  11           2HG      ARG  11   0.793  -3.137  -8.546
  105    HG3  ARG  11           3HG      ARG  11   2.101  -3.854  -9.490
  106    HD2  ARG  11           2HD      ARG  11   3.287  -4.477  -7.627
  107    HD3  ARG  11           3HD      ARG  11   2.596  -3.198  -6.629
  108    HE   ARG  11           HE       ARG  11   1.621  -5.847  -6.903
  109   HH11  ARG  11          1HH1      ARG  11   0.577  -2.548  -6.518
  110   HH12  ARG  11          2HH1      ARG  11  -0.910  -2.973  -5.737
  111   HH21  ARG  11          1HH2      ARG  11  -0.334  -6.419  -5.877
  112   HH22  ARG  11          2HH2      ARG  11  -1.427  -5.175  -5.372
  113    H    ARG  12           H        ARG  12   1.567   0.174  -7.298
  114    HA   ARG  12           HA       ARG  12   2.689   2.724  -8.240
  115    HB2  ARG  12           2HB      ARG  12   0.228   2.913  -7.946
  116    HB3  ARG  12           3HB      ARG  12   0.421   2.449  -6.261
  117    HG2  ARG  12           2HG      ARG  12   2.072   4.489  -6.221
  118    HG3  ARG  12           3HG      ARG  12   1.127   4.995  -7.622
  119    HD2  ARG  12           2HD      ARG  12  -0.229   4.132  -5.097
  120    HD3  ARG  12           3HD      ARG  12   0.404   5.770  -5.259
  121    HE   ARG  12           HE       ARG  12  -1.919   4.670  -6.552
  122   HH11  ARG  12          1HH1      ARG  12   0.540   7.131  -6.669
  123   HH12  ARG  12          2HH1      ARG  12  -0.406   8.215  -7.634
  124   HH21  ARG  12          1HH2      ARG  12  -3.175   6.088  -7.822
  125   HH22  ARG  12          2HH2      ARG  12  -2.520   7.621  -8.289
  126    H    ARG  13           H        ARG  13   4.366   3.420  -7.080
  127    HA   ARG  13           HA       ARG  13   5.151   1.930  -4.718
  128    HB2  ARG  13           2HB      ARG  13   7.277   2.961  -4.943
  129    HB3  ARG  13           3HB      ARG  13   6.744   2.578  -6.574
  130    HG2  ARG  13           2HG      ARG  13   6.085   4.887  -6.927
  131    HG3  ARG  13           3HG      ARG  13   6.550   5.285  -5.271
  132    HD2  ARG  13           2HD      ARG  13   8.849   4.236  -6.050
  133    HD3  ARG  13           3HD      ARG  13   8.248   4.701  -7.642
  134    HE   ARG  13           HE       ARG  13   8.077   6.811  -5.708
  135   HH11  ARG  13          1HH1      ARG  13  10.158   5.201  -7.987
  136   HH12  ARG  13          2HH1      ARG  13  11.188   6.576  -8.217
  137   HH21  ARG  13          1HH2      ARG  13   9.425   8.628  -6.002
  138   HH22  ARG  13          2HH2      ARG  13  10.770   8.524  -7.086
  Start of MODEL    5
    1    H1   LYS   1           H        LYS   1   0.969   0.012   0.273
    2    HA   LYS   1           HA       LYS   1   1.531   0.463  -2.584
    3    HB2  LYS   1           2HB      LYS   1   2.973   1.713  -0.238
    4    HB3  LYS   1           3HB      LYS   1   3.337   1.977  -1.938
    5    HG2  LYS   1           2HG      LYS   1   1.292   3.132  -2.285
    6    HG3  LYS   1           3HG      LYS   1   0.686   2.659  -0.696
    7    HD2  LYS   1           2HD      LYS   1   2.373   4.015   0.389
    8    HD3  LYS   1           3HD      LYS   1   3.093   4.416  -1.172
    9    HE2  LYS   1           2HE      LYS   1   1.336   5.801  -1.770
   10    HE3  LYS   1           3HE      LYS   1   0.214   5.028  -0.652
   11    HZ1  LYS   1           3HZ      LYS   1   0.644   6.930   0.483
   12    HZ2  LYS   1           1HZ      LYS   1   2.203   7.109  -0.148
   13    HZ3  LYS   1           2HZ      LYS   1   1.915   5.992   1.089
   14    H    TRP   2           H        TRP   2   3.343  -0.513  -3.447
   15    HA   TRP   2           HA       TRP   2   4.666  -2.483  -1.700
   16    HB2  TRP   2           2HB      TRP   2   4.421  -4.074  -3.283
   17    HB3  TRP   2           3HB      TRP   2   3.172  -3.012  -3.928
   18    HD1  TRP   2           HD1      TRP   2   4.145  -1.201  -5.879
   19    HE1  TRP   2           HE1      TRP   2   5.802  -1.699  -7.785
   20    HE3  TRP   2           HE3      TRP   2   6.294  -5.441  -3.998
   21    HZ2  TRP   2           HZ2      TRP   2   7.760  -3.635  -8.408
   22    HZ3  TRP   2           HZ3      TRP   2   8.051  -6.556  -5.311
   23    HH2  TRP   2           HH2      TRP   2   8.767  -5.670  -7.471
   24    H    PHE   3           H        PHE   3   6.813  -3.242  -2.949
   25    HA   PHE   3           HA       PHE   3   8.671  -1.211  -2.636
   26    HB2  PHE   3           2HB      PHE   3   8.681  -3.955  -3.559
   27    HB3  PHE   3           3HB      PHE   3   9.816  -2.977  -4.484
   28    HD1  PHE   3           HD1      PHE   3  11.075  -1.199  -2.768
   29    HD2  PHE   3           HD2      PHE   3   9.670  -5.112  -1.857
   30    HE1  PHE   3           HE1      PHE   3  12.707  -1.354  -0.933
   31    HE2  PHE   3           HE2      PHE   3  11.298  -5.273  -0.020
   32    HZ   PHE   3           HZ       PHE   3  12.819  -3.393   0.445
   33    H    ARG   4           H        ARG   4  10.318  -0.791  -4.598
   34    HA   ARG   4           HA       ARG   4   9.127   1.105  -6.236
   35    HB2  ARG   4           2HB      ARG   4  11.690  -0.424  -6.724
   36    HB3  ARG   4           3HB      ARG   4  11.227   1.069  -7.529
   37    HG2  ARG   4           2HG      ARG   4  11.109   2.077  -5.179
   38    HG3  ARG   4           3HG      ARG   4  12.006   0.645  -4.669
   39    HD2  ARG   4           2HD      ARG   4  12.973   2.271  -6.984
   40    HD3  ARG   4           3HD      ARG   4  13.284   2.816  -5.336
   41    HE   ARG   4           HE       ARG   4  14.533   0.619  -6.698
   42   HH11  ARG   4          1HH1      ARG   4  13.677   1.937  -3.591
   43   HH12  ARG   4          2HH1      ARG   4  14.920   1.081  -2.740
   44   HH21  ARG   4          1HH2      ARG   4  16.173  -0.513  -5.589
   45   HH22  ARG   4          2HH2      ARG   4  16.340  -0.311  -3.878
   46    H    VAL   5           H        VAL   5   7.983   1.016  -8.058
   47    HA   VAL   5           HA       VAL   5   7.184  -1.466  -9.176
   48    HB   VAL   5           HB       VAL   5   5.946  -0.174 -10.804
   49   HG11  VAL   5          1HG1      VAL   5   5.920   0.900  -7.998
   50   HG12  VAL   5          2HG1      VAL   5   4.749   1.415  -9.213
   51   HG13  VAL   5          3HG1      VAL   5   4.837  -0.281  -8.734
   52   HG21  VAL   5          3HG2      VAL   5   6.318   2.481 -10.268
   53   HG22  VAL   5          1HG2      VAL   5   7.962   1.848 -10.174
   54   HG23  VAL   5          2HG2      VAL   5   7.009   1.614 -11.640
   55    H    TYR   6           H        TYR   6   7.244  -1.705 -11.676
   56    HA   TYR   6           HA       TYR   6   9.734  -0.839 -12.884
   57    HB2  TYR   6           2HB      TYR   6   9.237  -3.632 -11.968
   58    HB3  TYR   6           3HB      TYR   6  10.068  -3.404 -13.503
   59    HD1  TYR   6           HD2      TYR   6  12.253  -2.245 -13.566
   60    HD2  TYR   6           HD1      TYR   6  10.322  -3.163  -9.888
   61    HE1  TYR   6           HE2      TYR   6  14.372  -1.887 -12.371
   62    HE2  TYR   6           HE1      TYR   6  12.436  -2.807  -8.682
   63    HH   TYR   6           HH       TYR   6  14.539  -2.032  -8.844
   64    H    ARG   7           H        ARG   7   9.875  -1.432 -15.169
   65    HA   ARG   7           HA       ARG   7   7.411  -1.041 -16.501
   66    HB2  ARG   7           2HB      ARG   7  10.172  -1.762 -17.471
   67    HB3  ARG   7           3HB      ARG   7   8.815  -1.567 -18.571
   68    HG2  ARG   7           2HG      ARG   7   9.891   0.495 -18.611
   69    HG3  ARG   7           3HG      ARG   7   8.527   0.744 -17.519
   70    HD2  ARG   7           2HD      ARG   7   9.881   0.750 -15.630
   71    HD3  ARG   7           3HD      ARG   7  11.197  -0.086 -16.453
   72    HE   ARG   7           HE       ARG   7  10.771   2.416 -17.668
   73   HH11  ARG   7          1HH1      ARG   7  11.998   1.019 -14.724
   74   HH12  ARG   7          2HH1      ARG   7  13.090   2.326 -14.406
   75   HH21  ARG   7          1HH2      ARG   7  12.205   4.142 -17.259
   76   HH22  ARG   7          2HH2      ARG   7  13.206   4.102 -15.847
   77    H    GLY   8           H        GLY   8   5.868  -2.540 -16.601
   78    HA2  GLY   8           2HA      GLY   8   5.536  -4.662 -18.037
   79    HA3  GLY   8           3HA      GLY   8   6.652  -5.363 -16.874
   80    H    ILE   9           H        ILE   9   5.390  -3.591 -14.756
   81    HA   ILE   9           HA       ILE   9   2.826  -4.995 -14.458
   82    HB   ILE   9           HB       ILE   9   4.454  -6.242 -13.140
   83   HG12  ILE   9          2HG1      ILE   9   3.351  -6.039 -10.918
   84   HG13  ILE   9          3HG1      ILE   9   2.587  -4.551 -11.463
   85   HG21  ILE   9          1HG2      ILE   9   4.921  -3.808 -11.452
   86   HG22  ILE   9          2HG2      ILE   9   5.834  -5.315 -11.500
   87   HG23  ILE   9          3HG2      ILE   9   5.942  -4.176 -12.842
   88   HD11  ILE   9          3HD1      ILE   9   0.974  -5.661 -12.501
   89   HD12  ILE   9          1HD1      ILE   9   2.119  -6.744 -13.291
   90   HD13  ILE   9          2HD1      ILE   9   1.554  -7.096 -11.658
   91    H    TYR  10           H        TYR  10   1.212  -3.686 -13.907
   92    HA   TYR  10           HA       TYR  10   1.727  -0.905 -13.396
   93    HB2  TYR  10           2HB      TYR  10  -0.898  -2.409 -13.383
   94    HB3  TYR  10           3HB      TYR  10  -0.706  -0.660 -13.425
   95    HD1  TYR  10           HD1      TYR  10  -0.328  -3.772 -15.354
   96    HD2  TYR  10           HD2      TYR  10  -0.153   0.478 -15.466
   97    HE1  TYR  10           HE1      TYR  10  -0.287  -3.844 -17.812
   98    HE2  TYR  10           HE2      TYR  10  -0.113   0.417 -17.924
   99    HH   TYR  10           HH       TYR  10  -1.056  -1.944 -19.722
  100    H    ARG  11           H        ARG  11   2.355  -0.263 -11.444
  101    HA   ARG  11           HA       ARG  11   0.714  -0.865  -9.145
  102    HB2  ARG  11           2HB      ARG  11   3.531  -1.876  -9.407
  103    HB3  ARG  11           3HB      ARG  11   2.858  -1.493  -7.828
  104    HG2  ARG  11           2HG      ARG  11   0.898  -3.044  -8.685
  105    HG3  ARG  11           3HG      ARG  11   2.189  -3.696  -9.696
  106    HD2  ARG  11           2HD      ARG  11   3.351  -4.531  -7.914
  107    HD3  ARG  11           3HD      ARG  11   2.746  -3.301  -6.805
  108    HE   ARG  11           HE       ARG  11   1.561  -5.856  -7.375
  109   HH11  ARG  11          1HH1      ARG  11   0.973  -2.613  -6.255
  110   HH12  ARG  11          2HH1      ARG  11  -0.448  -3.040  -5.359
  111   HH21  ARG  11          1HH2      ARG  11  -0.307  -6.431  -6.199
  112   HH22  ARG  11          2HH2      ARG  11  -1.174  -5.213  -5.327
  113    H    ARG  12           H        ARG  12   1.939   0.177  -7.114
  114    HA   ARG  12           HA       ARG  12   3.137   2.722  -7.963
  115    HB2  ARG  12           2HB      ARG  12   0.833   3.249  -7.559
  116    HB3  ARG  12           3HB      ARG  12   0.835   2.350  -6.047
  117    HG2  ARG  12           2HG      ARG  12   2.278   3.972  -5.020
  118    HG3  ARG  12           3HG      ARG  12   2.468   4.827  -6.552
  119    HD2  ARG  12           2HD      ARG  12   0.879   6.063  -5.329
  120    HD3  ARG  12           3HD      ARG  12  -0.045   5.150  -6.522
  121    HE   ARG  12           HE       ARG  12   0.105   3.678  -4.129
  122   HH11  ARG  12          1HH1      ARG  12  -1.385   6.534  -5.450
  123   HH12  ARG  12          2HH1      ARG  12  -2.759   6.462  -4.397
  124   HH21  ARG  12          1HH2      ARG  12  -1.700   3.572  -2.738
  125   HH22  ARG  12          2HH2      ARG  12  -2.937   4.778  -2.855
  126    H    ARG  13           H        ARG  13   4.929   3.220  -6.879
  127    HA   ARG  13           HA       ARG  13   5.720   1.551  -4.636
  128    HB2  ARG  13           2HB      ARG  13   7.916   2.430  -4.942
  129    HB3  ARG  13           3HB      ARG  13   7.267   2.099  -6.542
  130    HG2  ARG  13           2HG      ARG  13   6.801   4.438  -6.887
  131    HG3  ARG  13           3HG      ARG  13   7.310   4.812  -5.239
  132    HD2  ARG  13           2HD      ARG  13   9.556   4.361  -5.707
  133    HD3  ARG  13           3HD      ARG  13   9.163   3.463  -7.172
  134    HE   ARG  13           HE       ARG  13   9.543   6.288  -6.934
  135   HH11  ARG  13          1HH1      ARG  13   7.890   3.800  -8.722
  136   HH12  ARG  13          2HH1      ARG  13   7.728   4.757 -10.157
  137   HH21  ARG  13          1HH2      ARG  13   9.336   7.558  -8.817
  138   HH22  ARG  13          2HH2      ARG  13   8.552   6.894 -10.211
  Start of MODEL    6
    1    H1   LYS   1           H        LYS   1   0.265  -0.078  -0.203
    2    HA   LYS   1           HA       LYS   1   1.369   1.137  -2.645
    3    HB2  LYS   1           2HB      LYS   1   2.942   2.405  -1.125
    4    HB3  LYS   1           3HB      LYS   1   1.267   2.940  -1.102
    5    HG2  LYS   1           2HG      LYS   1   0.913   1.645   0.965
    6    HG3  LYS   1           3HG      LYS   1   2.623   1.206   0.953
    7    HD2  LYS   1           2HD      LYS   1   3.241   3.557   1.123
    8    HD3  LYS   1           3HD      LYS   1   1.538   4.021   1.080
    9    HE2  LYS   1           2HE      LYS   1   1.121   3.004   3.184
   10    HE3  LYS   1           3HE      LYS   1   2.688   2.196   3.180
   11    HZ1  LYS   1           3HZ      LYS   1   2.077   5.040   3.655
   12    HZ2  LYS   1           1HZ      LYS   1   3.613   4.576   3.119
   13    HZ3  LYS   1           2HZ      LYS   1   3.014   3.982   4.585
   14    H    TRP   2           H        TRP   2   2.992   0.012  -3.484
   15    HA   TRP   2           HA       TRP   2   4.433  -1.872  -1.734
   16    HB2  TRP   2           2HB      TRP   2   4.254  -3.491  -3.297
   17    HB3  TRP   2           3HB      TRP   2   2.944  -2.504  -3.938
   18    HD1  TRP   2           HD1      TRP   2   3.798  -0.665  -5.920
   19    HE1  TRP   2           HE1      TRP   2   5.458  -1.095  -7.839
   20    HE3  TRP   2           HE3      TRP   2   6.189  -4.765  -4.020
   21    HZ2  TRP   2           HZ2      TRP   2   7.509  -2.931  -8.465
   22    HZ3  TRP   2           HZ3      TRP   2   7.988  -5.799  -5.343
   23    HH2  TRP   2           HH2      TRP   2   8.633  -4.900  -7.519
   24    H    PHE   3           H        PHE   3   6.602  -2.529  -3.000
   25    HA   PHE   3           HA       PHE   3   8.353  -0.399  -2.730
   26    HB2  PHE   3           2HB      PHE   3   8.499  -3.149  -3.624
   27    HB3  PHE   3           3HB      PHE   3   9.570  -2.123  -4.573
   28    HD1  PHE   3           HD1      PHE   3  10.753  -0.262  -2.890
   29    HD2  PHE   3           HD2      PHE   3   9.566  -4.234  -1.921
   30    HE1  PHE   3           HE1      PHE   3  12.411  -0.311  -1.073
   31    HE2  PHE   3           HE2      PHE   3  11.221  -4.288  -0.102
   32    HZ   PHE   3           HZ       PHE   3  12.646  -2.325   0.325
   33    H    ARG   4           H        ARG   4   9.953   0.085  -4.714
   34    HA   ARG   4           HA       ARG   4   8.644   1.897  -6.359
   35    HB2  ARG   4           2HB      ARG   4  10.758   1.813  -7.748
   36    HB3  ARG   4           3HB      ARG   4  10.981   2.157  -6.038
   37    HG2  ARG   4           2HG      ARG   4  12.010   0.165  -5.625
   38    HG3  ARG   4           3HG      ARG   4  11.164  -0.668  -6.931
   39    HD2  ARG   4           2HD      ARG   4  12.522   0.658  -8.552
   40    HD3  ARG   4           3HD      ARG   4  13.442   1.288  -7.187
   41    HE   ARG   4           HE       ARG   4  13.683  -1.304  -8.384
   42   HH11  ARG   4          1HH1      ARG   4  14.099   0.519  -5.447
   43   HH12  ARG   4          2HH1      ARG   4  15.297  -0.550  -4.799
   44   HH21  ARG   4          1HH2      ARG   4  15.261  -2.720  -7.540
   45   HH22  ARG   4          2HH2      ARG   4  15.958  -2.392  -5.990
   46    H    VAL   5           H        VAL   5   7.483   1.722  -8.162
   47    HA   VAL   5           HA       VAL   5   6.804  -0.808  -9.246
   48    HB   VAL   5           HB       VAL   5   5.495   0.399 -10.882
   49   HG11  VAL   5          1HG1      VAL   5   5.432   1.534  -8.099
   50   HG12  VAL   5          2HG1      VAL   5   4.217   1.933  -9.315
   51   HG13  VAL   5          3HG1      VAL   5   4.423   0.262  -8.787
   52   HG21  VAL   5          3HG2      VAL   5   6.431   2.237 -11.751
   53   HG22  VAL   5          1HG2      VAL   5   5.760   3.082 -10.356
   54   HG23  VAL   5          2HG2      VAL   5   7.428   2.511 -10.323
   55    H    TYR   6           H        TYR   6   7.494  -1.863 -11.038
   56    HA   TYR   6           HA       TYR   6   9.724  -0.638 -12.527
   57    HB2  TYR   6           2HB      TYR   6  10.165  -2.691 -11.007
   58    HB3  TYR   6           3HB      TYR   6   9.342  -3.608 -12.263
   59    HD1  TYR   6           HD1      TYR   6  12.250  -1.408 -11.604
   60    HD2  TYR   6           HD2      TYR   6  10.459  -4.213 -14.255
   61    HE1  TYR   6           HE1      TYR   6  14.352  -1.542 -12.872
   62    HE2  TYR   6           HE2      TYR   6  12.557  -4.356 -15.530
   63    HH   TYR   6           HH       TYR   6  15.238  -2.209 -14.903
   64    H    ARG   7           H        ARG   7   9.951  -1.294 -14.766
   65    HA   ARG   7           HA       ARG   7   7.497  -1.167 -16.174
   66    HB2  ARG   7           2HB      ARG   7  10.337  -1.676 -17.044
   67    HB3  ARG   7           3HB      ARG   7   8.999  -1.645 -18.185
   68    HG2  ARG   7           2HG      ARG   7   9.889   0.502 -18.284
   69    HG3  ARG   7           3HG      ARG   7   8.480   0.670 -17.235
   70    HD2  ARG   7           2HD      ARG   7   9.820   0.747 -15.289
   71    HD3  ARG   7           3HD      ARG   7  11.248   0.196 -16.164
   72    HE   ARG   7           HE       ARG   7  10.313   2.638 -17.242
   73   HH11  ARG   7          1HH1      ARG   7  11.973   1.321 -14.480
   74   HH12  ARG   7          2HH1      ARG   7  12.851   2.778 -14.149
   75   HH21  ARG   7          1HH2      ARG   7  11.463   4.562 -16.816
   76   HH22  ARG   7          2HH2      ARG   7  12.559   4.621 -15.478
   77    H    GLY   8           H        GLY   8   6.095  -2.800 -16.253
   78    HA2  GLY   8           2HA      GLY   8   6.008  -5.001 -17.612
   79    HA3  GLY   8           3HA      GLY   8   7.127  -5.551 -16.374
   80    H    ILE   9           H        ILE   9   5.613  -3.789 -14.406
   81    HA   ILE   9           HA       ILE   9   3.179  -5.413 -14.136
   82    HB   ILE   9           HB       ILE   9   4.852  -6.424 -12.680
   83   HG12  ILE   9          2HG1      ILE   9   3.113  -4.919 -10.773
   84   HG13  ILE   9          3HG1      ILE   9   2.343  -5.914 -12.003
   85   HG21  ILE   9          1HG2      ILE   9   5.005  -3.874 -11.111
   86   HG22  ILE   9          2HG2      ILE   9   6.063  -5.282 -11.045
   87   HG23  ILE   9          3HG2      ILE   9   6.118  -4.204 -12.439
   88   HD11  ILE   9          3HD1      ILE   9   3.691  -6.685  -9.556
   89   HD12  ILE   9          1HD1      ILE   9   2.549  -7.583 -10.556
   90   HD13  ILE   9          2HD1      ILE   9   4.265  -7.579 -10.964
   91    H    TYR  10           H        TYR  10   1.425  -4.237 -13.728
   92    HA   TYR  10           HA       TYR  10   1.650  -1.395 -13.368
   93    HB2  TYR  10           2HB      TYR  10  -0.668  -3.295 -13.641
   94    HB3  TYR  10           3HB      TYR  10  -0.918  -1.600 -13.240
   95    HD1  TYR  10           HD1      TYR  10   0.418  -3.895 -15.817
   96    HD2  TYR  10           HD2      TYR  10  -0.791   0.081 -14.907
   97    HE1  TYR  10           HE1      TYR  10   0.519  -3.324 -18.207
   98    HE2  TYR  10           HE2      TYR  10  -0.695   0.663 -17.295
   99    HH   TYR  10           HH       TYR  10  -0.055  -0.018 -19.331
  100    H    ARG  11           H        ARG  11   2.113  -0.569 -11.441
  101    HA   ARG  11           HA       ARG  11   0.448  -1.199  -9.170
  102    HB2  ARG  11           2HB      ARG  11   3.332  -1.998  -9.302
  103    HB3  ARG  11           3HB      ARG  11   2.640  -1.498  -7.764
  104    HG2  ARG  11           2HG      ARG  11   0.792  -3.247  -8.368
  105    HG3  ARG  11           3HG      ARG  11   2.051  -3.902  -9.417
  106    HD2  ARG  11           2HD      ARG  11   3.401  -4.493  -7.657
  107    HD3  ARG  11           3HD      ARG  11   2.735  -3.255  -6.593
  108    HE   ARG  11           HE       ARG  11   1.849  -5.940  -6.836
  109   HH11  ARG  11          1HH1      ARG  11   0.715  -2.691  -6.306
  110   HH12  ARG  11          2HH1      ARG  11  -0.687  -3.186  -5.417
  111   HH21  ARG  11          1HH2      ARG  11   0.006  -6.604  -5.667
  112   HH22  ARG  11          2HH2      ARG  11  -1.089  -5.411  -5.053
  113    H    ARG  12           H        ARG  12   1.463   0.080  -7.165
  114    HA   ARG  12           HA       ARG  12   2.532   2.647  -8.094
  115    HB2  ARG  12           2HB      ARG  12   0.034   2.778  -7.933
  116    HB3  ARG  12           3HB      ARG  12   0.176   2.423  -6.217
  117    HG2  ARG  12           2HG      ARG  12  -0.081   4.770  -6.449
  118    HG3  ARG  12           3HG      ARG  12   1.596   4.465  -5.993
  119    HD2  ARG  12           2HD      ARG  12   1.418   6.154  -7.764
  120    HD3  ARG  12           3HD      ARG  12   2.296   4.723  -8.302
  121    HE   ARG  12           HE       ARG  12  -0.430   4.468  -8.965
  122   HH11  ARG  12          1HH1      ARG  12   2.420   6.253  -9.864
  123   HH12  ARG  12          2HH1      ARG  12   1.914   6.489 -11.504
  124   HH21  ARG  12          1HH2      ARG  12  -1.108   4.772 -11.122
  125   HH22  ARG  12          2HH2      ARG  12  -0.093   5.647 -12.218
  126    H    ARG  13           H        ARG  13   3.910   3.638  -6.692
  127    HA   ARG  13           HA       ARG  13   5.227   2.151  -4.753
  128    HB2  ARG  13           2HB      ARG  13   5.141   5.031  -5.492
  129    HB3  ARG  13           3HB      ARG  13   5.854   4.618  -3.938
  130    HG2  ARG  13           2HG      ARG  13   7.170   2.862  -5.406
  131    HG3  ARG  13           3HG      ARG  13   6.805   4.023  -6.684
  132    HD2  ARG  13           2HD      ARG  13   8.947   4.558  -5.732
  133    HD3  ARG  13           3HD      ARG  13   7.790   5.809  -5.277
  134    HE   ARG  13           HE       ARG  13   7.897   3.836  -3.268
  135   HH11  ARG  13          1HH1      ARG  13   9.784   6.430  -4.622
  136   HH12  ARG  13          2HH1      ARG  13  10.631   6.758  -3.146
  137   HH21  ARG  13          1HH2      ARG  13   9.005   4.259  -1.319
  138   HH22  ARG  13          2HH2      ARG  13  10.188   5.522  -1.269
  Start of MODEL    7
    1    H1   LYS   1           H        LYS   1   0.332  -0.108  -0.068
    2    HA   LYS   1           HA       LYS   1   1.447   0.767  -2.653
    3    HB2  LYS   1           2HB      LYS   1   3.202   1.928  -1.300
    4    HB3  LYS   1           3HB      LYS   1   1.584   2.585  -1.094
    5    HG2  LYS   1           2HG      LYS   1   1.345   1.533   1.031
    6    HG3  LYS   1           3HG      LYS   1   2.837   0.618   0.805
    7    HD2  LYS   1           2HD      LYS   1   4.116   2.704   0.811
    8    HD3  LYS   1           3HD      LYS   1   2.624   3.621   1.029
    9    HE2  LYS   1           2HE      LYS   1   2.257   2.311   3.144
   10    HE3  LYS   1           3HE      LYS   1   3.886   1.668   2.944
   11    HZ1  LYS   1           3HZ      LYS   1   4.378   3.447   4.221
   12    HZ2  LYS   1           1HZ      LYS   1   3.027   4.338   3.728
   13    HZ3  LYS   1           2HZ      LYS   1   4.392   4.250   2.733
   14    H    TRP   2           H        TRP   2   3.078  -0.382  -3.496
   15    HA   TRP   2           HA       TRP   2   4.264  -2.497  -1.820
   16    HB2  TRP   2           2HB      TRP   2   3.959  -4.014  -3.464
   17    HB3  TRP   2           3HB      TRP   2   2.771  -2.869  -4.079
   18    HD1  TRP   2           HD1      TRP   2   3.852  -1.036  -5.953
   19    HE1  TRP   2           HE1      TRP   2   5.503  -1.545  -7.860
   20    HE3  TRP   2           HE3      TRP   2   5.771  -5.444  -4.212
   21    HZ2  TRP   2           HZ2      TRP   2   7.372  -3.549  -8.538
   22    HZ3  TRP   2           HZ3      TRP   2   7.486  -6.593  -5.551
   23    HH2  TRP   2           HH2      TRP   2   8.268  -5.664  -7.669
   24    H    PHE   3           H        PHE   3   6.385  -3.312  -3.077
   25    HA   PHE   3           HA       PHE   3   8.336  -1.387  -2.671
   26    HB2  PHE   3           2HB      PHE   3   8.223  -4.093  -3.696
   27    HB3  PHE   3           3HB      PHE   3   9.414  -3.138  -4.574
   28    HD1  PHE   3           HD1      PHE   3  10.739  -1.488  -2.781
   29    HD2  PHE   3           HD2      PHE   3   9.136  -5.359  -2.030
   30    HE1  PHE   3           HE1      PHE   3  12.341  -1.790  -0.938
   31    HE2  PHE   3           HE2      PHE   3  10.735  -5.667  -0.186
   32    HZ   PHE   3           HZ       PHE   3  12.340  -3.881   0.363
   33    H    ARG   4           H        ARG   4  10.022  -0.976  -4.601
   34    HA   ARG   4           HA       ARG   4   8.943   1.035  -6.178
   35    HB2  ARG   4           2HB      ARG   4  11.492  -0.510  -6.217
   36    HB3  ARG   4           3HB      ARG   4  11.107   0.481  -7.617
   37    HG2  ARG   4           2HG      ARG   4  10.791   2.406  -6.022
   38    HG3  ARG   4           3HG      ARG   4  11.488   1.371  -4.774
   39    HD2  ARG   4           2HD      ARG   4  13.550   1.205  -5.955
   40    HD3  ARG   4           3HD      ARG   4  12.860   1.970  -7.386
   41    HE   ARG   4           HE       ARG   4  12.628   3.759  -5.258
   42   HH11  ARG   4          1HH1      ARG   4  15.116   2.244  -7.163
   43   HH12  ARG   4          2HH1      ARG   4  16.237   3.552  -6.978
   44   HH21  ARG   4          1HH2      ARG   4  14.094   5.488  -5.007
   45   HH22  ARG   4          2HH2      ARG   4  15.655   5.396  -5.750
   46    H    VAL   5           H        VAL   5   7.788   1.058  -7.991
   47    HA   VAL   5           HA       VAL   5   6.892  -1.336  -9.215
   48    HB   VAL   5           HB       VAL   5   5.738   0.078 -10.809
   49   HG11  VAL   5          1HG1      VAL   5   5.712   1.001  -7.952
   50   HG12  VAL   5          2HG1      VAL   5   4.595   1.651  -9.153
   51   HG13  VAL   5          3HG1      VAL   5   4.581  -0.072  -8.775
   52   HG21  VAL   5          3HG2      VAL   5   7.302   1.712 -11.425
   53   HG22  VAL   5          1HG2      VAL   5   6.052   2.604 -10.558
   54   HG23  VAL   5          2HG2      VAL   5   7.572   2.211  -9.755
   55    H    TYR   6           H        TYR   6   7.424  -2.289 -11.142
   56    HA   TYR   6           HA       TYR   6   9.823  -1.241 -12.497
   57    HB2  TYR   6           2HB      TYR   6   9.116  -3.995 -11.606
   58    HB3  TYR   6           3HB      TYR   6  10.009  -3.827 -13.113
   59    HD1  TYR   6           HD1      TYR   6  12.265  -2.805 -13.107
   60    HD2  TYR   6           HD2      TYR   6  10.163  -3.603  -9.494
   61    HE1  TYR   6           HE1      TYR   6  14.364  -2.583 -11.844
   62    HE2  TYR   6           HE2      TYR   6  12.256  -3.381  -8.221
   63    HH   TYR   6           HH       TYR   6  14.800  -1.915  -9.104
   64    H    ARG   7           H        ARG   7  10.018  -1.798 -14.775
   65    HA   ARG   7           HA       ARG   7   7.599  -1.315 -16.185
   66    HB2  ARG   7           2HB      ARG   7  10.202  -2.267 -17.379
   67    HB3  ARG   7           3HB      ARG   7   8.931  -1.344 -18.169
   68    HG2  ARG   7           2HG      ARG   7  10.699  -0.359 -15.940
   69    HG3  ARG   7           3HG      ARG   7  10.851   0.053 -17.649
   70    HD2  ARG   7           2HD      ARG   7   8.370   0.819 -17.389
   71    HD3  ARG   7           3HD      ARG   7   8.769   0.879 -15.673
   72    HE   ARG   7           HE       ARG   7   9.635   2.698 -17.713
   73   HH11  ARG   7          1HH1      ARG   7  10.406   1.325 -14.609
   74   HH12  ARG   7          2HH1      ARG   7  11.389   2.664 -14.115
   75   HH21  ARG   7          1HH2      ARG   7  10.927   4.467 -17.075
   76   HH22  ARG   7          2HH2      ARG   7  11.684   4.451 -15.518
   77    H    GLY   8           H        GLY   8   6.062  -2.808 -16.405
   78    HA2  GLY   8           2HA      GLY   8   5.818  -4.887 -17.935
   79    HA3  GLY   8           3HA      GLY   8   6.851  -5.623 -16.718
   80    H    ILE   9           H        ILE   9   5.438  -3.865 -14.664
   81    HA   ILE   9           HA       ILE   9   2.863  -5.274 -14.564
   82    HB   ILE   9           HB       ILE   9   4.393  -6.555 -13.166
   83   HG12  ILE   9          2HG1      ILE   9   3.131  -6.440 -11.046
   84   HG13  ILE   9          3HG1      ILE   9   2.454  -4.893 -11.541
   85   HG21  ILE   9          1HG2      ILE   9   4.752  -4.161 -11.398
   86   HG22  ILE   9          2HG2      ILE   9   5.661  -5.671 -11.417
   87   HG23  ILE   9          3HG2      ILE   9   5.864  -4.503 -12.723
   88   HD11  ILE   9          3HD1      ILE   9   0.807  -5.936 -12.574
   89   HD12  ILE   9          1HD1      ILE   9   1.962  -6.789 -13.598
   90   HD13  ILE   9          2HD1      ILE   9   1.471  -7.484 -12.053
   91    H    TYR  10           H        TYR  10   1.218  -3.972 -14.088
   92    HA   TYR  10           HA       TYR  10   1.683  -1.200 -13.530
   93    HB2  TYR  10           2HB      TYR  10  -0.816  -2.860 -13.830
   94    HB3  TYR  10           3HB      TYR  10  -0.869  -1.150 -13.417
   95    HD1  TYR  10           HD2      TYR  10  -0.194   0.546 -15.047
   96    HD2  TYR  10           HD1      TYR  10  -0.214  -3.589 -16.052
   97    HE1  TYR  10           HE2      TYR  10  -0.063   1.131 -17.433
   98    HE2  TYR  10           HE1      TYR  10  -0.082  -3.015 -18.440
   99    HH   TYR  10           HH       TYR  10  -0.857  -0.315 -19.729
  100    H    ARG  11           H        ARG  11   2.237  -0.540 -11.564
  101    HA   ARG  11           HA       ARG  11   0.547  -1.178  -9.310
  102    HB2  ARG  11           2HB      ARG  11   3.390  -2.127  -9.501
  103    HB3  ARG  11           3HB      ARG  11   2.679  -1.744  -7.938
  104    HG2  ARG  11           2HG      ARG  11   0.781  -3.343  -8.703
  105    HG3  ARG  11           3HG      ARG  11   1.991  -3.933  -9.844
  106    HD2  ARG  11           2HD      ARG  11   3.311  -4.816  -8.200
  107    HD3  ARG  11           3HD      ARG  11   2.785  -3.639  -6.997
  108    HE   ARG  11           HE       ARG  11   1.649  -6.206  -7.489
  109   HH11  ARG  11          1HH1      ARG  11   0.896  -2.961  -6.478
  110   HH12  ARG  11          2HH1      ARG  11  -0.490  -3.432  -5.550
  111   HH21  ARG  11          1HH2      ARG  11  -0.172  -6.839  -6.271
  112   HH22  ARG  11          2HH2      ARG  11  -1.096  -5.639  -5.432
  113    H    ARG  12           H        ARG  12   1.611  -0.077  -7.254
  114    HA   ARG  12           HA       ARG  12   2.869   2.455  -8.044
  115    HB2  ARG  12           2HB      ARG  12   0.324   2.621  -7.773
  116    HB3  ARG  12           3HB      ARG  12   0.608   2.365  -6.057
  117    HG2  ARG  12           2HG      ARG  12   0.587   4.635  -6.103
  118    HG3  ARG  12           3HG      ARG  12   2.304   4.358  -6.400
  119    HD2  ARG  12           2HD      ARG  12   2.137   4.890  -8.641
  120    HD3  ARG  12           3HD      ARG  12   0.414   4.523  -8.705
  121    HE   ARG  12           HE       ARG  12   0.604   6.672  -7.027
  122   HH11  ARG  12          1HH1      ARG  12   1.584   5.992 -10.297
  123   HH12  ARG  12          2HH1      ARG  12   1.424   7.634 -10.825
  124   HH21  ARG  12          1HH2      ARG  12   0.389   8.837  -7.710
  125   HH22  ARG  12          2HH2      ARG  12   0.745   9.252  -9.352
  126    H    ARG  13           H        ARG  13   4.364   3.223  -6.637
  127    HA   ARG  13           HA       ARG  13   5.546   1.529  -4.774
  128    HB2  ARG  13           2HB      ARG  13   5.702   4.545  -4.929
  129    HB3  ARG  13           3HB      ARG  13   6.804   3.518  -4.022
  130    HG2  ARG  13           2HG      ARG  13   7.136   2.374  -6.369
  131    HG3  ARG  13           3HG      ARG  13   6.580   3.943  -6.953
  132    HD2  ARG  13           2HD      ARG  13   8.693   3.876  -4.860
  133    HD3  ARG  13           3HD      ARG  13   9.138   3.455  -6.513
  134    HE   ARG  13           HE       ARG  13   7.705   5.827  -6.636
  135   HH11  ARG  13          1HH1      ARG  13  10.688   4.672  -5.264
  136   HH12  ARG  13          2HH1      ARG  13  11.485   6.207  -5.374
  137   HH21  ARG  13          1HH2      ARG  13   8.742   7.853  -6.786
  138   HH22  ARG  13          2HH2      ARG  13  10.376   8.016  -6.239
  Start of MODEL    8
    1    H1   LYS   1           H        LYS   1   0.163  -0.144   0.072
    2    HA   LYS   1           HA       LYS   1   0.679   0.410  -2.703
    3    HB2  LYS   1           2HB      LYS   1   2.424   2.083  -2.331
    4    HB3  LYS   1           3HB      LYS   1   0.865   2.666  -1.761
    5    HG2  LYS   1           2HG      LYS   1   1.592   1.881   0.546
    6    HG3  LYS   1           3HG      LYS   1   3.210   1.728  -0.142
    7    HD2  LYS   1           2HD      LYS   1   3.461   3.994  -0.403
    8    HD3  LYS   1           3HD      LYS   1   1.724   4.277  -0.551
    9    HE2  LYS   1           2HE      LYS   1   2.831   3.292   2.039
   10    HE3  LYS   1           3HE      LYS   1   3.022   4.992   1.613
   11    HZ1  LYS   1           3HZ      LYS   1   0.718   3.634   2.563
   12    HZ2  LYS   1           1HZ      LYS   1   0.390   4.386   1.084
   13    HZ3  LYS   1           2HZ      LYS   1   0.980   5.295   2.382
   14    H    TRP   2           H        TRP   2   2.713  -0.386  -3.412
   15    HA   TRP   2           HA       TRP   2   4.010  -2.181  -1.467
   16    HB2  TRP   2           2HB      TRP   2   3.975  -3.868  -2.967
   17    HB3  TRP   2           3HB      TRP   2   2.717  -2.923  -3.758
   18    HD1  TRP   2           HD1      TRP   2   3.722  -1.163  -5.741
   19    HE1  TRP   2           HE1      TRP   2   5.540  -1.660  -7.493
   20    HE3  TRP   2           HE3      TRP   2   5.972  -5.152  -3.468
   21    HZ2  TRP   2           HZ2      TRP   2   7.649  -3.500  -7.864
   22    HZ3  TRP   2           HZ3      TRP   2   7.883  -6.224  -4.588
   23    HH2  TRP   2           HH2      TRP   2   8.702  -5.413  -6.740
   24    H    PHE   3           H        PHE   3   6.283  -2.870  -2.517
   25    HA   PHE   3           HA       PHE   3   7.991  -0.712  -2.195
   26    HB2  PHE   3           2HB      PHE   3   8.230  -3.497  -2.951
   27    HB3  PHE   3           3HB      PHE   3   9.369  -2.502  -3.851
   28    HD1  PHE   3           HD1      PHE   3  10.393  -0.557  -2.159
   29    HD2  PHE   3           HD2      PHE   3   9.158  -4.495  -1.120
   30    HE1  PHE   3           HE1      PHE   3  11.892  -0.509  -0.209
   31    HE2  PHE   3           HE2      PHE   3  10.655  -4.453   0.832
   32    HZ   PHE   3           HZ       PHE   3  12.024  -2.458   1.291
   33    H    ARG   4           H        ARG   4   9.749  -0.298  -4.058
   34    HA   ARG   4           HA       ARG   4   8.573   1.428  -5.885
   35    HB2  ARG   4           2HB      ARG   4  10.800   1.279  -7.096
   36    HB3  ARG   4           3HB      ARG   4  10.868   1.735  -5.399
   37    HG2  ARG   4           2HG      ARG   4  11.875  -0.209  -4.770
   38    HG3  ARG   4           3HG      ARG   4  11.145  -1.140  -6.080
   39    HD2  ARG   4           2HD      ARG   4  13.345  -1.023  -6.760
   40    HD3  ARG   4           3HD      ARG   4  12.636   0.353  -7.604
   41    HE   ARG   4           HE       ARG   4  13.627   1.181  -5.099
   42   HH11  ARG   4          1HH1      ARG   4  14.718   0.148  -8.240
   43   HH12  ARG   4          2HH1      ARG   4  16.202   1.039  -8.161
   44   HH21  ARG   4          1HH2      ARG   4  15.577   2.358  -4.984
   45   HH22  ARG   4          2HH2      ARG   4  16.690   2.295  -6.308
   46    H    VAL   5           H        VAL   5   7.583   1.174  -7.780
   47    HA   VAL   5           HA       VAL   5   7.013  -1.414  -8.802
   48    HB   VAL   5           HB       VAL   5   5.817  -0.293 -10.580
   49   HG11  VAL   5          1HG1      VAL   5   5.525   0.924  -7.849
   50   HG12  VAL   5          2HG1      VAL   5   4.413   1.294  -9.168
   51   HG13  VAL   5          3HG1      VAL   5   4.573  -0.364  -8.587
   52   HG21  VAL   5          3HG2      VAL   5   7.448   2.061  -9.724
   53   HG22  VAL   5          1HG2      VAL   5   7.140   1.439 -11.346
   54   HG23  VAL   5          2HG2      VAL   5   5.873   2.308 -10.479
   55    H    TYR   6           H        TYR   6   7.214  -1.621 -11.361
   56    HA   TYR   6           HA       TYR   6   9.755  -0.718 -12.396
   57    HB2  TYR   6           2HB      TYR   6  10.035  -2.889 -10.914
   58    HB3  TYR   6           3HB      TYR   6   9.430  -3.689 -12.360
   59    HD1  TYR   6           HD2      TYR   6  12.207  -1.784 -10.914
   60    HD2  TYR   6           HD1      TYR   6  10.761  -3.777 -14.383
   61    HE1  TYR   6           HE2      TYR   6  14.469  -1.735 -11.877
   62    HE2  TYR   6           HE1      TYR   6  13.020  -3.736 -15.356
   63    HH   TYR   6           HH       TYR   6  15.769  -3.085 -13.590
   64    H    ARG   7           H        ARG   7  10.070  -1.305 -14.644
   65    HA   ARG   7           HA       ARG   7   7.688  -1.110 -16.149
   66    HB2  ARG   7           2HB      ARG   7  10.547  -1.680 -16.914
   67    HB3  ARG   7           3HB      ARG   7   9.258  -1.586 -18.107
   68    HG2  ARG   7           2HG      ARG   7  10.213   0.536 -18.120
   69    HG3  ARG   7           3HG      ARG   7   8.765   0.722 -17.128
   70    HD2  ARG   7           2HD      ARG   7   9.982   0.851 -15.154
   71    HD3  ARG   7           3HD      ARG   7  11.395   0.069 -15.861
   72    HE   ARG   7           HE       ARG   7  10.762   2.866 -15.907
   73   HH11  ARG   7          1HH1      ARG   7  12.456   0.303 -17.543
   74   HH12  ARG   7          2HH1      ARG   7  13.598   1.364 -18.300
   75   HH21  ARG   7          1HH2      ARG   7  12.259   4.273 -16.897
   76   HH22  ARG   7          2HH2      ARG   7  13.486   3.622 -17.931
   77    H    GLY   8           H        GLY   8   6.249  -2.705 -16.312
   78    HA2  GLY   8           2HA      GLY   8   6.143  -4.870 -17.716
   79    HA3  GLY   8           3HA      GLY   8   7.221  -5.478 -16.468
   80    H    ILE   9           H        ILE   9   5.753  -3.793 -14.445
   81    HA   ILE   9           HA       ILE   9   3.260  -5.346 -14.286
   82    HB   ILE   9           HB       ILE   9   4.878  -6.437 -12.829
   83   HG12  ILE   9          2HG1      ILE   9   3.626  -6.244 -10.683
   84   HG13  ILE   9          3HG1      ILE   9   2.793  -4.835 -11.330
   85   HG21  ILE   9          1HG2      ILE   9   5.070  -3.925 -11.200
   86   HG22  ILE   9          2HG2      ILE   9   6.080  -5.369 -11.131
   87   HG23  ILE   9          3HG2      ILE   9   6.205  -4.271 -12.505
   88   HD11  ILE   9          3HD1      ILE   9   1.574  -7.056 -11.415
   89   HD12  ILE   9          1HD1      ILE   9   1.628  -6.113 -12.904
   90   HD13  ILE   9          2HD1      ILE   9   2.700  -7.499 -12.698
   91    H    TYR  10           H        TYR  10   1.525  -4.140 -13.888
   92    HA   TYR  10           HA       TYR  10   1.803  -1.318 -13.437
   93    HB2  TYR  10           2HB      TYR  10  -0.504  -3.177 -13.892
   94    HB3  TYR  10           3HB      TYR  10  -0.801  -1.543 -13.309
   95    HD1  TYR  10           HD2      TYR  10  -0.142   0.403 -14.712
   96    HD2  TYR  10           HD1      TYR  10   0.089  -3.591 -16.161
   97    HE1  TYR  10           HE2      TYR  10  -0.017   1.253 -17.017
   98    HE2  TYR  10           HE1      TYR  10   0.216  -2.752 -18.470
   99    HH   TYR  10           HH       TYR  10   0.192   0.733 -19.162
  100    H    ARG  11           H        ARG  11   2.266  -0.573 -11.476
  101    HA   ARG  11           HA       ARG  11   0.535  -1.211  -9.257
  102    HB2  ARG  11           2HB      ARG  11   3.407  -2.077  -9.336
  103    HB3  ARG  11           3HB      ARG  11   2.654  -1.649  -7.805
  104    HG2  ARG  11           2HG      ARG  11   0.803  -3.334  -8.670
  105    HG3  ARG  11           3HG      ARG  11   2.175  -3.976  -9.574
  106    HD2  ARG  11           2HD      ARG  11   3.286  -4.639  -7.685
  107    HD3  ARG  11           3HD      ARG  11   2.540  -3.396  -6.681
  108    HE   ARG  11           HE       ARG  11   1.617  -6.052  -7.059
  109   HH11  ARG  11          1HH1      ARG  11   0.512  -2.780  -6.616
  110   HH12  ARG  11          2HH1      ARG  11  -0.993  -3.247  -5.897
  111   HH21  ARG  11          1HH2      ARG  11  -0.362  -6.680  -6.113
  112   HH22  ARG  11          2HH2      ARG  11  -1.489  -5.465  -5.610
  113    H    ARG  12           H        ARG  12   1.570  -0.034  -7.193
  114    HA   ARG  12           HA       ARG  12   2.639   2.562  -8.066
  115    HB2  ARG  12           2HB      ARG  12   0.096   2.495  -7.591
  116    HB3  ARG  12           3HB      ARG  12   0.565   2.363  -5.901
  117    HG2  ARG  12           2HG      ARG  12   1.756   4.549  -7.522
  118    HG3  ARG  12           3HG      ARG  12   0.069   4.691  -7.023
  119    HD2  ARG  12           2HD      ARG  12   2.086   3.905  -4.983
  120    HD3  ARG  12           3HD      ARG  12   2.048   5.586  -5.515
  121    HE   ARG  12           HE       ARG  12   0.118   4.248  -3.863
  122   HH11  ARG  12          1HH1      ARG  12   0.636   6.867  -6.098
  123   HH12  ARG  12          2HH1      ARG  12  -0.684   7.814  -5.497
  124   HH21  ARG  12          1HH2      ARG  12  -1.623   5.485  -3.063
  125   HH22  ARG  12          2HH2      ARG  12  -1.968   7.027  -3.770
  126    H    ARG  13           H        ARG  13   4.220   3.387  -6.814
  127    HA   ARG  13           HA       ARG  13   5.053   1.793  -4.503
  128    HB2  ARG  13           2HB      ARG  13   7.221   2.786  -4.762
  129    HB3  ARG  13           3HB      ARG  13   6.674   2.262  -6.349
  130    HG2  ARG  13           2HG      ARG  13   6.138   4.506  -6.978
  131    HG3  ARG  13           3HG      ARG  13   6.451   5.088  -5.342
  132    HD2  ARG  13           2HD      ARG  13   8.773   4.683  -5.542
  133    HD3  ARG  13           3HD      ARG  13   8.553   3.730  -7.009
  134    HE   ARG  13           HE       ARG  13   7.638   6.411  -7.333
  135   HH11  ARG  13          1HH1      ARG  13  10.488   4.412  -7.281
  136   HH12  ARG  13          2HH1      ARG  13  11.407   5.470  -8.299
  137   HH21  ARG  13          1HH2      ARG  13   8.838   7.812  -8.674
  138   HH22  ARG  13          2HH2      ARG  13  10.468   7.404  -9.091
  Start of MODEL    9
    1    H1   LYS   1           H        LYS   1  -0.444   1.086  -0.553
    2    HA   LYS   1           HA       LYS   1   1.295   1.227  -2.719
    3    HB2  LYS   1           2HB      LYS   1   2.872   2.321  -1.151
    4    HB3  LYS   1           3HB      LYS   1   1.239   2.965  -1.039
    5    HG2  LYS   1           2HG      LYS   1   0.844   1.624   0.963
    6    HG3  LYS   1           3HG      LYS   1   2.482   0.976   0.851
    7    HD2  LYS   1           2HD      LYS   1   3.343   3.309   1.033
    8    HD3  LYS   1           3HD      LYS   1   1.687   3.848   1.320
    9    HE2  LYS   1           2HE      LYS   1   1.605   2.930   3.410
   10    HE3  LYS   1           3HE      LYS   1   2.744   1.645   3.009
   11    HZ1  LYS   1           3HZ      LYS   1   3.454   4.498   3.433
   12    HZ2  LYS   1           1HZ      LYS   1   4.539   3.248   3.080
   13    HZ3  LYS   1           2HZ      LYS   1   3.699   3.250   4.548
   14    H    TRP   2           H        TRP   2   2.983   0.056  -3.401
   15    HA   TRP   2           HA       TRP   2   3.971  -2.089  -1.637
   16    HB2  TRP   2           2HB      TRP   2   3.712  -3.644  -3.253
   17    HB3  TRP   2           3HB      TRP   2   2.585  -2.488  -3.959
   18    HD1  TRP   2           HD1      TRP   2   3.805  -0.735  -5.823
   19    HE1  TRP   2           HE1      TRP   2   5.537  -1.335  -7.630
   20    HE3  TRP   2           HE3      TRP   2   5.523  -5.136  -3.869
   21    HZ2  TRP   2           HZ2      TRP   2   7.387  -3.401  -8.157
   22    HZ3  TRP   2           HZ3      TRP   2   7.275  -6.363  -5.087
   23    HH2  TRP   2           HH2      TRP   2   8.186  -5.512  -7.186
   24    H    PHE   3           H        PHE   3   6.132  -2.989  -2.762
   25    HA   PHE   3           HA       PHE   3   8.107  -1.100  -2.309
   26    HB2  PHE   3           2HB      PHE   3   7.979  -3.830  -3.265
   27    HB3  PHE   3           3HB      PHE   3   9.236  -2.929  -4.106
   28    HD1  PHE   3           HD1      PHE   3  10.510  -1.262  -2.292
   29    HD2  PHE   3           HD2      PHE   3   8.774  -5.070  -1.520
   30    HE1  PHE   3           HE1      PHE   3  12.009  -1.550  -0.363
   31    HE2  PHE   3           HE2      PHE   3  10.269  -5.364   0.411
   32    HZ   PHE   3           HZ       PHE   3  11.889  -3.603   0.993
   33    H    ARG   4           H        ARG   4   9.899  -0.784  -4.159
   34    HA   ARG   4           HA       ARG   4   8.952   1.208  -5.843
   35    HB2  ARG   4           2HB      ARG   4  11.393   0.491  -5.123
   36    HB3  ARG   4           3HB      ARG   4  11.355  -0.365  -6.659
   37    HG2  ARG   4           2HG      ARG   4  11.120   1.620  -7.886
   38    HG3  ARG   4           3HG      ARG   4  10.681   2.550  -6.452
   39    HD2  ARG   4           2HD      ARG   4  12.868   3.187  -6.720
   40    HD3  ARG   4           3HD      ARG   4  13.057   1.815  -5.628
   41    HE   ARG   4           HE       ARG   4  14.161   0.697  -7.288
   42   HH11  ARG   4          1HH1      ARG   4  12.429   3.375  -8.683
   43   HH12  ARG   4          2HH1      ARG   4  13.130   3.177 -10.256
   44   HH21  ARG   4          1HH2      ARG   4  15.090   0.426  -9.354
   45   HH22  ARG   4          2HH2      ARG   4  14.642   1.499 -10.636
   46    H    VAL   5           H        VAL   5   7.914   1.216  -7.728
   47    HA   VAL   5           HA       VAL   5   7.012  -1.191  -8.928
   48    HB   VAL   5           HB       VAL   5   5.972   0.202 -10.610
   49   HG11  VAL   5          1HG1      VAL   5   5.847   1.244  -7.795
   50   HG12  VAL   5          2HG1      VAL   5   4.793   1.855  -9.072
   51   HG13  VAL   5          3HG1      VAL   5   4.731   0.152  -8.615
   52   HG21  VAL   5          3HG2      VAL   5   6.529   2.823  -9.956
   53   HG22  VAL   5          1HG2      VAL   5   8.106   2.037  -9.879
   54   HG23  VAL   5          2HG2      VAL   5   7.149   1.948 -11.357
   55    H    TYR   6           H        TYR   6   7.537  -2.120 -10.904
   56    HA   TYR   6           HA       TYR   6  10.028  -1.175 -12.158
   57    HB2  TYR   6           2HB      TYR   6  10.113  -3.322 -10.647
   58    HB3  TYR   6           3HB      TYR   6   9.388  -4.099 -12.050
   59    HD1  TYR   6           HD1      TYR   6  12.227  -1.798 -11.247
   60    HD2  TYR   6           HD2      TYR   6  10.813  -5.058 -13.588
   61    HE1  TYR   6           HE1      TYR   6  14.455  -2.027 -12.262
   62    HE2  TYR   6           HE2      TYR   6  13.038  -5.297 -14.609
   63    HH   TYR   6           HH       TYR   6  15.196  -3.217 -14.821
   64    H    ARG   7           H        ARG   7  10.302  -1.811 -14.395
   65    HA   ARG   7           HA       ARG   7   7.920  -1.462 -15.903
   66    HB2  ARG   7           2HB      ARG   7  10.775  -2.065 -16.640
   67    HB3  ARG   7           3HB      ARG   7   9.508  -1.997 -17.857
   68    HG2  ARG   7           2HG      ARG   7  10.480   0.126 -17.877
   69    HG3  ARG   7           3HG      ARG   7   8.987   0.324 -16.957
   70    HD2  ARG   7           2HD      ARG   7  10.121   0.456 -14.920
   71    HD3  ARG   7           3HD      ARG   7  11.586  -0.266 -15.585
   72    HE   ARG   7           HE       ARG   7  10.944   2.229 -16.820
   73   HH11  ARG   7          1HH1      ARG   7  12.417   0.765 -14.026
   74   HH12  ARG   7          2HH1      ARG   7  13.450   2.118 -13.700
   75   HH21  ARG   7          1HH2      ARG   7  12.299   4.016 -16.402
   76   HH22  ARG   7          2HH2      ARG   7  13.381   3.966 -15.052
   77    H    GLY   8           H        GLY   8   6.440  -2.989 -16.204
   78    HA2  GLY   8           2HA      GLY   8   6.311  -5.144 -17.614
   79    HA3  GLY   8           3HA      GLY   8   7.312  -5.798 -16.326
   80    H    ILE   9           H        ILE   9   5.751  -3.971 -14.428
   81    HA   ILE   9           HA       ILE   9   3.212  -5.441 -14.369
   82    HB   ILE   9           HB       ILE   9   4.704  -6.650 -12.870
   83   HG12  ILE   9          2HG1      ILE   9   3.369  -6.442 -10.781
   84   HG13  ILE   9          3HG1      ILE   9   2.652  -4.966 -11.417
   85   HG21  ILE   9          1HG2      ILE   9   4.961  -4.189 -11.176
   86   HG22  ILE   9          2HG2      ILE   9   5.887  -5.687 -11.100
   87   HG23  ILE   9          3HG2      ILE   9   6.130  -4.567 -12.441
   88   HD11  ILE   9          3HD1      ILE   9   2.457  -7.395 -13.091
   89   HD12  ILE   9          1HD1      ILE   9   1.479  -7.331 -11.625
   90   HD13  ILE   9          2HD1      ILE   9   1.306  -6.080 -12.855
   91    H    TYR  10           H        TYR  10   1.531  -4.148 -14.016
   92    HA   TYR  10           HA       TYR  10   1.914  -1.355 -13.550
   93    HB2  TYR  10           2HB      TYR  10  -0.413  -3.141 -14.066
   94    HB3  TYR  10           3HB      TYR  10  -0.731  -1.575 -13.329
   95    HD1  TYR  10           HD1      TYR  10   1.038  -3.114 -16.230
   96    HD2  TYR  10           HD2      TYR  10  -0.989   0.293 -14.685
   97    HE1  TYR  10           HE1      TYR  10   1.132  -2.058 -18.450
   98    HE2  TYR  10           HE2      TYR  10  -0.902   1.357 -16.900
   99    HH   TYR  10           HH       TYR  10   1.072   0.588 -19.232
  100    H    ARG  11           H        ARG  11   2.427  -0.605 -11.603
  101    HA   ARG  11           HA       ARG  11   0.704  -1.180  -9.354
  102    HB2  ARG  11           2HB      ARG  11   3.582  -2.044  -9.437
  103    HB3  ARG  11           3HB      ARG  11   2.803  -1.642  -7.913
  104    HG2  ARG  11           2HG      ARG  11   1.009  -3.334  -8.604
  105    HG3  ARG  11           3HG      ARG  11   2.183  -3.879  -9.804
  106    HD2  ARG  11           2HD      ARG  11   3.637  -4.682  -8.214
  107    HD3  ARG  11           3HD      ARG  11   3.050  -3.580  -6.969
  108    HE   ARG  11           HE       ARG  11   2.086  -6.206  -7.526
  109   HH11  ARG  11          1HH1      ARG  11   1.141  -3.057  -6.382
  110   HH12  ARG  11          2HH1      ARG  11  -0.185  -3.653  -5.440
  111   HH21  ARG  11          1HH2      ARG  11   0.342  -7.003  -6.291
  112   HH22  ARG  11          2HH2      ARG  11  -0.638  -5.898  -5.389
  113    H    ARG  12           H        ARG  12   1.747   0.025  -7.326
  114    HA   ARG  12           HA       ARG  12   2.991   2.532  -8.182
  115    HB2  ARG  12           2HB      ARG  12   0.413   2.667  -8.076
  116    HB3  ARG  12           3HB      ARG  12   0.621   2.583  -6.332
  117    HG2  ARG  12           2HG      ARG  12   1.857   4.616  -6.302
  118    HG3  ARG  12           3HG      ARG  12   1.950   4.650  -8.064
  119    HD2  ARG  12           2HD      ARG  12  -0.518   4.848  -8.142
  120    HD3  ARG  12           3HD      ARG  12  -0.536   4.934  -6.381
  121    HE   ARG  12           HE       ARG  12   1.192   6.904  -7.431
  122   HH11  ARG  12          1HH1      ARG  12  -2.188   6.139  -7.100
  123   HH12  ARG  12          2HH1      ARG  12  -2.697   7.795  -7.109
  124   HH21  ARG  12          1HH2      ARG  12   0.534   9.088  -7.444
  125   HH22  ARG  12          2HH2      ARG  12  -1.149   9.472  -7.305
  126    H    ARG  13           H        ARG  13   4.476   3.271  -6.783
  127    HA   ARG  13           HA       ARG  13   5.439   1.710  -4.698
  128    HB2  ARG  13           2HB      ARG  13   5.770   4.689  -5.098
  129    HB3  ARG  13           3HB      ARG  13   6.764   3.687  -4.049
  130    HG2  ARG  13           2HG      ARG  13   7.332   2.346  -6.134
  131    HG3  ARG  13           3HG      ARG  13   6.619   3.680  -7.044
  132    HD2  ARG  13           2HD      ARG  13   8.909   3.888  -5.091
  133    HD3  ARG  13           3HD      ARG  13   9.043   3.926  -6.849
  134    HE   ARG  13           HE       ARG  13   7.271   5.939  -6.037
  135   HH11  ARG  13          1HH1      ARG  13  10.653   5.133  -5.864
  136   HH12  ARG  13          2HH1      ARG  13  11.177   6.784  -5.804
  137   HH21  ARG  13          1HH2      ARG  13   7.948   8.116  -5.958
  138   HH22  ARG  13          2HH2      ARG  13   9.638   8.479  -5.856
  Start of MODEL   10
    1    H1   LYS   1           H        LYS   1   0.764  -0.528   0.633
    2    HA   LYS   1           HA       LYS   1   1.280   0.282  -2.116
    3    HB2  LYS   1           2HB      LYS   1   2.633   1.597   0.247
    4    HB3  LYS   1           3HB      LYS   1   3.096   1.817  -1.435
    5    HG2  LYS   1           2HG      LYS   1   0.334   2.459  -0.462
    6    HG3  LYS   1           3HG      LYS   1   1.659   3.621  -0.358
    7    HD2  LYS   1           2HD      LYS   1   1.907   3.700  -2.701
    8    HD3  LYS   1           3HD      LYS   1   0.928   2.250  -2.933
    9    HE2  LYS   1           2HE      LYS   1  -0.196   4.762  -1.725
   10    HE3  LYS   1           3HE      LYS   1  -0.152   4.503  -3.468
   11    HZ1  LYS   1           3HZ      LYS   1  -2.271   3.843  -2.422
   12    HZ2  LYS   1           1HZ      LYS   1  -1.449   2.657  -1.539
   13    HZ3  LYS   1           2HZ      LYS   1  -1.509   2.565  -3.227
   14    H    TRP   2           H        TRP   2   3.213  -0.530  -2.965
   15    HA   TRP   2           HA       TRP   2   4.558  -2.520  -1.257
   16    HB2  TRP   2           2HB      TRP   2   4.399  -4.075  -2.887
   17    HB3  TRP   2           3HB      TRP   2   3.123  -3.041  -3.524
   18    HD1  TRP   2           HD1      TRP   2   4.060  -1.142  -5.408
   19    HE1  TRP   2           HE1      TRP   2   5.766  -1.527  -7.297
   20    HE3  TRP   2           HE3      TRP   2   6.333  -5.352  -3.605
   21    HZ2  TRP   2           HZ2      TRP   2   7.805  -3.371  -7.938
   22    HZ3  TRP   2           HZ3      TRP   2   8.152  -6.364  -4.917
   23    HH2  TRP   2           HH2      TRP   2   8.871  -5.393  -7.038
   24    H    PHE   3           H        PHE   3   6.752  -3.164  -2.488
   25    HA   PHE   3           HA       PHE   3   8.528  -1.076  -2.087
   26    HB2  PHE   3           2HB      PHE   3   8.656  -3.792  -3.083
   27    HB3  PHE   3           3HB      PHE   3   9.769  -2.748  -3.961
   28    HD1  PHE   3           HD1      PHE   3  10.929  -0.971  -2.172
   29    HD2  PHE   3           HD2      PHE   3   9.661  -4.960  -1.399
   30    HE1  PHE   3           HE1      PHE   3  12.534  -1.118  -0.313
   31    HE2  PHE   3           HE2      PHE   3  11.263  -5.113   0.462
   32    HZ   PHE   3           HZ       PHE   3  12.702  -3.190   1.008
   33    H    ARG   4           H        ARG   4  10.191  -0.542  -4.007
   34    HA   ARG   4           HA       ARG   4   8.958   1.354  -5.614
   35    HB2  ARG   4           2HB      ARG   4  11.113   1.251  -6.963
   36    HB3  ARG   4           3HB      ARG   4  11.278   1.586  -5.244
   37    HG2  ARG   4           2HG      ARG   4  12.155  -0.512  -4.789
   38    HG3  ARG   4           3HG      ARG   4  11.513  -1.210  -6.277
   39    HD2  ARG   4           2HD      ARG   4  13.168  -0.247  -7.591
   40    HD3  ARG   4           3HD      ARG   4  13.542   0.986  -6.387
   41    HE   ARG   4           HE       ARG   4  14.121  -1.658  -5.467
   42   HH11  ARG   4          1HH1      ARG   4  15.321   0.994  -7.375
   43   HH12  ARG   4          2HH1      ARG   4  16.986   0.561  -7.168
   44   HH21  ARG   4          1HH2      ARG   4  16.309  -2.240  -5.187
   45   HH22  ARG   4          2HH2      ARG   4  17.546  -1.279  -5.924
   46    H    VAL   5           H        VAL   5   7.857   1.276  -7.463
   47    HA   VAL   5           HA       VAL   5   7.170  -1.204  -8.662
   48    HB   VAL   5           HB       VAL   5   5.908   0.084 -10.272
   49   HG11  VAL   5          1HG1      VAL   5   5.796   1.080  -7.440
   50   HG12  VAL   5          2HG1      VAL   5   4.623   1.578  -8.660
   51   HG13  VAL   5          3HG1      VAL   5   4.774  -0.124  -8.223
   52   HG21  VAL   5          3HG2      VAL   5   6.972   1.915 -11.035
   53   HG22  VAL   5          1HG2      VAL   5   6.134   2.725  -9.712
   54   HG23  VAL   5          2HG2      VAL   5   7.804   2.196  -9.506
   55    H    TYR   6           H        TYR   6   7.415  -1.664 -11.001
   56    HA   TYR   6           HA       TYR   6   9.853  -0.574 -12.196
   57    HB2  TYR   6           2HB      TYR   6  10.161  -2.818 -10.840
   58    HB3  TYR   6           3HB      TYR   6   9.466  -3.538 -12.288
   59    HD1  TYR   6           HD1      TYR   6  12.115  -1.063 -11.361
   60    HD2  TYR   6           HD2      TYR   6  10.929  -4.247 -13.922
   61    HE1  TYR   6           HE1      TYR   6  14.326  -1.012 -12.438
   62    HE2  TYR   6           HE2      TYR   6  13.137  -4.206 -15.005
   63    HH   TYR   6           HH       TYR   6  15.671  -1.964 -13.926
   64    H    ARG   7           H        ARG   7  10.127  -1.491 -14.485
   65    HA   ARG   7           HA       ARG   7   7.666  -1.027 -15.890
   66    HB2  ARG   7           2HB      ARG   7  10.317  -1.900 -17.045
   67    HB3  ARG   7           3HB      ARG   7   8.993  -1.115 -17.894
   68    HG2  ARG   7           2HG      ARG   7  10.722   0.107 -15.754
   69    HG3  ARG   7           3HG      ARG   7  10.767   0.463 -17.482
   70    HD2  ARG   7           2HD      ARG   7   8.416   1.246 -17.325
   71    HD3  ARG   7           3HD      ARG   7   8.489   1.000 -15.581
   72    HE   ARG   7           HE       ARG   7  10.596   2.683 -16.497
   73   HH11  ARG   7          1HH1      ARG   7   7.203   2.630 -15.717
   74   HH12  ARG   7          2HH1      ARG   7   7.134   4.316 -15.323
   75   HH21  ARG   7          1HH2      ARG   7  10.517   4.904 -15.982
   76   HH22  ARG   7          2HH2      ARG   7   9.020   5.609 -15.476
   77    H    GLY   8           H        GLY   8   6.184  -2.583 -16.037
   78    HA2  GLY   8           2HA      GLY   8   5.977  -4.709 -17.492
   79    HA3  GLY   8           3HA      GLY   8   7.081  -5.373 -16.297
   80    H    ILE   9           H        ILE   9   5.673  -3.639 -14.227
   81    HA   ILE   9           HA       ILE   9   3.164  -5.151 -14.007
   82    HB   ILE   9           HB       ILE   9   4.794  -6.328 -12.632
   83   HG12  ILE   9          2HG1      ILE   9   3.614  -6.168 -10.449
   84   HG13  ILE   9          3HG1      ILE   9   2.815  -4.706 -11.016
   85   HG21  ILE   9          1HG2      ILE   9   5.113  -3.869 -10.945
   86   HG22  ILE   9          2HG2      ILE   9   6.081  -5.342 -10.948
   87   HG23  ILE   9          3HG2      ILE   9   6.194  -4.210 -12.295
   88   HD11  ILE   9          3HD1      ILE   9   2.054  -7.418 -11.379
   89   HD12  ILE   9          1HD1      ILE   9   1.206  -5.952 -11.868
   90   HD13  ILE   9          2HD1      ILE   9   2.373  -6.700 -12.958
   91    H    TYR  10           H        TYR  10   1.481  -3.906 -13.520
   92    HA   TYR  10           HA       TYR  10   1.855  -1.106 -13.013
   93    HB2  TYR  10           2HB      TYR  10  -0.615  -2.831 -13.221
   94    HB3  TYR  10           3HB      TYR  10  -0.671  -1.096 -12.931
   95    HD1  TYR  10           HD1      TYR  10   0.646  -3.613 -15.344
   96    HD2  TYR  10           HD2      TYR  10  -0.699   0.378 -14.734
   97    HE1  TYR  10           HE1      TYR  10   0.754  -3.212 -17.768
   98    HE2  TYR  10           HE2      TYR  10  -0.596   0.789 -17.156
   99    HH   TYR  10           HH       TYR  10  -0.627  -1.343 -19.387
  100    H    ARG  11           H        ARG  11   2.410  -0.418 -11.055
  101    HA   ARG  11           HA       ARG  11   0.747  -1.070  -8.786
  102    HB2  ARG  11           2HB      ARG  11   3.605  -1.972  -8.984
  103    HB3  ARG  11           3HB      ARG  11   2.896  -1.588  -7.421
  104    HG2  ARG  11           2HG      ARG  11   1.006  -3.225  -8.290
  105    HG3  ARG  11           3HG      ARG  11   2.347  -3.851  -9.252
  106    HD2  ARG  11           2HD      ARG  11   3.496  -4.592  -7.417
  107    HD3  ARG  11           3HD      ARG  11   2.800  -3.370  -6.354
  108    HE   ARG  11           HE       ARG  11   1.828  -5.998  -6.774
  109   HH11  ARG  11          1HH1      ARG  11   0.771  -2.724  -6.239
  110   HH12  ARG  11          2HH1      ARG  11  -0.724  -3.190  -5.498
  111   HH21  ARG  11          1HH2      ARG  11  -0.138  -6.624  -5.801
  112   HH22  ARG  11          2HH2      ARG  11  -1.240  -5.408  -5.249
  113    H    ARG  12           H        ARG  12   1.880   0.042  -6.739
  114    HA   ARG  12           HA       ARG  12   3.020   2.615  -7.576
  115    HB2  ARG  12           2HB      ARG  12   0.480   2.675  -7.161
  116    HB3  ARG  12           3HB      ARG  12   0.884   2.459  -5.463
  117    HG2  ARG  12           2HG      ARG  12   1.764   4.553  -5.259
  118    HG3  ARG  12           3HG      ARG  12   2.240   4.638  -6.956
  119    HD2  ARG  12           2HD      ARG  12  -0.332   4.617  -7.386
  120    HD3  ARG  12           3HD      ARG  12  -0.427   5.136  -5.703
  121    HE   ARG  12           HE       ARG  12   0.370   7.194  -6.324
  122   HH11  ARG  12          1HH1      ARG  12   0.872   4.929  -8.920
  123   HH12  ARG  12          2HH1      ARG  12   1.362   6.141 -10.057
  124   HH21  ARG  12          1HH2      ARG  12   1.014   8.799  -7.812
  125   HH22  ARG  12          2HH2      ARG  12   1.443   8.342  -9.426
  126    H    ARG  13           H        ARG  13   4.727   3.201  -6.400
  127    HA   ARG  13           HA       ARG  13   5.487   1.576  -4.123
  128    HB2  ARG  13           2HB      ARG  13   7.633   2.584  -4.300
  129    HB3  ARG  13           3HB      ARG  13   7.088   2.277  -5.944
  130    HG2  ARG  13           2HG      ARG  13   6.481   4.604  -6.213
  131    HG3  ARG  13           3HG      ARG  13   6.927   4.934  -4.537
  132    HD2  ARG  13           2HD      ARG  13   9.241   4.257  -5.050
  133    HD3  ARG  13           3HD      ARG  13   8.776   4.008  -6.732
  134    HE   ARG  13           HE       ARG  13   8.081   6.617  -5.996
  135   HH11  ARG  13          1HH1      ARG  13  10.920   4.669  -6.515
  136   HH12  ARG  13          2HH1      ARG  13  11.911   6.008  -6.992
  137   HH21  ARG  13          1HH2      ARG  13   9.375   8.388  -6.622
  138   HH22  ARG  13          2HH2      ARG  13  11.031   8.123  -7.052
  Start of MODEL   11
    1    H1   LYS   1           H        LYS   1   0.825  -0.395   0.304
    2    HA   LYS   1           HA       LYS   1   2.032   0.594  -2.197
    3    HB2  LYS   1           2HB      LYS   1   2.778   1.151   0.674
    4    HB3  LYS   1           3HB      LYS   1   3.834   1.530  -0.680
    5    HG2  LYS   1           2HG      LYS   1   2.783   3.539  -0.328
    6    HG3  LYS   1           3HG      LYS   1   1.768   2.825  -1.584
    7    HD2  LYS   1           2HD      LYS   1   0.024   2.440  -0.146
    8    HD3  LYS   1           3HD      LYS   1   1.077   2.301   1.265
    9    HE2  LYS   1           2HE      LYS   1  -0.114   4.326   1.528
   10    HE3  LYS   1           3HE      LYS   1   1.515   4.777   1.025
   11    HZ1  LYS   1           3HZ      LYS   1  -0.730   5.690  -0.117
   12    HZ2  LYS   1           1HZ      LYS   1  -0.360   4.396  -1.142
   13    HZ3  LYS   1           2HZ      LYS   1   0.772   5.628  -0.893
   14    H    TRP   2           H        TRP   2   3.747  -0.479  -3.027
   15    HA   TRP   2           HA       TRP   2   4.833  -2.724  -1.459
   16    HB2  TRP   2           2HB      TRP   2   4.413  -4.219  -3.098
   17    HB3  TRP   2           3HB      TRP   2   3.236  -3.034  -3.656
   18    HD1  TRP   2           HD1      TRP   2   4.292  -1.221  -5.561
   19    HE1  TRP   2           HE1      TRP   2   5.846  -1.765  -7.540
   20    HE3  TRP   2           HE3      TRP   2   6.148  -5.697  -3.931
   21    HZ2  TRP   2           HZ2      TRP   2   7.622  -3.819  -8.309
   22    HZ3  TRP   2           HZ3      TRP   2   7.769  -6.888  -5.348
   23    HH2  TRP   2           HH2      TRP   2   8.489  -5.967  -7.491
   24    H    PHE   3           H        PHE   3   6.874  -3.594  -2.810
   25    HA   PHE   3           HA       PHE   3   8.897  -1.732  -2.475
   26    HB2  PHE   3           2HB      PHE   3   8.659  -4.425  -3.510
   27    HB3  PHE   3           3HB      PHE   3   9.840  -3.500  -4.432
   28    HD1  PHE   3           HD1      PHE   3  11.287  -1.903  -2.684
   29    HD2  PHE   3           HD2      PHE   3   9.605  -5.732  -1.895
   30    HE1  PHE   3           HE1      PHE   3  12.956  -2.267  -0.913
   31    HE2  PHE   3           HE2      PHE   3  11.270  -6.102  -0.122
   32    HZ   PHE   3           HZ       PHE   3  12.948  -4.368   0.372
   33    H    ARG   4           H        ARG   4  10.513  -1.358  -4.471
   34    HA   ARG   4           HA       ARG   4   9.431   0.698  -5.989
   35    HB2  ARG   4           2HB      ARG   4  11.931  -0.911  -6.115
   36    HB3  ARG   4           3HB      ARG   4  11.519   0.056  -7.525
   37    HG2  ARG   4           2HG      ARG   4  11.498   1.305  -4.815
   38    HG3  ARG   4           3HG      ARG   4  13.026   1.048  -5.660
   39    HD2  ARG   4           2HD      ARG   4  12.081   2.275  -7.608
   40    HD3  ARG   4           3HD      ARG   4  10.653   2.630  -6.636
   41    HE   ARG   4           HE       ARG   4  12.956   3.465  -5.253
   42   HH11  ARG   4          1HH1      ARG   4  11.032   4.294  -8.034
   43   HH12  ARG   4          2HH1      ARG   4  11.437   5.977  -7.975
   44   HH21  ARG   4          1HH2      ARG   4  13.496   5.679  -5.164
   45   HH22  ARG   4          2HH2      ARG   4  12.839   6.764  -6.343
   46    H    VAL   5           H        VAL   5   8.227   0.779  -7.771
   47    HA   VAL   5           HA       VAL   5   7.193  -1.577  -8.963
   48    HB   VAL   5           HB       VAL   5   6.021  -0.120 -10.496
   49   HG11  VAL   5          1HG1      VAL   5   6.170   0.861  -7.658
   50   HG12  VAL   5          2HG1      VAL   5   4.993   1.481  -8.817
   51   HG13  VAL   5          3HG1      VAL   5   4.986  -0.228  -8.380
   52   HG21  VAL   5          3HG2      VAL   5   6.627   2.470  -9.878
   53   HG22  VAL   5          1HG2      VAL   5   8.215   1.704  -9.851
   54   HG23  VAL   5          2HG2      VAL   5   7.213   1.603 -11.298
   55    H    TYR   6           H        TYR   6   7.121  -1.512 -11.548
   56    HA   TYR   6           HA       TYR   6   9.627  -0.851 -12.790
   57    HB2  TYR   6           2HB      TYR   6   9.881  -3.111 -11.483
   58    HB3  TYR   6           3HB      TYR   6   8.980  -3.776 -12.841
   59    HD1  TYR   6           HD1      TYR   6  11.948  -1.609 -12.161
   60    HD2  TYR   6           HD2      TYR   6  10.163  -4.542 -14.674
   61    HE1  TYR   6           HE1      TYR   6  14.032  -1.755 -13.460
   62    HE2  TYR   6           HE2      TYR   6  12.242  -4.697 -15.979
   63    HH   TYR   6           HH       TYR   6  15.177  -3.155 -14.952
   64    H    ARG   7           H        ARG   7   9.662  -1.547 -15.102
   65    HA   ARG   7           HA       ARG   7   7.139  -0.961 -16.309
   66    HB2  ARG   7           2HB      ARG   7   9.853  -1.665 -17.409
   67    HB3  ARG   7           3HB      ARG   7   8.458  -1.439 -18.455
   68    HG2  ARG   7           2HG      ARG   7   9.535   0.624 -18.473
   69    HG3  ARG   7           3HG      ARG   7   8.209   0.841 -17.329
   70    HD2  ARG   7           2HD      ARG   7   9.612   0.863 -15.501
   71    HD3  ARG   7           3HD      ARG   7  10.873  -0.052 -16.327
   72    HE   ARG   7           HE       ARG   7  10.512   2.482 -17.543
   73   HH11  ARG   7          1HH1      ARG   7  11.871   0.948 -14.728
   74   HH12  ARG   7          2HH1      ARG   7  13.071   2.174 -14.480
   75   HH21  ARG   7          1HH2      ARG   7  12.087   4.101 -17.226
   76   HH22  ARG   7          2HH2      ARG   7  13.192   3.967 -15.900
   77    H    GLY   8           H        GLY   8   5.566  -2.423 -16.439
   78    HA2  GLY   8           2HA      GLY   8   5.149  -4.482 -17.936
   79    HA3  GLY   8           3HA      GLY   8   6.291  -5.248 -16.842
   80    H    ILE   9           H        ILE   9   5.115  -3.515 -14.627
   81    HA   ILE   9           HA       ILE   9   2.536  -4.877 -14.296
   82    HB   ILE   9           HB       ILE   9   4.169  -6.244 -13.109
   83   HG12  ILE   9          2HG1      ILE   9   3.155  -6.120 -10.833
   84   HG13  ILE   9          3HG1      ILE   9   2.406  -4.593 -11.287
   85   HG21  ILE   9          1HG2      ILE   9   4.771  -3.930 -11.301
   86   HG22  ILE   9          2HG2      ILE   9   5.640  -5.454 -11.482
   87   HG23  ILE   9          3HG2      ILE   9   5.726  -4.234 -12.752
   88   HD11  ILE   9          3HD1      ILE   9   1.249  -7.041 -11.509
   89   HD12  ILE   9          1HD1      ILE   9   0.768  -5.605 -12.412
   90   HD13  ILE   9          2HD1      ILE   9   1.862  -6.780 -13.142
   91    H    TYR  10           H        TYR  10   0.987  -3.552 -13.610
   92    HA   TYR  10           HA       TYR  10   1.602  -0.818 -12.987
   93    HB2  TYR  10           2HB      TYR  10  -1.077  -2.212 -12.844
   94    HB3  TYR  10           3HB      TYR  10  -0.791  -0.478 -12.941
   95    HD1  TYR  10           HD2      TYR  10  -0.114   0.557 -15.045
   96    HD2  TYR  10           HD1      TYR  10  -0.892  -3.619 -14.805
   97    HE1  TYR  10           HE2      TYR  10  -0.227   0.443 -17.499
   98    HE2  TYR  10           HE1      TYR  10  -1.006  -3.745 -17.259
   99    HH   TYR  10           HH       TYR  10   0.161  -1.467 -19.272
  100    H    ARG  11           H        ARG  11   2.344  -0.283 -11.044
  101    HA   ARG  11           HA       ARG  11   0.809  -0.961  -8.692
  102    HB2  ARG  11           2HB      ARG  11   3.591  -2.003  -9.144
  103    HB3  ARG  11           3HB      ARG  11   2.999  -1.691  -7.518
  104    HG2  ARG  11           2HG      ARG  11   0.982  -3.170  -8.309
  105    HG3  ARG  11           3HG      ARG  11   2.164  -3.766  -9.476
  106    HD2  ARG  11           2HD      ARG  11   3.466  -4.739  -7.866
  107    HD3  ARG  11           3HD      ARG  11   2.978  -3.587  -6.624
  108    HE   ARG  11           HE       ARG  11   1.707  -6.082  -7.270
  109   HH11  ARG  11          1HH1      ARG  11   1.267  -2.922  -5.878
  110   HH12  ARG  11          2HH1      ARG  11  -0.080  -3.398  -4.897
  111   HH21  ARG  11          1HH2      ARG  11  -0.064  -6.722  -5.983
  112   HH22  ARG  11          2HH2      ARG  11  -0.835  -5.560  -4.957
  113    H    ARG  12           H        ARG  12   2.157  -0.037  -6.681
  114    HA   ARG  12           HA       ARG  12   3.507   2.445  -7.427
  115    HB2  ARG  12           2HB      ARG  12   1.038   2.891  -7.169
  116    HB3  ARG  12           3HB      ARG  12   1.199   2.424  -5.481
  117    HG2  ARG  12           2HG      ARG  12   1.318   4.739  -5.425
  118    HG3  ARG  12           3HG      ARG  12   3.009   4.239  -5.361
  119    HD2  ARG  12           2HD      ARG  12   2.818   6.047  -6.919
  120    HD3  ARG  12           3HD      ARG  12   3.133   4.567  -7.824
  121    HE   ARG  12           HE       ARG  12   0.348   5.054  -7.627
  122   HH11  ARG  12          1HH1      ARG  12   3.221   6.122  -9.277
  123   HH12  ARG  12          2HH1      ARG  12   2.369   6.670 -10.682
  124   HH21  ARG  12          1HH2      ARG  12  -0.786   5.772  -9.471
  125   HH22  ARG  12          2HH2      ARG  12   0.089   6.472 -10.791
  126    H    ARG  13           H        ARG  13   4.939   3.216  -5.894
  127    HA   ARG  13           HA       ARG  13   6.162   1.392  -4.198
  128    HB2  ARG  13           2HB      ARG  13   6.197   4.413  -4.063
  129    HB3  ARG  13           3HB      ARG  13   7.312   3.357  -3.206
  130    HG2  ARG  13           2HG      ARG  13   7.757   2.428  -5.632
  131    HG3  ARG  13           3HG      ARG  13   7.170   4.027  -6.093
  132    HD2  ARG  13           2HD      ARG  13   9.509   3.361  -4.318
  133    HD3  ARG  13           3HD      ARG  13   9.543   4.155  -5.892
  134    HE   ARG  13           HE       ARG  13   8.027   5.825  -4.414
  135   HH11  ARG  13          1HH1      ARG  13  11.145   4.366  -3.891
  136   HH12  ARG  13          2HH1      ARG  13  11.743   5.679  -2.932
  137   HH21  ARG  13          1HH2      ARG  13   8.804   7.559  -3.153
  138   HH22  ARG  13          2HH2      ARG  13  10.410   7.494  -2.512
  Start of MODEL   12
    1    H1   LYS   1           H        LYS   1  -0.157   0.022   0.037
    2    HA   LYS   1           HA       LYS   1   1.225   0.786  -2.439
    3    HB2  LYS   1           2HB      LYS   1   1.951   1.435   0.423
    4    HB3  LYS   1           3HB      LYS   1   2.738   2.066  -1.018
    5    HG2  LYS   1           2HG      LYS   1   0.953   3.443  -1.548
    6    HG3  LYS   1           3HG      LYS   1  -0.186   2.506  -0.578
    7    HD2  LYS   1           2HD      LYS   1   0.148   4.405   0.715
    8    HD3  LYS   1           3HD      LYS   1   1.280   3.250   1.423
    9    HE2  LYS   1           2HE      LYS   1   2.954   4.279  -0.295
   10    HE3  LYS   1           3HE      LYS   1   1.820   5.629  -0.304
   11    HZ1  LYS   1           3HZ      LYS   1   2.065   5.748   2.126
   12    HZ2  LYS   1           1HZ      LYS   1   3.525   6.022   1.316
   13    HZ3  LYS   1           2HZ      LYS   1   3.238   4.532   2.062
   14    H    TRP   2           H        TRP   2   2.945  -0.314  -3.158
   15    HA   TRP   2           HA       TRP   2   4.064  -2.403  -1.404
   16    HB2  TRP   2           2HB      TRP   2   3.915  -3.931  -3.059
   17    HB3  TRP   2           3HB      TRP   2   2.737  -2.823  -3.757
   18    HD1  TRP   2           HD1      TRP   2   3.887  -0.962  -5.560
   19    HE1  TRP   2           HE1      TRP   2   5.676  -1.424  -7.351
   20    HE3  TRP   2           HE3      TRP   2   5.815  -5.308  -3.679
   21    HZ2  TRP   2           HZ2      TRP   2   7.645  -3.373  -7.895
   22    HZ3  TRP   2           HZ3      TRP   2   7.649  -6.408  -4.896
   23    HH2  TRP   2           HH2      TRP   2   8.543  -5.459  -6.960
   24    H    PHE   3           H        PHE   3   6.288  -3.157  -2.514
   25    HA   PHE   3           HA       PHE   3   8.149  -1.174  -1.985
   26    HB2  PHE   3           2HB      PHE   3   8.185  -3.884  -3.005
   27    HB3  PHE   3           3HB      PHE   3   9.403  -2.895  -3.805
   28    HD1  PHE   3           HD1      PHE   3  10.554  -1.203  -1.932
   29    HD2  PHE   3           HD2      PHE   3   9.024  -5.120  -1.278
   30    HE1  PHE   3           HE1      PHE   3  12.038  -1.454   0.015
   31    HE2  PHE   3           HE2      PHE   3  10.504  -5.377   0.670
   32    HZ   PHE   3           HZ       PHE   3  12.013  -3.543   1.319
   33    H    ARG   4           H        ARG   4   9.948  -0.717  -3.799
   34    HA   ARG   4           HA       ARG   4   8.919   1.260  -5.452
   35    HB2  ARG   4           2HB      ARG   4  11.140   1.046  -6.677
   36    HB3  ARG   4           3HB      ARG   4  11.223   1.357  -4.948
   37    HG2  ARG   4           2HG      ARG   4  12.057  -0.716  -4.471
   38    HG3  ARG   4           3HG      ARG   4  11.306  -1.462  -5.883
   39    HD2  ARG   4           2HD      ARG   4  13.580  -1.430  -6.404
   40    HD3  ARG   4           3HD      ARG   4  12.927  -0.034  -7.260
   41    HE   ARG   4           HE       ARG   4  13.887   0.662  -4.669
   42   HH11  ARG   4          1HH1      ARG   4  14.890  -0.026  -7.931
   43   HH12  ARG   4          2HH1      ARG   4  16.339   0.916  -7.823
   44   HH21  ARG   4          1HH2      ARG   4  15.793   1.906  -4.514
   45   HH22  ARG   4          2HH2      ARG   4  16.853   2.014  -5.878
   46    H    VAL   5           H        VAL   5   7.936   1.267  -7.369
   47    HA   VAL   5           HA       VAL   5   7.175  -1.160  -8.633
   48    HB   VAL   5           HB       VAL   5   6.087   0.213 -10.299
   49   HG11  VAL   5          1HG1      VAL   5   5.866   1.207  -7.471
   50   HG12  VAL   5          2HG1      VAL   5   4.788   1.757  -8.756
   51   HG13  VAL   5          3HG1      VAL   5   4.834   0.050  -8.310
   52   HG21  VAL   5          3HG2      VAL   5   7.997   2.255  -9.325
   53   HG22  VAL   5          1HG2      VAL   5   7.396   1.947 -10.954
   54   HG23  VAL   5          2HG2      VAL   5   6.393   2.817  -9.794
   55    H    TYR   6           H        TYR   6   7.506  -1.556 -10.995
   56    HA   TYR   6           HA       TYR   6  10.064  -0.610 -12.034
   57    HB2  TYR   6           2HB      TYR   6  10.203  -2.863 -10.663
   58    HB3  TYR   6           3HB      TYR   6   9.562  -3.555 -12.149
   59    HD1  TYR   6           HD1      TYR   6  12.383  -1.609 -10.742
   60    HD2  TYR   6           HD2      TYR   6  10.954  -3.905 -14.027
   61    HE1  TYR   6           HE1      TYR   6  14.651  -1.650 -11.692
   62    HE2  TYR   6           HE2      TYR   6  13.219  -3.954 -14.985
   63    HH   TYR   6           HH       TYR   6  15.283  -2.910 -14.886
   64    H    ARG   7           H        ARG   7  10.401  -1.267 -14.311
   65    HA   ARG   7           HA       ARG   7   8.019  -0.831 -15.820
   66    HB2  ARG   7           2HB      ARG   7  10.693  -1.696 -16.915
   67    HB3  ARG   7           3HB      ARG   7   9.428  -0.798 -17.744
   68    HG2  ARG   7           2HG      ARG   7  11.102   0.207 -15.451
   69    HG3  ARG   7           3HG      ARG   7  11.283   0.649 -17.150
   70    HD2  ARG   7           2HD      ARG   7   8.799   1.127 -15.509
   71    HD3  ARG   7           3HD      ARG   7  10.052   2.333 -15.800
   72    HE   ARG   7           HE       ARG   7   9.132   1.293 -18.255
   73   HH11  ARG   7          1HH1      ARG   7   8.145   3.372 -15.643
   74   HH12  ARG   7          2HH1      ARG   7   7.090   4.329 -16.630
   75   HH21  ARG   7          1HH2      ARG   7   7.747   2.546 -19.565
   76   HH22  ARG   7          2HH2      ARG   7   6.863   3.857 -18.861
   77    H    GLY   8           H        GLY   8   6.548  -2.377 -16.107
   78    HA2  GLY   8           2HA      GLY   8   6.423  -4.459 -17.632
   79    HA3  GLY   8           3HA      GLY   8   7.458  -5.160 -16.397
   80    H    ILE   9           H        ILE   9   5.921  -3.464 -14.373
   81    HA   ILE   9           HA       ILE   9   3.401  -4.968 -14.339
   82    HB   ILE   9           HB       ILE   9   4.939  -6.227 -12.932
   83   HG12  ILE   9          2HG1      ILE   9   3.642  -6.163 -10.822
   84   HG13  ILE   9          3HG1      ILE   9   2.913  -4.645 -11.334
   85   HG21  ILE   9          1HG2      ILE   9   5.200  -3.844 -11.129
   86   HG22  ILE   9          2HG2      ILE   9   6.144  -5.333 -11.139
   87   HG23  ILE   9          3HG2      ILE   9   6.349  -4.151 -12.431
   88   HD11  ILE   9          3HD1      ILE   9   1.360  -5.721 -12.478
   89   HD12  ILE   9          1HD1      ILE   9   2.576  -6.638 -13.367
   90   HD13  ILE   9          2HD1      ILE   9   1.985  -7.230 -11.814
   91    H    TYR  10           H        TYR  10   1.709  -3.719 -13.893
   92    HA   TYR  10           HA       TYR  10   2.087  -0.949 -13.250
   93    HB2  TYR  10           2HB      TYR  10  -0.242  -2.692 -13.919
   94    HB3  TYR  10           3HB      TYR  10  -0.553  -1.156 -13.117
   95    HD1  TYR  10           HD1      TYR  10   1.932  -2.098 -15.740
   96    HD2  TYR  10           HD2      TYR  10  -1.435   0.286 -14.701
   97    HE1  TYR  10           HE1      TYR  10   2.089  -0.943 -17.906
   98    HE2  TYR  10           HE2      TYR  10  -1.289   1.446 -16.864
   99    HH   TYR  10           HH       TYR  10  -0.327   1.439 -18.897
  100    H    ARG  11           H        ARG  11   2.558  -0.348 -11.242
  101    HA   ARG  11           HA       ARG  11   0.789  -1.098  -9.079
  102    HB2  ARG  11           2HB      ARG  11   3.675  -1.930  -9.172
  103    HB3  ARG  11           3HB      ARG  11   2.873  -1.636  -7.634
  104    HG2  ARG  11           2HG      ARG  11   1.121  -3.299  -8.377
  105    HG3  ARG  11           3HG      ARG  11   2.215  -3.714  -9.698
  106    HD2  ARG  11           2HD      ARG  11   3.775  -4.652  -8.292
  107    HD3  ARG  11           3HD      ARG  11   3.261  -3.688  -6.908
  108    HE   ARG  11           HE       ARG  11   2.315  -6.264  -7.624
  109   HH11  ARG  11          1HH1      ARG  11   1.293  -3.224  -6.269
  110   HH12  ARG  11          2HH1      ARG  11  -0.001  -3.920  -5.350
  111   HH21  ARG  11          1HH2      ARG  11   0.615  -7.192  -6.419
  112   HH22  ARG  11          2HH2      ARG  11  -0.385  -6.177  -5.435
  113    H    ARG  12           H        ARG  12   1.751  -0.027  -6.950
  114    HA   ARG  12           HA       ARG  12   2.925   2.577  -7.623
  115    HB2  ARG  12           2HB      ARG  12   0.319   2.512  -7.342
  116    HB3  ARG  12           3HB      ARG  12   0.699   2.432  -5.626
  117    HG2  ARG  12           2HG      ARG  12   0.504   4.682  -5.871
  118    HG3  ARG  12           3HG      ARG  12   2.223   4.500  -6.223
  119    HD2  ARG  12           2HD      ARG  12   1.488   5.845  -7.961
  120    HD3  ARG  12           3HD      ARG  12   1.450   4.234  -8.675
  121    HE   ARG  12           HE       ARG  12  -1.047   4.979  -7.495
  122   HH11  ARG  12          1HH1      ARG  12   0.941   5.279 -10.337
  123   HH12  ARG  12          2HH1      ARG  12  -0.396   5.565 -11.401
  124   HH21  ARG  12          1HH2      ARG  12  -2.816   5.355  -8.886
  125   HH22  ARG  12          2HH2      ARG  12  -2.532   5.610 -10.575
  126    H    ARG  13           H        ARG  13   4.406   3.301  -6.198
  127    HA   ARG  13           HA       ARG  13   5.556   1.597  -4.324
  128    HB2  ARG  13           2HB      ARG  13   5.704   4.617  -4.400
  129    HB3  ARG  13           3HB      ARG  13   6.821   3.552  -3.556
  130    HG2  ARG  13           2HG      ARG  13   7.093   2.515  -5.972
  131    HG3  ARG  13           3HG      ARG  13   6.568   4.130  -6.453
  132    HD2  ARG  13           2HD      ARG  13   8.366   5.029  -4.920
  133    HD3  ARG  13           3HD      ARG  13   8.964   3.375  -4.795
  134    HE   ARG  13           HE       ARG  13   8.732   3.998  -7.503
  135   HH11  ARG  13          1HH1      ARG  13  10.588   4.985  -4.728
  136   HH12  ARG  13          2HH1      ARG  13  11.977   5.442  -5.656
  137   HH21  ARG  13          1HH2      ARG  13  10.555   4.597  -8.736
  138   HH22  ARG  13          2HH2      ARG  13  11.957   5.222  -7.936
  Start of MODEL   13
    1    H1   LYS   1           H        LYS   1   0.258  -0.571  -0.433
    2    HA   LYS   1           HA       LYS   1   1.311   0.963  -2.565
    3    HB2  LYS   1           2HB      LYS   1   2.979   2.250  -1.148
    4    HB3  LYS   1           3HB      LYS   1   1.323   2.843  -1.126
    5    HG2  LYS   1           2HG      LYS   1   2.143   0.917   0.979
    6    HG3  LYS   1           3HG      LYS   1   2.735   2.576   1.083
    7    HD2  LYS   1           2HD      LYS   1   0.274   3.247   0.719
    8    HD3  LYS   1           3HD      LYS   1  -0.092   1.574   1.146
    9    HE2  LYS   1           2HE      LYS   1  -0.252   2.729   3.170
   10    HE3  LYS   1           3HE      LYS   1   1.347   1.988   3.223
   11    HZ1  LYS   1           3HZ      LYS   1   0.636   4.745   3.285
   12    HZ2  LYS   1           1HZ      LYS   1   1.736   4.428   2.039
   13    HZ3  LYS   1           2HZ      LYS   1   2.121   4.012   3.633
   14    H    TRP   2           H        TRP   2   2.988  -0.122  -3.383
   15    HA   TRP   2           HA       TRP   2   4.368  -2.046  -1.628
   16    HB2  TRP   2           2HB      TRP   2   4.185  -3.650  -3.207
   17    HB3  TRP   2           3HB      TRP   2   2.901  -2.635  -3.859
   18    HD1  TRP   2           HD1      TRP   2   3.815  -0.795  -5.813
   19    HE1  TRP   2           HE1      TRP   2   5.495  -1.239  -7.712
   20    HE3  TRP   2           HE3      TRP   2   6.108  -4.950  -3.913
   21    HZ2  TRP   2           HZ2      TRP   2   7.523  -3.104  -8.323
   22    HZ3  TRP   2           HZ3      TRP   2   7.908  -6.004  -5.217
   23    HH2  TRP   2           HH2      TRP   2   8.599  -5.099  -7.377
   24    H    PHE   3           H        PHE   3   6.544  -2.730  -2.869
   25    HA   PHE   3           HA       PHE   3   8.327  -0.633  -2.556
   26    HB2  PHE   3           2HB      PHE   3   8.439  -3.378  -3.470
   27    HB3  PHE   3           3HB      PHE   3   9.541  -2.362  -4.395
   28    HD1  PHE   3           HD1      PHE   3  10.729  -0.535  -2.679
   29    HD2  PHE   3           HD2      PHE   3   9.464  -4.494  -1.762
   30    HE1  PHE   3           HE1      PHE   3  12.359  -0.626  -0.838
   31    HE2  PHE   3           HE2      PHE   3  11.091  -4.591   0.080
   32    HZ   PHE   3           HZ       PHE   3  12.541  -2.655   0.545
   33    H    ARG   4           H        ARG   4   9.964  -0.160  -4.513
   34    HA   ARG   4           HA       ARG   4   8.706   1.685  -6.163
   35    HB2  ARG   4           2HB      ARG   4  11.095   1.768  -5.700
   36    HB3  ARG   4           3HB      ARG   4  11.341   0.262  -6.573
   37    HG2  ARG   4           2HG      ARG   4  10.036   2.395  -8.113
   38    HG3  ARG   4           3HG      ARG   4  11.703   2.718  -7.631
   39    HD2  ARG   4           2HD      ARG   4  11.106   0.042  -8.757
   40    HD3  ARG   4           3HD      ARG   4  11.074   1.410  -9.869
   41    HE   ARG   4           HE       ARG   4  13.426   1.286  -8.209
   42   HH11  ARG   4          1HH1      ARG   4  11.949   0.279 -11.196
   43   HH12  ARG   4          2HH1      ARG   4  13.458   0.005 -12.001
   44   HH21  ARG   4          1HH2      ARG   4  15.419   0.928  -9.258
   45   HH22  ARG   4          2HH2      ARG   4  15.431   0.373 -10.897
   46    H    VAL   5           H        VAL   5   7.558   1.533  -7.975
   47    HA   VAL   5           HA       VAL   5   6.851  -0.968  -9.088
   48    HB   VAL   5           HB       VAL   5   5.616   0.275 -10.756
   49   HG11  VAL   5          1HG1      VAL   5   5.517   1.454  -7.989
   50   HG12  VAL   5          2HG1      VAL   5   4.324   1.818  -9.237
   51   HG13  VAL   5          3HG1      VAL   5   4.519   0.163  -8.657
   52   HG21  VAL   5          3HG2      VAL   5   5.769   2.748 -10.854
   53   HG22  VAL   5          1HG2      VAL   5   7.153   2.672  -9.764
   54   HG23  VAL   5          2HG2      VAL   5   7.250   1.939 -11.365
   55    H    TYR   6           H        TYR   6   7.578  -2.060 -10.836
   56    HA   TYR   6           HA       TYR   6   9.887  -0.910 -12.260
   57    HB2  TYR   6           2HB      TYR   6  10.037  -3.086 -10.747
   58    HB3  TYR   6           3HB      TYR   6   9.419  -3.857 -12.204
   59    HD1  TYR   6           HD2      TYR   6  10.727  -3.586 -14.357
   60    HD2  TYR   6           HD1      TYR   6  12.309  -2.502 -10.559
   61    HE1  TYR   6           HE2      TYR   6  13.001  -3.650 -15.292
   62    HE2  TYR   6           HE1      TYR   6  14.587  -2.561 -11.484
   63    HH   TYR   6           HH       TYR   6  15.786  -3.607 -13.359
   64    H    ARG   7           H        ARG   7  10.121  -1.414 -14.501
   65    HA   ARG   7           HA       ARG   7   7.728  -1.191 -15.974
   66    HB2  ARG   7           2HB      ARG   7  10.569  -1.791 -16.780
   67    HB3  ARG   7           3HB      ARG   7   9.266  -1.669 -17.955
   68    HG2  ARG   7           2HG      ARG   7  10.242   0.440 -17.965
   69    HG3  ARG   7           3HG      ARG   7   8.817   0.636 -16.942
   70    HD2  ARG   7           2HD      ARG   7  10.132   0.550 -14.960
   71    HD3  ARG   7           3HD      ARG   7  11.562   0.042 -15.858
   72    HE   ARG   7           HE       ARG   7  10.729   2.521 -16.851
   73   HH11  ARG   7          1HH1      ARG   7  12.068   1.139 -13.950
   74   HH12  ARG   7          2HH1      ARG   7  12.883   2.593 -13.477
   75   HH21  ARG   7          1HH2      ARG   7  11.797   4.441 -16.240
   76   HH22  ARG   7          2HH2      ARG   7  12.727   4.471 -14.780
   77    H    GLY   8           H        GLY   8   6.265  -2.766 -16.130
   78    HA2  GLY   8           2HA      GLY   8   6.125  -4.920 -17.556
   79    HA3  GLY   8           3HA      GLY   8   7.195  -5.551 -16.313
   80    H    ILE   9           H        ILE   9   5.735  -3.827 -14.297
   81    HA   ILE   9           HA       ILE   9   3.237  -5.372 -14.128
   82    HB   ILE   9           HB       ILE   9   4.848  -6.443 -12.648
   83   HG12  ILE   9          2HG1      ILE   9   3.577  -6.284 -10.543
   84   HG13  ILE   9          3HG1      ILE   9   2.805  -4.811 -11.122
   85   HG21  ILE   9          1HG2      ILE   9   5.037  -3.907 -11.057
   86   HG22  ILE   9          2HG2      ILE   9   6.043  -5.351 -10.961
   87   HG23  ILE   9          3HG2      ILE   9   6.177  -4.275 -12.352
   88   HD11  ILE   9          3HD1      ILE   9   1.427  -5.928 -12.540
   89   HD12  ILE   9          1HD1      ILE   9   2.569  -7.248 -12.792
   90   HD13  ILE   9          2HD1      ILE   9   1.635  -7.163 -11.298
   91    H    TYR  10           H        TYR  10   1.502  -4.158 -13.757
   92    HA   TYR  10           HA       TYR  10   1.780  -1.329 -13.347
   93    HB2  TYR  10           2HB      TYR  10  -0.731  -3.015 -13.402
   94    HB3  TYR  10           3HB      TYR  10  -0.649  -1.263 -13.547
   95    HD1  TYR  10           HD1      TYR  10  -0.064  -4.453 -15.254
   96    HD2  TYR  10           HD2      TYR  10   0.068  -0.215 -15.611
   97    HE1  TYR  10           HE1      TYR  10   0.136  -4.671 -17.695
   98    HE2  TYR  10           HE2      TYR  10   0.266  -0.422 -18.054
   99    HH   TYR  10           HH       TYR  10   0.663  -1.857 -19.754
  100    H    ARG  11           H        ARG  11   2.239  -0.556 -11.395
  101    HA   ARG  11           HA       ARG  11   0.503  -1.175  -9.171
  102    HB2  ARG  11           2HB      ARG  11   3.378  -2.019  -9.246
  103    HB3  ARG  11           3HB      ARG  11   2.648  -1.542  -7.719
  104    HG2  ARG  11           2HG      ARG  11   0.789  -3.256  -8.470
  105    HG3  ARG  11           3HG      ARG  11   2.125  -3.920  -9.414
  106    HD2  ARG  11           2HD      ARG  11   3.299  -4.556  -7.560
  107    HD3  ARG  11           3HD      ARG  11   2.624  -3.272  -6.559
  108    HE   ARG  11           HE       ARG  11   1.602  -5.921  -6.877
  109   HH11  ARG  11          1HH1      ARG  11   0.716  -2.617  -6.233
  110   HH12  ARG  11          2HH1      ARG  11  -0.726  -3.035  -5.367
  111   HH21  ARG  11          1HH2      ARG  11  -0.293  -6.485  -5.739
  112   HH22  ARG  11          2HH2      ARG  11  -1.298  -5.235  -5.087
  113    H    ARG  12           H        ARG  12   1.515   0.052  -7.125
  114    HA   ARG  12           HA       ARG  12   2.642   2.614  -7.999
  115    HB2  ARG  12           2HB      ARG  12   0.101   2.699  -7.828
  116    HB3  ARG  12           3HB      ARG  12   0.308   2.472  -6.097
  117    HG2  ARG  12           2HG      ARG  12   0.149   4.753  -6.241
  118    HG3  ARG  12           3HG      ARG  12   1.899   4.527  -6.303
  119    HD2  ARG  12           2HD      ARG  12   1.667   4.524  -8.826
  120    HD3  ARG  12           3HD      ARG  12   0.014   5.084  -8.580
  121    HE   ARG  12           HE       ARG  12   0.830   7.160  -8.066
  122   HH11  ARG  12          1HH1      ARG  12   3.427   4.845  -7.936
  123   HH12  ARG  12          2HH1      ARG  12   4.662   6.045  -7.746
  124   HH21  ARG  12          1HH2      ARG  12   2.447   8.750  -7.816
  125   HH22  ARG  12          2HH2      ARG  12   4.103   8.266  -7.676
  126    H    ARG  13           H        ARG  13   4.047   3.527  -6.583
  127    HA   ARG  13           HA       ARG  13   5.280   1.988  -4.631
  128    HB2  ARG  13           2HB      ARG  13   5.314   4.868  -5.368
  129    HB3  ARG  13           3HB      ARG  13   5.980   4.433  -3.800
  130    HG2  ARG  13           2HG      ARG  13   7.364   2.701  -5.079
  131    HG3  ARG  13           3HG      ARG  13   6.904   3.604  -6.524
  132    HD2  ARG  13           2HD      ARG  13   9.056   4.365  -5.700
  133    HD3  ARG  13           3HD      ARG  13   7.850   5.641  -5.537
  134    HE   ARG  13           HE       ARG  13   8.037   4.126  -3.150
  135   HH11  ARG  13          1HH1      ARG  13   9.700   6.559  -5.005
  136   HH12  ARG  13          2HH1      ARG  13  10.478   7.264  -3.626
  137   HH21  ARG  13          1HH2      ARG  13   9.055   5.046  -1.328
  138   HH22  ARG  13          2HH2      ARG  13  10.110   6.402  -1.535
  Start of MODEL   14
    1    H1   LYS   1           H        LYS   1   0.235  -0.062  -0.210
    2    HA   LYS   1           HA       LYS   1   1.472   1.133  -2.580
    3    HB2  LYS   1           2HB      LYS   1   3.193   2.224  -1.203
    4    HB3  LYS   1           3HB      LYS   1   1.588   2.859  -0.863
    5    HG2  LYS   1           2HG      LYS   1   1.476   1.420   1.136
    6    HG3  LYS   1           3HG      LYS   1   3.125   0.882   0.810
    7    HD2  LYS   1           2HD      LYS   1   3.887   3.225   0.983
    8    HD3  LYS   1           3HD      LYS   1   2.240   3.708   1.394
    9    HE2  LYS   1           2HE      LYS   1   3.303   3.514   3.462
   10    HE3  LYS   1           3HE      LYS   1   2.422   1.996   3.294
   11    HZ1  LYS   1           3HZ      LYS   1   5.102   2.289   3.806
   12    HZ2  LYS   1           1HZ      LYS   1   5.035   1.805   2.186
   13    HZ3  LYS   1           2HZ      LYS   1   4.307   0.857   3.383
   14    H    TRP   2           H        TRP   2   3.092  -0.057  -3.399
   15    HA   TRP   2           HA       TRP   2   4.128  -2.268  -1.748
   16    HB2  TRP   2           2HB      TRP   2   3.753  -3.757  -3.402
   17    HB3  TRP   2           3HB      TRP   2   2.626  -2.549  -4.014
   18    HD1  TRP   2           HD1      TRP   2   3.803  -0.761  -5.871
   19    HE1  TRP   2           HE1      TRP   2   5.434  -1.338  -7.777
   20    HE3  TRP   2           HE3      TRP   2   5.495  -5.270  -4.155
   21    HZ2  TRP   2           HZ2      TRP   2   7.203  -3.429  -8.463
   22    HZ3  TRP   2           HZ3      TRP   2   7.155  -6.495  -5.496
   23    HH2  TRP   2           HH2      TRP   2   7.990  -5.592  -7.605
   24    H    PHE   3           H        PHE   3   6.210  -3.180  -3.004
   25    HA   PHE   3           HA       PHE   3   8.253  -1.358  -2.579
   26    HB2  PHE   3           2HB      PHE   3   8.009  -4.047  -3.623
   27    HB3  PHE   3           3HB      PHE   3   9.249  -3.147  -4.489
   28    HD1  PHE   3           HD1      PHE   3  10.655  -1.583  -2.687
   29    HD2  PHE   3           HD2      PHE   3   8.843  -5.365  -1.955
   30    HE1  PHE   3           HE1      PHE   3  12.233  -1.979  -0.840
   31    HE2  PHE   3           HE2      PHE   3  10.417  -5.765  -0.107
   32    HZ   PHE   3           HZ       PHE   3  12.115  -4.071   0.453
   33    H    ARG   4           H        ARG   4   9.965  -1.019  -4.500
   34    HA   ARG   4           HA       ARG   4   8.993   1.055  -6.067
   35    HB2  ARG   4           2HB      ARG   4  11.444  -0.672  -6.273
   36    HB3  ARG   4           3HB      ARG   4  11.116   0.574  -7.470
   37    HG2  ARG   4           2HG      ARG   4  10.871   2.121  -5.389
   38    HG3  ARG   4           3HG      ARG   4  11.800   0.855  -4.582
   39    HD2  ARG   4           2HD      ARG   4  13.565   1.075  -6.247
   40    HD3  ARG   4           3HD      ARG   4  12.629   2.306  -7.094
   41    HE   ARG   4           HE       ARG   4  13.054   3.043  -4.389
   42   HH11  ARG   4          1HH1      ARG   4  14.657   2.821  -7.472
   43   HH12  ARG   4          2HH1      ARG   4  15.790   4.084  -7.120
   44   HH21  ARG   4          1HH2      ARG   4  14.540   4.707  -3.914
   45   HH22  ARG   4          2HH2      ARG   4  15.723   5.155  -5.096
   46    H    VAL   5           H        VAL   5   7.870   1.155  -7.900
   47    HA   VAL   5           HA       VAL   5   6.850  -1.184  -9.138
   48    HB   VAL   5           HB       VAL   5   5.774   0.293 -10.723
   49   HG11  VAL   5          1HG1      VAL   5   5.808   1.258  -7.876
   50   HG12  VAL   5          2HG1      VAL   5   4.704   1.916  -9.085
   51   HG13  VAL   5          3HG1      VAL   5   4.634   0.204  -8.664
   52   HG21  VAL   5          3HG2      VAL   5   6.306   2.853 -10.242
   53   HG22  VAL   5          1HG2      VAL   5   7.883   2.179  -9.832
   54   HG23  VAL   5          2HG2      VAL   5   7.202   1.917 -11.438
   55    H    TYR   6           H        TYR   6   7.397  -2.206 -11.004
   56    HA   TYR   6           HA       TYR   6   9.839  -1.264 -12.359
   57    HB2  TYR   6           2HB      TYR   6   9.792  -3.506 -10.973
   58    HB3  TYR   6           3HB      TYR   6   9.023  -4.141 -12.423
   59    HD1  TYR   6           HD2      TYR   6  11.889  -1.823 -11.767
   60    HD2  TYR   6           HD1      TYR   6  10.495  -5.330 -13.731
   61    HE1  TYR   6           HE2      TYR   6  14.100  -2.114 -12.804
   62    HE2  TYR   6           HE1      TYR   6  12.703  -5.632 -14.772
   63    HH   TYR   6           HH       TYR   6  15.112  -4.929 -14.216
   64    H    ARG   7           H        ARG   7  10.033  -1.908 -14.639
   65    HA   ARG   7           HA       ARG   7   7.665  -1.255 -16.078
   66    HB2  ARG   7           2HB      ARG   7  10.421  -2.129 -16.928
   67    HB3  ARG   7           3HB      ARG   7   9.137  -1.821 -18.090
   68    HG2  ARG   7           2HG      ARG   7  10.339   0.169 -18.020
   69    HG3  ARG   7           3HG      ARG   7   8.941   0.477 -16.988
   70    HD2  ARG   7           2HD      ARG   7  10.203   0.308 -15.029
   71    HD3  ARG   7           3HD      ARG   7  11.524  -0.527 -15.845
   72    HE   ARG   7           HE       ARG   7  11.124   2.114 -16.854
   73   HH11  ARG   7          1HH1      ARG   7  12.561   0.278 -14.269
   74   HH12  ARG   7          2HH1      ARG   7  13.768   1.470 -13.918
   75   HH21  ARG   7          1HH2      ARG   7  12.709   3.691 -16.402
   76   HH22  ARG   7          2HH2      ARG   7  13.851   3.411 -15.131
   77    H    GLY   8           H        GLY   8   6.035  -2.645 -16.304
   78    HA2  GLY   8           2HA      GLY   8   5.654  -4.708 -17.817
   79    HA3  GLY   8           3HA      GLY   8   6.644  -5.507 -16.604
   80    H    ILE   9           H        ILE   9   5.378  -3.704 -14.521
   81    HA   ILE   9           HA       ILE   9   2.720  -4.958 -14.409
   82    HB   ILE   9           HB       ILE   9   4.190  -6.283 -12.990
   83   HG12  ILE   9          2HG1      ILE   9   2.648  -4.657 -11.016
   84   HG13  ILE   9          3HG1      ILE   9   1.766  -5.445 -12.319
   85   HG21  ILE   9          1HG2      ILE   9   4.678  -3.867 -11.281
   86   HG22  ILE   9          2HG2      ILE   9   5.504  -5.424 -11.256
   87   HG23  ILE   9          3HG2      ILE   9   5.768  -4.307 -12.595
   88   HD11  ILE   9          3HD1      ILE   9   1.957  -6.698 -10.131
   89   HD12  ILE   9          1HD1      ILE   9   2.395  -7.582 -11.593
   90   HD13  ILE   9          2HD1      ILE   9   3.655  -6.942 -10.538
   91    H    TYR  10           H        TYR  10   1.142  -3.566 -13.971
   92    HA   TYR  10           HA       TYR  10   1.743  -0.813 -13.446
   93    HB2  TYR  10           2HB      TYR  10  -0.866  -2.316 -13.691
   94    HB3  TYR  10           3HB      TYR  10  -0.770  -0.579 -13.421
   95    HD1  TYR  10           HD1      TYR  10  -0.216  -3.284 -15.833
   96    HD2  TYR  10           HD2      TYR  10  -0.058   0.918 -15.187
   97    HE1  TYR  10           HE1      TYR  10  -0.031  -2.925 -18.259
   98    HE2  TYR  10           HE2      TYR  10   0.126   1.290 -17.611
   99    HH   TYR  10           HH       TYR  10  -0.077   0.316 -19.644
  100    H    ARG  11           H        ARG  11   2.319  -0.171 -11.478
  101    HA   ARG  11           HA       ARG  11   0.564  -0.673  -9.241
  102    HB2  ARG  11           2HB      ARG  11   3.339  -1.811  -9.381
  103    HB3  ARG  11           3HB      ARG  11   2.631  -1.369  -7.833
  104    HG2  ARG  11           2HG      ARG  11   0.698  -2.866  -8.405
  105    HG3  ARG  11           3HG      ARG  11   1.641  -3.426  -9.786
  106    HD2  ARG  11           2HD      ARG  11   3.193  -4.496  -8.465
  107    HD3  ARG  11           3HD      ARG  11   2.881  -3.455  -7.076
  108    HE   ARG  11           HE       ARG  11   1.627  -5.931  -7.650
  109   HH11  ARG  11          1HH1      ARG  11   1.006  -2.768  -6.336
  110   HH12  ARG  11          2HH1      ARG  11  -0.291  -3.302  -5.319
  111   HH21  ARG  11          1HH2      ARG  11  -0.079  -6.647  -6.316
  112   HH22  ARG  11          2HH2      ARG  11  -0.907  -5.509  -5.308
  113    H    ARG  12           H        ARG  12   1.737   0.349  -7.175
  114    HA   ARG  12           HA       ARG  12   3.155   2.788  -7.973
  115    HB2  ARG  12           2HB      ARG  12   0.564   3.032  -7.666
  116    HB3  ARG  12           3HB      ARG  12   0.954   2.976  -5.952
  117    HG2  ARG  12           2HG      ARG  12   2.529   4.876  -6.328
  118    HG3  ARG  12           3HG      ARG  12   1.906   4.986  -7.975
  119    HD2  ARG  12           2HD      ARG  12   0.237   5.209  -5.473
  120    HD3  ARG  12           3HD      ARG  12   0.827   6.576  -6.418
  121    HE   ARG  12           HE       ARG  12  -1.424   4.930  -7.009
  122   HH11  ARG  12          1HH1      ARG  12   1.128   6.805  -8.456
  123   HH12  ARG  12          2HH1      ARG  12   0.247   7.120  -9.914
  124   HH21  ARG  12          1HH2      ARG  12  -2.594   5.338  -8.924
  125   HH22  ARG  12          2HH2      ARG  12  -1.870   6.286 -10.179
  126    H    ARG  13           H        ARG  13   4.674   3.472  -6.546
  127    HA   ARG  13           HA       ARG  13   5.705   1.714  -4.649
  128    HB2  ARG  13           2HB      ARG  13   6.108   4.706  -4.632
  129    HB3  ARG  13           3HB      ARG  13   7.202   3.476  -4.014
  130    HG2  ARG  13           2HG      ARG  13   7.156   2.650  -6.510
  131    HG3  ARG  13           3HG      ARG  13   6.683   4.323  -6.814
  132    HD2  ARG  13           2HD      ARG  13   8.836   4.371  -4.982
  133    HD3  ARG  13           3HD      ARG  13   9.275   3.258  -6.276
  134    HE   ARG  13           HE       ARG  13   9.460   5.042  -7.693
  135   HH11  ARG  13          1HH1      ARG  13   7.658   6.014  -4.877
  136   HH12  ARG  13          2HH1      ARG  13   7.626   7.690  -5.316
  137   HH21  ARG  13          1HH2      ARG  13   9.424   7.246  -8.282
  138   HH22  ARG  13          2HH2      ARG  13   8.630   8.389  -7.253
  Start of MODEL   15
    1    H1   LYS   1           H        LYS   1   0.921   0.001   0.233
    2    HA   LYS   1           HA       LYS   1   1.303   0.465  -2.607
    3    HB2  LYS   1           2HB      LYS   1   2.576   2.140  -0.465
    4    HB3  LYS   1           3HB      LYS   1   3.409   1.860  -1.989
    5    HG2  LYS   1           2HG      LYS   1   1.897   3.089  -3.202
    6    HG3  LYS   1           3HG      LYS   1   0.597   2.842  -2.034
    7    HD2  LYS   1           2HD      LYS   1   3.002   4.367  -1.170
    8    HD3  LYS   1           3HD      LYS   1   1.848   5.161  -2.244
    9    HE2  LYS   1           2HE      LYS   1   0.948   5.730  -0.225
   10    HE3  LYS   1           3HE      LYS   1   0.109   4.205  -0.503
   11    HZ1  LYS   1           3HZ      LYS   1   1.267   3.164   1.121
   12    HZ2  LYS   1           1HZ      LYS   1   1.366   4.734   1.745
   13    HZ3  LYS   1           2HZ      LYS   1   2.670   4.080   0.888
   14    H    TRP   2           H        TRP   2   3.210  -0.485  -3.438
   15    HA   TRP   2           HA       TRP   2   4.457  -2.417  -1.597
   16    HB2  TRP   2           2HB      TRP   2   4.258  -4.034  -3.159
   17    HB3  TRP   2           3HB      TRP   2   3.050  -2.970  -3.874
   18    HD1  TRP   2           HD1      TRP   2   4.124  -1.207  -5.816
   19    HE1  TRP   2           HE1      TRP   2   5.852  -1.759  -7.642
   20    HE3  TRP   2           HE3      TRP   2   6.143  -5.435  -3.771
   21    HZ2  TRP   2           HZ2      TRP   2   7.811  -3.728  -8.149
   22    HZ3  TRP   2           HZ3      TRP   2   7.939  -6.593  -4.990
   23    HH2  TRP   2           HH2      TRP   2   8.754  -5.756  -7.134
   24    H    PHE   3           H        PHE   3   6.644  -3.222  -2.742
   25    HA   PHE   3           HA       PHE   3   8.512  -1.206  -2.389
   26    HB2  PHE   3           2HB      PHE   3   8.527  -3.968  -3.261
   27    HB3  PHE   3           3HB      PHE   3   9.711  -3.020  -4.156
   28    HD1  PHE   3           HD1      PHE   3  10.913  -1.221  -2.415
   29    HD2  PHE   3           HD2      PHE   3   9.437  -5.108  -1.504
   30    HE1  PHE   3           HE1      PHE   3  12.465  -1.360  -0.512
   31    HE2  PHE   3           HE2      PHE   3  10.986  -5.253   0.402
   32    HZ   PHE   3           HZ       PHE   3  12.502  -3.377   0.901
   33    H    ARG   4           H        ARG   4  10.243  -0.842  -4.288
   34    HA   ARG   4           HA       ARG   4   9.144   1.037  -6.009
   35    HB2  ARG   4           2HB      ARG   4  11.703  -0.532  -6.383
   36    HB3  ARG   4           3HB      ARG   4  11.292   0.968  -7.204
   37    HG2  ARG   4           2HG      ARG   4  11.070   1.924  -4.803
   38    HG3  ARG   4           3HG      ARG   4  12.035   0.518  -4.349
   39    HD2  ARG   4           2HD      ARG   4  12.843   2.435  -6.524
   40    HD3  ARG   4           3HD      ARG   4  13.319   2.639  -4.839
   41    HE   ARG   4           HE       ARG   4  14.434   0.813  -6.724
   42   HH11  ARG   4          1HH1      ARG   4  13.722   1.268  -3.347
   43   HH12  ARG   4          2HH1      ARG   4  14.977   0.203  -2.805
   44   HH21  ARG   4          1HH2      ARG   4  16.090  -0.590  -6.023
   45   HH22  ARG   4          2HH2      ARG   4  16.324  -0.852  -4.328
   46    H    VAL   5           H        VAL   5   8.056   0.920  -7.860
   47    HA   VAL   5           HA       VAL   5   7.280  -1.571  -8.969
   48    HB   VAL   5           HB       VAL   5   6.119  -0.297 -10.665
   49   HG11  VAL   5          1HG1      VAL   5   5.999   0.836  -7.885
   50   HG12  VAL   5          2HG1      VAL   5   4.877   1.332  -9.154
   51   HG13  VAL   5          3HG1      VAL   5   4.935  -0.353  -8.634
   52   HG21  VAL   5          3HG2      VAL   5   6.563   2.377 -10.074
   53   HG22  VAL   5          1HG2      VAL   5   8.174   1.659 -10.086
   54   HG23  VAL   5          2HG2      VAL   5   7.130   1.507 -11.499
   55    H    TYR   6           H        TYR   6   7.395  -1.708 -11.532
   56    HA   TYR   6           HA       TYR   6   9.940  -0.929 -12.640
   57    HB2  TYR   6           2HB      TYR   6   9.407  -3.725 -11.727
   58    HB3  TYR   6           3HB      TYR   6  10.345  -3.479 -13.196
   59    HD1  TYR   6           HD1      TYR   6  12.408  -1.955 -13.031
   60    HD2  TYR   6           HD2      TYR   6  10.438  -3.597  -9.636
   61    HE1  TYR   6           HE1      TYR   6  14.430  -1.577 -11.682
   62    HE2  TYR   6           HE2      TYR   6  12.454  -3.222  -8.278
   63    HH   TYR   6           HH       TYR   6  15.433  -1.965  -9.719
   64    H    ARG   7           H        ARG   7  10.186  -1.739 -14.903
   65    HA   ARG   7           HA       ARG   7   7.758  -1.326 -16.332
   66    HB2  ARG   7           2HB      ARG   7  10.451  -2.257 -17.345
   67    HB3  ARG   7           3HB      ARG   7   9.127  -1.669 -18.342
   68    HG2  ARG   7           2HG      ARG   7  10.577  -0.056 -16.253
   69    HG3  ARG   7           3HG      ARG   7  10.867   0.021 -17.992
   70    HD2  ARG   7           2HD      ARG   7   8.313   0.510 -18.118
   71    HD3  ARG   7           3HD      ARG   7   8.498   0.944 -16.419
   72    HE   ARG   7           HE       ARG   7  10.477   2.269 -17.883
   73   HH11  ARG   7          1HH1      ARG   7   7.014   2.252 -17.523
   74   HH12  ARG   7          2HH1      ARG   7   6.832   3.925 -17.936
   75   HH21  ARG   7          1HH2      ARG   7  10.251   4.472 -18.429
   76   HH22  ARG   7          2HH2      ARG   7   8.674   5.186 -18.452
   77    H    GLY   8           H        GLY   8   6.219  -2.828 -16.444
   78    HA2  GLY   8           2HA      GLY   8   5.944  -4.995 -17.825
   79    HA3  GLY   8           3HA      GLY   8   7.010  -5.658 -16.595
   80    H    ILE   9           H        ILE   9   5.685  -3.844 -14.571
   81    HA   ILE   9           HA       ILE   9   3.096  -5.215 -14.343
   82    HB   ILE   9           HB       ILE   9   4.661  -6.450 -12.941
   83   HG12  ILE   9          2HG1      ILE   9   3.473  -6.209 -10.775
   84   HG13  ILE   9          3HG1      ILE   9   2.760  -4.709 -11.355
   85   HG21  ILE   9          1HG2      ILE   9   5.088  -3.986 -11.286
   86   HG22  ILE   9          2HG2      ILE   9   5.986  -5.503 -11.267
   87   HG23  ILE   9          3HG2      ILE   9   6.158  -4.394 -12.627
   88   HD11  ILE   9          3HD1      ILE   9   2.371  -7.368 -12.699
   89   HD12  ILE   9          1HD1      ILE   9   1.276  -6.705 -11.486
   90   HD13  ILE   9          2HD1      ILE   9   1.512  -5.862 -13.018
   91    H    TYR  10           H        TYR  10   1.475  -3.882 -13.870
   92    HA   TYR  10           HA       TYR  10   2.003  -1.095 -13.394
   93    HB2  TYR  10           2HB      TYR  10  -0.525  -2.707 -13.711
   94    HB3  TYR  10           3HB      TYR  10  -0.553  -0.993 -13.310
   95    HD1  TYR  10           HD1      TYR  10   0.421  -3.449 -15.891
   96    HD2  TYR  10           HD2      TYR  10  -0.148   0.665 -14.970
   97    HE1  TYR  10           HE1      TYR  10   0.599  -2.895 -18.281
   98    HE2  TYR  10           HE2      TYR  10   0.027   1.230 -17.357
   99    HH   TYR  10           HH       TYR  10   0.733  -1.253 -19.786
  100    H    ARG  11           H        ARG  11   2.552  -0.420 -11.430
  101    HA   ARG  11           HA       ARG  11   0.813  -0.968  -9.191
  102    HB2  ARG  11           2HB      ARG  11   3.629  -2.006  -9.319
  103    HB3  ARG  11           3HB      ARG  11   2.898  -1.587  -7.776
  104    HG2  ARG  11           2HG      ARG  11   0.960  -3.138  -8.655
  105    HG3  ARG  11           3HG      ARG  11   2.263  -3.811  -9.638
  106    HD2  ARG  11           2HD      ARG  11   3.390  -4.634  -7.825
  107    HD3  ARG  11           3HD      ARG  11   2.764  -3.396  -6.738
  108    HE   ARG  11           HE       ARG  11   1.658  -5.967  -7.193
  109   HH11  ARG  11          1HH1      ARG  11   0.781  -2.656  -6.573
  110   HH12  ARG  11          2HH1      ARG  11  -0.725  -3.060  -5.817
  111   HH21  ARG  11          1HH2      ARG  11  -0.323  -6.512  -6.201
  112   HH22  ARG  11          2HH2      ARG  11  -1.351  -5.253  -5.606
  113    H    ARG  12           H        ARG  12   1.958   0.103  -7.130
  114    HA   ARG  12           HA       ARG  12   3.187   2.635  -7.983
  115    HB2  ARG  12           2HB      ARG  12   0.614   2.618  -7.367
  116    HB3  ARG  12           3HB      ARG  12   1.236   2.644  -5.723
  117    HG2  ARG  12           2HG      ARG  12   2.664   4.641  -6.582
  118    HG3  ARG  12           3HG      ARG  12   1.449   4.712  -7.860
  119    HD2  ARG  12           2HD      ARG  12   0.529   4.523  -5.037
  120    HD3  ARG  12           3HD      ARG  12   1.174   6.062  -5.605
  121    HE   ARG  12           HE       ARG  12  -0.754   5.039  -7.417
  122   HH11  ARG  12          1HH1      ARG  12  -0.427   6.610  -4.327
  123   HH12  ARG  12          2HH1      ARG  12  -1.982   7.368  -4.402
  124   HH21  ARG  12          1HH2      ARG  12  -2.804   6.032  -7.527
  125   HH22  ARG  12          2HH2      ARG  12  -3.334   7.039  -6.222
  126    H    ARG  13           H        ARG  13   4.919   3.218  -6.831
  127    HA   ARG  13           HA       ARG  13   5.684   1.557  -4.563
  128    HB2  ARG  13           2HB      ARG  13   7.890   2.435  -4.843
  129    HB3  ARG  13           3HB      ARG  13   7.273   2.043  -6.442
  130    HG2  ARG  13           2HG      ARG  13   6.784   4.382  -6.855
  131    HG3  ARG  13           3HG      ARG  13   7.326   4.798  -5.228
  132    HD2  ARG  13           2HD      ARG  13   9.540   3.659  -5.940
  133    HD3  ARG  13           3HD      ARG  13   8.932   3.877  -7.581
  134    HE   ARG  13           HE       ARG  13   8.810   6.292  -6.073
  135   HH11  ARG  13          1HH1      ARG  13  10.957   4.218  -7.865
  136   HH12  ARG  13          2HH1      ARG  13  12.057   5.492  -8.273
  137   HH21  ARG  13          1HH2      ARG  13  10.251   7.978  -6.605
  138   HH22  ARG  13          2HH2      ARG  13  11.656   7.630  -7.555
  Start of MODEL   16
    1    H1   LYS   1           H        LYS   1   0.148  -0.163  -0.445
    2    HA   LYS   1           HA       LYS   1   1.512   1.087  -2.727
    3    HB2  LYS   1           2HB      LYS   1   2.250   1.664   0.141
    4    HB3  LYS   1           3HB      LYS   1   2.866   2.450  -1.307
    5    HG2  LYS   1           2HG      LYS   1   0.701   3.461  -1.713
    6    HG3  LYS   1           3HG      LYS   1   0.027   2.621  -0.314
    7    HD2  LYS   1           2HD      LYS   1   0.492   4.700   0.572
    8    HD3  LYS   1           3HD      LYS   1   1.961   3.808   0.975
    9    HE2  LYS   1           2HE      LYS   1   3.039   4.730  -1.039
   10    HE3  LYS   1           3HE      LYS   1   1.579   5.658  -1.379
   11    HZ1  LYS   1           3HZ      LYS   1   2.624   7.237  -0.208
   12    HZ2  LYS   1           1HZ      LYS   1   3.669   6.149   0.558
   13    HZ3  LYS   1           2HZ      LYS   1   2.100   6.373   1.149
   14    H    TRP   2           H        TRP   2   3.095  -0.150  -3.476
   15    HA   TRP   2           HA       TRP   2   4.302  -2.130  -1.658
   16    HB2  TRP   2           2HB      TRP   2   4.102  -3.738  -3.231
   17    HB3  TRP   2           3HB      TRP   2   2.896  -2.667  -3.940
   18    HD1  TRP   2           HD1      TRP   2   3.974  -0.893  -5.870
   19    HE1  TRP   2           HE1      TRP   2   5.702  -1.436  -7.698
   20    HE3  TRP   2           HE3      TRP   2   5.985  -5.137  -3.850
   21    HZ2  TRP   2           HZ2      TRP   2   7.659  -3.404  -8.216
   22    HZ3  TRP   2           HZ3      TRP   2   7.780  -6.290  -5.075
   23    HH2  TRP   2           HH2      TRP   2   8.598  -5.440  -7.213
   24    H    PHE   3           H        PHE   3   6.489  -2.931  -2.806
   25    HA   PHE   3           HA       PHE   3   8.359  -0.921  -2.440
   26    HB2  PHE   3           2HB      PHE   3   8.371  -3.676  -3.329
   27    HB3  PHE   3           3HB      PHE   3   9.557  -2.724  -4.216
   28    HD1  PHE   3           HD1      PHE   3  10.767  -0.942  -2.470
   29    HD2  PHE   3           HD2      PHE   3   9.271  -4.825  -1.572
   30    HE1  PHE   3           HE1      PHE   3  12.317  -1.096  -0.566
   31    HE2  PHE   3           HE2      PHE   3  10.818  -4.984   0.334
   32    HZ   PHE   3           HZ       PHE   3  12.343  -3.118   0.840
   33    H    ARG   4           H        ARG   4  10.091  -0.547  -4.335
   34    HA   ARG   4           HA       ARG   4   8.997   1.345  -6.044
   35    HB2  ARG   4           2HB      ARG   4  11.450   0.973  -5.375
   36    HB3  ARG   4           3HB      ARG   4  11.508  -0.179  -6.703
   37    HG2  ARG   4           2HG      ARG   4  11.352   1.444  -8.304
   38    HG3  ARG   4           3HG      ARG   4  10.483   2.558  -7.246
   39    HD2  ARG   4           2HD      ARG   4  12.447   3.184  -6.117
   40    HD3  ARG   4           3HD      ARG   4  13.350   1.812  -6.756
   41    HE   ARG   4           HE       ARG   4  12.919   4.346  -8.032
   42   HH11  ARG   4          1HH1      ARG   4  13.578   0.967  -8.551
   43   HH12  ARG   4          2HH1      ARG   4  14.328   1.216 -10.093
   44   HH21  ARG   4          1HH2      ARG   4  13.904   4.686 -10.061
   45   HH22  ARG   4          2HH2      ARG   4  14.513   3.332 -10.951
   46    H    VAL   5           H        VAL   5   7.942   1.255  -7.920
   47    HA   VAL   5           HA       VAL   5   7.156  -1.235  -9.040
   48    HB   VAL   5           HB       VAL   5   5.995   0.053 -10.727
   49   HG11  VAL   5          1HG1      VAL   5   5.867   1.152  -7.935
   50   HG12  VAL   5          2HG1      VAL   5   4.749   1.665  -9.200
   51   HG13  VAL   5          3HG1      VAL   5   4.804  -0.027  -8.703
   52   HG21  VAL   5          3HG2      VAL   5   6.249   2.642 -10.484
   53   HG22  VAL   5          1HG2      VAL   5   7.831   2.227  -9.825
   54   HG23  VAL   5          2HG2      VAL   5   7.398   1.729 -11.461
   55    H    TYR   6           H        TYR   6   7.493  -1.912 -11.264
   56    HA   TYR   6           HA       TYR   6   9.969  -0.936 -12.493
   57    HB2  TYR   6           2HB      TYR   6  10.326  -3.016 -11.017
   58    HB3  TYR   6           3HB      TYR   6   9.435  -3.890 -12.258
   59    HD1  TYR   6           HD1      TYR   6  12.440  -1.776 -11.706
   60    HD2  TYR   6           HD2      TYR   6  10.514  -4.627 -14.208
   61    HE1  TYR   6           HE1      TYR   6  14.512  -2.024 -13.008
   62    HE2  TYR   6           HE2      TYR   6  12.581  -4.884 -15.516
   63    HH   TYR   6           HH       TYR   6  14.608  -3.809 -15.985
   64    H    ARG   7           H        ARG   7  10.245  -1.759 -14.734
   65    HA   ARG   7           HA       ARG   7   7.831  -1.404 -16.203
   66    HB2  ARG   7           2HB      ARG   7  10.653  -2.101 -16.993
   67    HB3  ARG   7           3HB      ARG   7   9.353  -2.014 -18.174
   68    HG2  ARG   7           2HG      ARG   7  10.362   0.077 -18.280
   69    HG3  ARG   7           3HG      ARG   7   8.938   0.342 -17.272
   70    HD2  ARG   7           2HD      ARG   7  10.230   0.376 -15.292
   71    HD3  ARG   7           3HD      ARG   7  11.647  -0.269 -16.120
   72    HE   ARG   7           HE       ARG   7  11.144   2.088 -17.390
   73   HH11  ARG   7          1HH1      ARG   7  11.671   1.155 -14.078
   74   HH12  ARG   7          2HH1      ARG   7  12.386   2.668 -13.629
   75   HH21  ARG   7          1HH2      ARG   7  12.084   4.084 -16.812
   76   HH22  ARG   7          2HH2      ARG   7  12.619   4.334 -15.185
   77    H    GLY   8           H        GLY   8   6.318  -2.927 -16.345
   78    HA2  GLY   8           2HA      GLY   8   6.108  -5.122 -17.691
   79    HA3  GLY   8           3HA      GLY   8   7.151  -5.748 -16.423
   80    H    ILE   9           H        ILE   9   5.700  -3.852 -14.516
   81    HA   ILE   9           HA       ILE   9   3.138  -5.268 -14.317
   82    HB   ILE   9           HB       ILE   9   4.672  -6.477 -12.858
   83   HG12  ILE   9          2HG1      ILE   9   3.427  -6.193 -10.715
   84   HG13  ILE   9          3HG1      ILE   9   2.695  -4.733 -11.372
   85   HG21  ILE   9          1HG2      ILE   9   5.033  -3.998 -11.212
   86   HG22  ILE   9          2HG2      ILE   9   5.948  -5.504 -11.164
   87   HG23  ILE   9          3HG2      ILE   9   6.140  -4.398 -12.524
   88   HD11  ILE   9          3HD1      ILE   9   1.389  -5.907 -12.866
   89   HD12  ILE   9          1HD1      ILE   9   2.435  -7.326 -12.827
   90   HD13  ILE   9          2HD1      ILE   9   1.394  -6.959 -11.451
   91    H    TYR  10           H        TYR  10   1.497  -3.940 -13.901
   92    HA   TYR  10           HA       TYR  10   1.989  -1.143 -13.463
   93    HB2  TYR  10           2HB      TYR  10  -0.615  -2.680 -13.573
   94    HB3  TYR  10           3HB      TYR  10  -0.465  -0.926 -13.583
   95    HD1  TYR  10           HD1      TYR  10   0.028  -3.999 -15.531
   96    HD2  TYR  10           HD2      TYR  10   0.245   0.250 -15.569
   97    HE1  TYR  10           HE1      TYR  10   0.209  -4.037 -17.983
   98    HE2  TYR  10           HE2      TYR  10   0.425   0.224 -18.022
   99    HH   TYR  10           HH       TYR  10   0.114  -1.091 -19.878
  100    H    ARG  11           H        ARG  11   2.501  -0.415 -11.510
  101    HA   ARG  11           HA       ARG  11   0.749  -0.948  -9.276
  102    HB2  ARG  11           2HB      ARG  11   3.589  -1.925  -9.353
  103    HB3  ARG  11           3HB      ARG  11   2.829  -1.493  -7.827
  104    HG2  ARG  11           2HG      ARG  11   0.937  -3.107  -8.744
  105    HG3  ARG  11           3HG      ARG  11   2.305  -3.783  -9.629
  106    HD2  ARG  11           2HD      ARG  11   3.349  -4.514  -7.731
  107    HD3  ARG  11           3HD      ARG  11   2.650  -3.243  -6.729
  108    HE   ARG  11           HE       ARG  11   1.574  -5.849  -7.200
  109   HH11  ARG  11          1HH1      ARG  11   0.746  -2.542  -6.493
  110   HH12  ARG  11          2HH1      ARG  11  -0.756  -2.944  -5.730
  111   HH21  ARG  11          1HH2      ARG  11  -0.402  -6.391  -6.198
  112   HH22  ARG  11          2HH2      ARG  11  -1.408  -5.134  -5.562
  113    H    ARG  12           H        ARG  12   1.839   0.195  -7.229
  114    HA   ARG  12           HA       ARG  12   3.161   2.670  -8.066
  115    HB2  ARG  12           2HB      ARG  12   0.841   3.283  -8.086
  116    HB3  ARG  12           3HB      ARG  12   0.567   2.507  -6.531
  117    HG2  ARG  12           2HG      ARG  12   1.628   4.198  -5.355
  118    HG3  ARG  12           3HG      ARG  12   2.507   4.768  -6.775
  119    HD2  ARG  12           2HD      ARG  12   0.884   6.203  -7.272
  120    HD3  ARG  12           3HD      ARG  12  -0.325   4.921  -7.229
  121    HE   ARG  12           HE       ARG  12   0.222   6.850  -5.180
  122   HH11  ARG  12          1HH1      ARG  12  -1.003   3.656  -5.826
  123   HH12  ARG  12          2HH1      ARG  12  -1.984   3.602  -4.399
  124   HH21  ARG  12          1HH2      ARG  12  -1.066   6.791  -3.299
  125   HH22  ARG  12          2HH2      ARG  12  -2.020   5.387  -2.963
  126    H    ARG  13           H        ARG  13   4.533   3.532  -6.566
  127    HA   ARG  13           HA       ARG  13   5.594   1.886  -4.584
  128    HB2  ARG  13           2HB      ARG  13   5.875   4.751  -5.323
  129    HB3  ARG  13           3HB      ARG  13   6.445   4.275  -3.729
  130    HG2  ARG  13           2HG      ARG  13   7.783   2.470  -4.892
  131    HG3  ARG  13           3HG      ARG  13   7.385   3.289  -6.404
  132    HD2  ARG  13           2HD      ARG  13   9.561   4.004  -5.581
  133    HD3  ARG  13           3HD      ARG  13   8.413   5.342  -5.560
  134    HE   ARG  13           HE       ARG  13   8.572   5.406  -3.271
  135   HH11  ARG  13          1HH1      ARG  13  10.002   2.461  -4.454
  136   HH12  ARG  13          2HH1      ARG  13  10.682   2.022  -2.922
  137   HH21  ARG  13          1HH2      ARG  13   9.462   4.839  -1.249
  138   HH22  ARG  13          2HH2      ARG  13  10.374   3.375  -1.099
  Start of MODEL   17
    1    H1   LYS   1           H        LYS   1   0.286   0.173  -0.657
    2    HA   LYS   1           HA       LYS   1   1.554   1.508  -2.851
    3    HB2  LYS   1           2HB      LYS   1   3.168   2.767  -1.349
    4    HB3  LYS   1           3HB      LYS   1   1.545   3.435  -1.475
    5    HG2  LYS   1           2HG      LYS   1   2.110   1.547   0.746
    6    HG3  LYS   1           3HG      LYS   1   2.771   3.181   0.844
    7    HD2  LYS   1           2HD      LYS   1   0.310   3.851   0.176
    8    HD3  LYS   1           3HD      LYS   1  -0.066   2.269   0.862
    9    HE2  LYS   1           2HE      LYS   1  -0.292   3.868   2.609
   10    HE3  LYS   1           3HE      LYS   1   1.190   2.965   2.916
   11    HZ1  LYS   1           3HZ      LYS   1   1.118   5.576   3.033
   12    HZ2  LYS   1           1HZ      LYS   1   1.400   5.438   1.371
   13    HZ3  LYS   1           2HZ      LYS   1   2.488   4.757   2.472
   14    H    TRP   2           H        TRP   2   3.226   0.312  -3.504
   15    HA   TRP   2           HA       TRP   2   4.414  -1.570  -1.571
   16    HB2  TRP   2           2HB      TRP   2   4.211  -3.275  -3.037
   17    HB3  TRP   2           3HB      TRP   2   3.004  -2.252  -3.811
   18    HD1  TRP   2           HD1      TRP   2   4.079  -0.605  -5.853
   19    HE1  TRP   2           HE1      TRP   2   5.805  -1.264  -7.645
   20    HE3  TRP   2           HE3      TRP   2   6.093  -4.711  -3.569
   21    HZ2  TRP   2           HZ2      TRP   2   7.760  -3.261  -8.039
   22    HZ3  TRP   2           HZ3      TRP   2   7.887  -5.940  -4.720
   23    HH2  TRP   2           HH2      TRP   2   8.701  -5.229  -6.909
   24    H    PHE   3           H        PHE   3   6.599  -2.443  -2.669
   25    HA   PHE   3           HA       PHE   3   8.470  -0.414  -2.435
   26    HB2  PHE   3           2HB      PHE   3   8.480  -3.220  -3.145
   27    HB3  PHE   3           3HB      PHE   3   9.664  -2.328  -4.094
   28    HD1  PHE   3           HD1      PHE   3  10.878  -0.438  -2.468
   29    HD2  PHE   3           HD2      PHE   3   9.382  -4.254  -1.320
   30    HE1  PHE   3           HE1      PHE   3  12.432  -0.470  -0.561
   31    HE2  PHE   3           HE2      PHE   3  10.933  -4.291   0.589
   32    HZ   PHE   3           HZ       PHE   3  12.460  -2.397   0.972
   33    H    ARG   4           H        ARG   4  10.199  -0.162  -4.353
   34    HA   ARG   4           HA       ARG   4   9.102   1.617  -6.178
   35    HB2  ARG   4           2HB      ARG   4  11.272   1.310  -7.439
   36    HB3  ARG   4           3HB      ARG   4  11.433   1.740  -5.742
   37    HG2  ARG   4           2HG      ARG   4  12.133  -0.407  -5.142
   38    HG3  ARG   4           3HG      ARG   4  11.548  -1.113  -6.651
   39    HD2  ARG   4           2HD      ARG   4  13.284   0.551  -7.716
   40    HD3  ARG   4           3HD      ARG   4  14.020   0.462  -6.116
   41    HE   ARG   4           HE       ARG   4  14.112  -1.526  -8.137
   42   HH11  ARG   4          1HH1      ARG   4  13.914  -1.100  -4.688
   43   HH12  ARG   4          2HH1      ARG   4  14.664  -2.619  -4.326
   44   HH21  ARG   4          1HH2      ARG   4  15.101  -3.528  -7.674
   45   HH22  ARG   4          2HH2      ARG   4  15.340  -3.999  -6.025
   46    H    VAL   5           H        VAL   5   8.049   1.408  -8.046
   47    HA   VAL   5           HA       VAL   5   7.231  -1.133  -8.997
   48    HB   VAL   5           HB       VAL   5   6.123   0.049 -10.792
   49   HG11  VAL   5          1HG1      VAL   5   5.991   1.449  -8.129
   50   HG12  VAL   5          2HG1      VAL   5   4.850   1.743  -9.442
   51   HG13  VAL   5          3HG1      VAL   5   4.965   0.140  -8.715
   52   HG21  VAL   5          3HG2      VAL   5   6.525   2.712 -10.534
   53   HG22  VAL   5          1HG2      VAL   5   8.141   2.100 -10.180
   54   HG23  VAL   5          2HG2      VAL   5   7.360   1.696 -11.708
   55    H    TYR   6           H        TYR   6   7.371  -1.419 -11.557
   56    HA   TYR   6           HA       TYR   6   9.951  -0.786 -12.670
   57    HB2  TYR   6           2HB      TYR   6  10.159  -2.867 -11.091
   58    HB3  TYR   6           3HB      TYR   6   9.391  -3.720 -12.424
   59    HD1  TYR   6           HD1      TYR   6  12.394  -1.879 -11.366
   60    HD2  TYR   6           HD2      TYR   6  10.579  -4.155 -14.469
   61    HE1  TYR   6           HE1      TYR   6  14.579  -2.102 -12.473
   62    HE2  TYR   6           HE2      TYR   6  12.759  -4.386 -15.583
   63    HH   TYR   6           HH       TYR   6  15.115  -4.276 -15.060
   64    H    ARG   7           H        ARG   7  10.188  -1.605 -14.886
   65    HA   ARG   7           HA       ARG   7   7.756  -1.318 -16.339
   66    HB2  ARG   7           2HB      ARG   7  10.580  -1.984 -17.150
   67    HB3  ARG   7           3HB      ARG   7   9.265  -1.917 -18.316
   68    HG2  ARG   7           2HG      ARG   7  10.257   0.183 -18.445
   69    HG3  ARG   7           3HG      ARG   7   8.839   0.441 -17.427
   70    HD2  ARG   7           2HD      ARG   7  10.123   0.572 -15.474
   71    HD3  ARG   7           3HD      ARG   7  11.523  -0.178 -16.240
   72    HE   ARG   7           HE       ARG   7  10.795   2.324 -17.433
   73   HH11  ARG   7          1HH1      ARG   7  12.548   0.821 -14.828
   74   HH12  ARG   7          2HH1      ARG   7  13.640   2.151 -14.622
   75   HH21  ARG   7          1HH2      ARG   7  12.227   4.080 -17.173
   76   HH22  ARG   7          2HH2      ARG   7  13.456   4.004 -15.956
   77    H    GLY   8           H        GLY   8   6.271  -2.875 -16.426
   78    HA2  GLY   8           2HA      GLY   8   6.074  -5.087 -17.739
   79    HA3  GLY   8           3HA      GLY   8   7.164  -5.679 -16.494
   80    H    ILE   9           H        ILE   9   5.804  -3.899 -14.490
   81    HA   ILE   9           HA       ILE   9   3.261  -5.353 -14.228
   82    HB   ILE   9           HB       ILE   9   4.877  -6.472 -12.789
   83   HG12  ILE   9          2HG1      ILE   9   3.690  -6.184 -10.616
   84   HG13  ILE   9          3HG1      ILE   9   2.890  -4.762 -11.277
   85   HG21  ILE   9          1HG2      ILE   9   5.204  -3.935 -11.222
   86   HG22  ILE   9          2HG2      ILE   9   6.161  -5.414 -11.147
   87   HG23  ILE   9          3HG2      ILE   9   6.290  -4.351 -12.548
   88   HD11  ILE   9          3HD1      ILE   9   1.756  -7.144 -11.276
   89   HD12  ILE   9          1HD1      ILE   9   1.494  -5.986 -12.579
   90   HD13  ILE   9          2HD1      ILE   9   2.653  -7.299 -12.786
   91    H    TYR  10           H        TYR  10   1.585  -4.074 -13.808
   92    HA   TYR  10           HA       TYR  10   1.977  -1.254 -13.441
   93    HB2  TYR  10           2HB      TYR  10  -0.476  -2.998 -13.625
   94    HB3  TYR  10           3HB      TYR  10  -0.575  -1.269 -13.314
   95    HD1  TYR  10           HD1      TYR  10   0.753  -3.743 -15.758
   96    HD2  TYR  10           HD2      TYR  10  -0.572   0.245 -15.093
   97    HE1  TYR  10           HE1      TYR  10   0.860  -3.310 -18.177
   98    HE2  TYR  10           HE2      TYR  10  -0.470   0.688 -17.510
   99    HH   TYR  10           HH       TYR  10  -0.630  -0.952 -19.690
  100    H    ARG  11           H        ARG  11   2.532  -0.469 -11.520
  101    HA   ARG  11           HA       ARG  11   0.872  -1.036  -9.217
  102    HB2  ARG  11           2HB      ARG  11   3.763  -1.839  -9.372
  103    HB3  ARG  11           3HB      ARG  11   3.030  -1.415  -7.830
  104    HG2  ARG  11           2HG      ARG  11   1.212  -3.163  -8.626
  105    HG3  ARG  11           3HG      ARG  11   2.575  -3.774  -9.567
  106    HD2  ARG  11           2HD      ARG  11   3.754  -4.399  -7.709
  107    HD3  ARG  11           3HD      ARG  11   3.021  -3.158  -6.695
  108    HE   ARG  11           HE       ARG  11   2.089  -5.834  -7.089
  109   HH11  ARG  11          1HH1      ARG  11   1.111  -2.577  -6.343
  110   HH12  ARG  11          2HH1      ARG  11  -0.318  -3.062  -5.492
  111   HH21  ARG  11          1HH2      ARG  11   0.210  -6.485  -5.971
  112   HH22  ARG  11          2HH2      ARG  11  -0.829  -5.286  -5.280
  113    H    ARG  12           H        ARG  12   1.950   0.226  -7.238
  114    HA   ARG  12           HA       ARG  12   3.095   2.752  -8.175
  115    HB2  ARG  12           2HB      ARG  12   0.531   2.840  -7.992
  116    HB3  ARG  12           3HB      ARG  12   0.779   2.744  -6.253
  117    HG2  ARG  12           2HG      ARG  12   2.076   4.793  -6.299
  118    HG3  ARG  12           3HG      ARG  12   1.906   4.878  -8.053
  119    HD2  ARG  12           2HD      ARG  12   0.310   6.365  -7.046
  120    HD3  ARG  12           3HD      ARG  12  -0.552   5.002  -7.760
  121    HE   ARG  12           HE       ARG  12  -0.189   4.249  -5.179
  122   HH11  ARG  12          1HH1      ARG  12  -1.542   7.069  -6.706
  123   HH12  ARG  12          2HH1      ARG  12  -2.665   7.385  -5.425
  124   HH21  ARG  12          1HH2      ARG  12  -1.662   4.654  -3.485
  125   HH22  ARG  12          2HH2      ARG  12  -2.731   6.011  -3.593
  126    H    ARG  13           H        ARG  13   4.462   3.725  -6.744
  127    HA   ARG  13           HA       ARG  13   5.697   2.213  -4.770
  128    HB2  ARG  13           2HB      ARG  13   5.606   5.222  -5.056
  129    HB3  ARG  13           3HB      ARG  13   6.738   4.341  -4.038
  130    HG2  ARG  13           2HG      ARG  13   7.372   3.122  -6.238
  131    HG3  ARG  13           3HG      ARG  13   6.611   4.513  -7.014
  132    HD2  ARG  13           2HD      ARG  13   8.203   5.680  -5.107
  133    HD3  ARG  13           3HD      ARG  13   9.172   4.301  -5.626
  134    HE   ARG  13           HE       ARG  13   9.535   5.365  -7.613
  135   HH11  ARG  13          1HH1      ARG  13   6.784   6.816  -6.049
  136   HH12  ARG  13          2HH1      ARG  13   6.632   8.092  -7.211
  137   HH21  ARG  13          1HH2      ARG  13   9.345   7.040  -9.149
  138   HH22  ARG  13          2HH2      ARG  13   8.089   8.218  -8.975
  Start of MODEL   18
    1    H1   LYS   1           H        LYS   1   0.665   0.182   0.131
    2    HA   LYS   1           HA       LYS   1   1.278   0.732  -2.691
    3    HB2  LYS   1           2HB      LYS   1   3.057   2.265  -2.032
    4    HB3  LYS   1           3HB      LYS   1   1.505   2.825  -1.423
    5    HG2  LYS   1           2HG      LYS   1   2.085   1.802   0.777
    6    HG3  LYS   1           3HG      LYS   1   3.694   1.470   0.134
    7    HD2  LYS   1           2HD      LYS   1   2.600   4.241  -0.036
    8    HD3  LYS   1           3HD      LYS   1   3.225   3.656   1.507
    9    HE2  LYS   1           2HE      LYS   1   4.868   3.275  -0.949
   10    HE3  LYS   1           3HE      LYS   1   4.786   4.880  -0.224
   11    HZ1  LYS   1           3HZ      LYS   1   5.860   2.389   0.934
   12    HZ2  LYS   1           1HZ      LYS   1   5.368   3.662   1.933
   13    HZ3  LYS   1           2HZ      LYS   1   6.601   3.904   0.801
   14    H    TRP   2           H        TRP   2   3.100  -0.258  -3.505
   15    HA   TRP   2           HA       TRP   2   4.397  -2.198  -1.705
   16    HB2  TRP   2           2HB      TRP   2   4.182  -3.814  -3.268
   17    HB3  TRP   2           3HB      TRP   2   2.943  -2.763  -3.951
   18    HD1  TRP   2           HD1      TRP   2   3.948  -0.981  -5.912
   19    HE1  TRP   2           HE1      TRP   2   5.639  -1.505  -7.780
   20    HE3  TRP   2           HE3      TRP   2   6.069  -5.188  -3.929
   21    HZ2  TRP   2           HZ2      TRP   2   7.610  -3.446  -8.339
   22    HZ3  TRP   2           HZ3      TRP   2   7.850  -6.319  -5.194
   23    HH2  TRP   2           HH2      TRP   2   8.604  -5.465  -7.354
   24    H    PHE   3           H        PHE   3   6.566  -2.972  -2.905
   25    HA   PHE   3           HA       PHE   3   8.415  -0.933  -2.590
   26    HB2  PHE   3           2HB      PHE   3   8.446  -3.691  -3.470
   27    HB3  PHE   3           3HB      PHE   3   9.595  -2.725  -4.390
   28    HD1  PHE   3           HD1      PHE   3  10.821  -0.919  -2.679
   29    HD2  PHE   3           HD2      PHE   3   9.406  -4.821  -1.734
   30    HE1  PHE   3           HE1      PHE   3  12.420  -1.044  -0.814
   31    HE2  PHE   3           HE2      PHE   3  11.002  -4.951   0.134
   32    HZ   PHE   3           HZ       PHE   3  12.511  -3.061   0.597
   33    H    ARG   4           H        ARG   4  10.096  -0.541  -4.528
   34    HA   ARG   4           HA       ARG   4   8.932   1.329  -6.217
   35    HB2  ARG   4           2HB      ARG   4  11.554  -0.091  -6.164
   36    HB3  ARG   4           3HB      ARG   4  11.132   0.816  -7.611
   37    HG2  ARG   4           2HG      ARG   4  12.476   2.129  -6.040
   38    HG3  ARG   4           3HG      ARG   4  10.884   2.840  -6.315
   39    HD2  ARG   4           2HD      ARG   4  10.118   2.258  -4.208
   40    HD3  ARG   4           3HD      ARG   4  11.314   0.976  -4.018
   41    HE   ARG   4           HE       ARG   4  12.543   3.537  -4.176
   42   HH11  ARG   4          1HH1      ARG   4  10.809   1.409  -2.035
   43   HH12  ARG   4          2HH1      ARG   4  11.506   2.077  -0.596
   44   HH21  ARG   4          1HH2      ARG   4  13.467   4.425  -2.289
   45   HH22  ARG   4          2HH2      ARG   4  13.016   3.793  -0.742
   46    H    VAL   5           H        VAL   5   7.839   1.218  -8.070
   47    HA   VAL   5           HA       VAL   5   7.046  -1.279  -9.158
   48    HB   VAL   5           HB       VAL   5   5.855  -0.011 -10.837
   49   HG11  VAL   5          1HG1      VAL   5   5.774   1.171  -8.072
   50   HG12  VAL   5          2HG1      VAL   5   4.605   1.584  -9.328
   51   HG13  VAL   5          3HG1      VAL   5   4.734  -0.079  -8.754
   52   HG21  VAL   5          3HG2      VAL   5   7.269   1.649 -11.605
   53   HG22  VAL   5          1HG2      VAL   5   6.104   2.572 -10.656
   54   HG23  VAL   5          2HG2      VAL   5   7.687   2.190  -9.979
   55    H    TYR   6           H        TYR   6   7.357  -1.994 -11.368
   56    HA   TYR   6           HA       TYR   6   9.839  -1.047 -12.618
   57    HB2  TYR   6           2HB      TYR   6  10.141  -3.161 -11.192
   58    HB3  TYR   6           3HB      TYR   6   9.192  -3.983 -12.425
   59    HD1  TYR   6           HD1      TYR   6  12.314  -2.066 -11.857
   60    HD2  TYR   6           HD2      TYR   6  10.179  -4.672 -14.456
   61    HE1  TYR   6           HE1      TYR   6  14.348  -2.382 -13.201
   62    HE2  TYR   6           HE2      TYR   6  12.208  -4.996 -15.807
   63    HH   TYR   6           HH       TYR   6  14.908  -4.754 -15.161
   64    H    ARG   7           H        ARG   7  10.079  -1.873 -14.876
   65    HA   ARG   7           HA       ARG   7   7.661  -1.399 -16.320
   66    HB2  ARG   7           2HB      ARG   7  10.460  -2.141 -17.155
   67    HB3  ARG   7           3HB      ARG   7   9.152  -1.973 -18.318
   68    HG2  ARG   7           2HG      ARG   7  10.231   0.089 -18.356
   69    HG3  ARG   7           3HG      ARG   7   8.817   0.360 -17.335
   70    HD2  ARG   7           2HD      ARG   7  10.066   0.497 -15.408
   71    HD3  ARG   7           3HD      ARG   7  11.380  -0.478 -16.066
   72    HE   ARG   7           HE       ARG   7  11.492   1.744 -17.577
   73   HH11  ARG   7          1HH1      ARG   7  11.344   1.244 -14.135
   74   HH12  ARG   7          2HH1      ARG   7  12.240   2.678 -13.756
   75   HH21  ARG   7          1HH2      ARG   7  12.673   3.635 -17.092
   76   HH22  ARG   7          2HH2      ARG   7  12.994   4.038 -15.439
   77    H    GLY   8           H        GLY   8   6.117  -2.892 -16.473
   78    HA2  GLY   8           2HA      GLY   8   5.846  -5.041 -17.880
   79    HA3  GLY   8           3HA      GLY   8   6.898  -5.724 -16.649
   80    H    ILE   9           H        ILE   9   5.571  -3.941 -14.607
   81    HA   ILE   9           HA       ILE   9   2.987  -5.335 -14.409
   82    HB   ILE   9           HB       ILE   9   4.553  -6.514 -12.964
   83   HG12  ILE   9          2HG1      ILE   9   3.343  -6.233 -10.806
   84   HG13  ILE   9          3HG1      ILE   9   2.593  -4.776 -11.449
   85   HG21  ILE   9          1HG2      ILE   9   4.922  -4.006 -11.360
   86   HG22  ILE   9          2HG2      ILE   9   5.837  -5.511 -11.287
   87   HG23  ILE   9          3HG2      ILE   9   6.018  -4.436 -12.674
   88   HD11  ILE   9          3HD1      ILE   9   2.314  -7.397 -12.859
   89   HD12  ILE   9          1HD1      ILE   9   1.272  -6.970 -11.503
   90   HD13  ILE   9          2HD1      ILE   9   1.289  -5.965 -12.952
   91    H    TYR  10           H        TYR  10   1.335  -4.021 -14.003
   92    HA   TYR  10           HA       TYR  10   1.778  -1.219 -13.595
   93    HB2  TYR  10           2HB      TYR  10  -0.611  -2.966 -14.004
   94    HB3  TYR  10           3HB      TYR  10  -0.851  -1.353 -13.343
   95    HD1  TYR  10           HD1      TYR  10   0.221  -3.270 -16.284
   96    HD2  TYR  10           HD2      TYR  10  -0.501   0.613 -14.703
   97    HE1  TYR  10           HE1      TYR  10   0.301  -2.336 -18.558
   98    HE2  TYR  10           HE2      TYR  10  -0.424   1.558 -16.973
   99    HH   TYR  10           HH       TYR  10   0.784  -0.108 -19.617
  100    H    ARG  11           H        ARG  11   2.346  -0.467 -11.663
  101    HA   ARG  11           HA       ARG  11   0.656  -0.975  -9.379
  102    HB2  ARG  11           2HB      ARG  11   3.484  -1.973  -9.524
  103    HB3  ARG  11           3HB      ARG  11   2.784  -1.499  -7.982
  104    HG2  ARG  11           2HG      ARG  11   0.849  -3.110  -8.736
  105    HG3  ARG  11           3HG      ARG  11   2.125  -3.803  -9.740
  106    HD2  ARG  11           2HD      ARG  11   3.335  -4.533  -7.936
  107    HD3  ARG  11           3HD      ARG  11   2.706  -3.277  -6.870
  108    HE   ARG  11           HE       ARG  11   1.614  -5.885  -7.286
  109   HH11  ARG  11          1HH1      ARG  11   0.821  -2.591  -6.485
  110   HH12  ARG  11          2HH1      ARG  11  -0.618  -3.012  -5.616
  111   HH21  ARG  11          1HH2      ARG  11  -0.278  -6.451  -6.144
  112   HH22  ARG  11          2HH2      ARG  11  -1.241  -5.208  -5.422
  113    H    ARG  12           H        ARG  12   1.814   0.186  -7.373
  114    HA   ARG  12           HA       ARG  12   3.045   2.681  -8.306
  115    HB2  ARG  12           2HB      ARG  12   0.665   3.146  -8.074
  116    HB3  ARG  12           3HB      ARG  12   0.671   2.483  -6.446
  117    HG2  ARG  12           2HG      ARG  12   1.939   4.283  -5.608
  118    HG3  ARG  12           3HG      ARG  12   2.352   4.844  -7.229
  119    HD2  ARG  12           2HD      ARG  12   0.686   6.320  -6.521
  120    HD3  ARG  12           3HD      ARG  12  -0.166   5.171  -7.552
  121    HE   ARG  12           HE       ARG  12  -1.345   4.451  -5.724
  122   HH11  ARG  12          1HH1      ARG  12   1.377   6.346  -4.666
  123   HH12  ARG  12          2HH1      ARG  12   0.865   6.396  -3.012
  124   HH21  ARG  12          1HH2      ARG  12  -2.030   4.510  -3.549
  125   HH22  ARG  12          2HH2      ARG  12  -1.072   5.351  -2.377
  126    H    ARG  13           H        ARG  13   4.775   3.222  -7.148
  127    HA   ARG  13           HA       ARG  13   5.449   1.682  -4.795
  128    HB2  ARG  13           2HB      ARG  13   7.618   2.679  -4.956
  129    HB3  ARG  13           3HB      ARG  13   7.108   2.254  -6.584
  130    HG2  ARG  13           2HG      ARG  13   6.568   4.541  -7.074
  131    HG3  ARG  13           3HG      ARG  13   6.885   5.012  -5.403
  132    HD2  ARG  13           2HD      ARG  13   8.882   5.596  -6.325
  133    HD3  ARG  13           3HD      ARG  13   9.238   3.914  -5.936
  134    HE   ARG  13           HE       ARG  13   9.378   3.471  -8.173
  135   HH11  ARG  13          1HH1      ARG  13   7.712   6.495  -7.723
  136   HH12  ARG  13          2HH1      ARG  13   7.672   6.873  -9.413
  137   HH21  ARG  13          1HH2      ARG  13   9.331   3.958 -10.401
  138   HH22  ARG  13          2HH2      ARG  13   8.592   5.429 -10.936
  Start of MODEL   19
    1    H1   LYS   1           H        LYS   1  -0.378   0.257  -0.488
    2    HA   LYS   1           HA       LYS   1   0.863   1.162  -2.970
    3    HB2  LYS   1           2HB      LYS   1   2.374   2.668  -1.924
    4    HB3  LYS   1           3HB      LYS   1   0.769   3.095  -1.345
    5    HG2  LYS   1           2HG      LYS   1   1.844   3.133   0.637
    6    HG3  LYS   1           3HG      LYS   1   1.470   1.408   0.597
    7    HD2  LYS   1           2HD      LYS   1   3.698   1.277   1.053
    8    HD3  LYS   1           3HD      LYS   1   3.784   1.333  -0.709
    9    HE2  LYS   1           2HE      LYS   1   3.807   3.885   0.834
   10    HE3  LYS   1           3HE      LYS   1   5.276   2.913   0.763
   11    HZ1  LYS   1           3HZ      LYS   1   4.350   3.033  -1.823
   12    HZ2  LYS   1           1HZ      LYS   1   5.672   3.871  -1.181
   13    HZ3  LYS   1           2HZ      LYS   1   4.147   4.601  -1.222
   14    H    TRP   2           H        TRP   2   2.750   0.118  -3.468
   15    HA   TRP   2           HA       TRP   2   3.715  -1.860  -1.509
   16    HB2  TRP   2           2HB      TRP   2   3.567  -3.545  -3.004
   17    HB3  TRP   2           3HB      TRP   2   2.436  -2.486  -3.842
   18    HD1  TRP   2           HD1      TRP   2   3.679  -0.847  -5.793
   19    HE1  TRP   2           HE1      TRP   2   5.500  -1.531  -7.478
   20    HE3  TRP   2           HE3      TRP   2   5.444  -5.023  -3.430
   21    HZ2  TRP   2           HZ2      TRP   2   7.429  -3.572  -7.768
   22    HZ3  TRP   2           HZ3      TRP   2   7.278  -6.284  -4.478
   23    HH2  TRP   2           HH2      TRP   2   8.248  -5.573  -6.602
   24    H    PHE   3           H        PHE   3   5.945  -2.776  -2.475
   25    HA   PHE   3           HA       PHE   3   7.844  -0.795  -2.099
   26    HB2  PHE   3           2HB      PHE   3   7.834  -3.594  -2.838
   27    HB3  PHE   3           3HB      PHE   3   9.097  -2.722  -3.700
   28    HD1  PHE   3           HD1      PHE   3  10.249  -0.877  -1.980
   29    HD2  PHE   3           HD2      PHE   3   8.593  -4.666  -0.970
   30    HE1  PHE   3           HE1      PHE   3  11.677  -0.964   0.022
   31    HE2  PHE   3           HE2      PHE   3  10.017  -4.758   1.034
   32    HZ   PHE   3           HZ       PHE   3  11.561  -2.905   1.533
   33    H    ARG   4           H        ARG   4   9.699  -0.567  -3.900
   34    HA   ARG   4           HA       ARG   4   8.763   1.254  -5.772
   35    HB2  ARG   4           2HB      ARG   4  11.151   0.907  -4.945
   36    HB3  ARG   4           3HB      ARG   4  11.272  -0.374  -6.143
   37    HG2  ARG   4           2HG      ARG   4  11.276   1.078  -7.904
   38    HG3  ARG   4           3HG      ARG   4  10.351   2.305  -7.036
   39    HD2  ARG   4           2HD      ARG   4  12.271   2.917  -5.735
   40    HD3  ARG   4           3HD      ARG   4  13.201   1.570  -6.391
   41    HE   ARG   4           HE       ARG   4  12.828   4.127  -7.583
   42   HH11  ARG   4          1HH1      ARG   4  13.226   0.745  -8.310
   43   HH12  ARG   4          2HH1      ARG   4  13.910   1.029  -9.876
   44   HH21  ARG   4          1HH2      ARG   4  13.728   4.513  -9.643
   45   HH22  ARG   4          2HH2      ARG   4  14.196   3.172 -10.633
   46    H    VAL   5           H        VAL   5   7.825   1.087  -7.704
   47    HA   VAL   5           HA       VAL   5   7.013  -1.425  -8.734
   48    HB   VAL   5           HB       VAL   5   6.047  -0.200 -10.581
   49   HG11  VAL   5          1HG1      VAL   5   5.779   1.176  -7.917
   50   HG12  VAL   5          2HG1      VAL   5   4.731   1.511  -9.296
   51   HG13  VAL   5          3HG1      VAL   5   4.762  -0.102  -8.582
   52   HG21  VAL   5          3HG2      VAL   5   7.928   1.940  -9.688
   53   HG22  VAL   5          1HG2      VAL   5   7.586   1.350 -11.314
   54   HG23  VAL   5          2HG2      VAL   5   6.421   2.385 -10.489
   55    H    TYR   6           H        TYR   6   7.307  -1.676 -11.289
   56    HA   TYR   6           HA       TYR   6   9.967  -1.096 -12.228
   57    HB2  TYR   6           2HB      TYR   6  10.103  -3.160 -10.671
   58    HB3  TYR   6           3HB      TYR   6   9.291  -4.015 -11.977
   59    HD1  TYR   6           HD1      TYR   6  12.261  -1.845 -11.345
   60    HD2  TYR   6           HD2      TYR   6  10.564  -4.990 -13.653
   61    HE1  TYR   6           HE1      TYR   6  14.428  -2.192 -12.454
   62    HE2  TYR   6           HE2      TYR   6  12.727  -5.347 -14.769
   63    HH   TYR   6           HH       TYR   6  15.276  -4.841 -14.045
   64    H    ARG   7           H        ARG   7  10.334  -1.975 -14.427
   65    HA   ARG   7           HA       ARG   7   8.022  -1.572 -16.042
   66    HB2  ARG   7           2HB      ARG   7  10.859  -2.377 -16.655
   67    HB3  ARG   7           3HB      ARG   7   9.632  -2.263 -17.909
   68    HG2  ARG   7           2HG      ARG   7  10.734  -0.212 -17.981
   69    HG3  ARG   7           3HG      ARG   7   9.254   0.120 -17.078
   70    HD2  ARG   7           2HD      ARG   7  10.367   0.354 -15.078
   71    HD3  ARG   7           3HD      ARG   7  11.714  -0.663 -15.588
   72    HE   ARG   7           HE       ARG   7  12.765   1.213 -16.339
   73   HH11  ARG   7          1HH1      ARG   7   9.354   1.871 -16.116
   74   HH12  ARG   7          2HH1      ARG   7   9.518   3.548 -16.519
   75   HH21  ARG   7          1HH2      ARG   7  12.995   3.420 -16.870
   76   HH22  ARG   7          2HH2      ARG   7  11.589   4.428 -16.948
   77    H    GLY   8           H        GLY   8   6.471  -3.052 -16.231
   78    HA2  GLY   8           2HA      GLY   8   6.246  -5.258 -17.544
   79    HA3  GLY   8           3HA      GLY   8   7.227  -5.897 -16.234
   80    H    ILE   9           H        ILE   9   5.766  -3.946 -14.395
   81    HA   ILE   9           HA       ILE   9   3.165  -5.299 -14.267
   82    HB   ILE   9           HB       ILE   9   4.617  -6.506 -12.728
   83   HG12  ILE   9          2HG1      ILE   9   3.308  -6.150 -10.638
   84   HG13  ILE   9          3HG1      ILE   9   2.637  -4.684 -11.344
   85   HG21  ILE   9          1HG2      ILE   9   4.982  -3.994 -11.132
   86   HG22  ILE   9          2HG2      ILE   9   5.854  -5.521 -11.009
   87   HG23  ILE   9          3HG2      ILE   9   6.125  -4.460 -12.391
   88   HD11  ILE   9          3HD1      ILE   9   1.101  -6.573 -11.503
   89   HD12  ILE   9          1HD1      ILE   9   1.582  -5.984 -13.094
   90   HD13  ILE   9          2HD1      ILE   9   2.296  -7.461 -12.447
   91    H    TYR  10           H        TYR  10   1.540  -3.926 -13.956
   92    HA   TYR  10           HA       TYR  10   2.075  -1.133 -13.542
   93    HB2  TYR  10           2HB      TYR  10  -0.402  -2.758 -14.038
   94    HB3  TYR  10           3HB      TYR  10  -0.525  -1.071 -13.552
   95    HD1  TYR  10           HD1      TYR  10   1.009  -3.281 -16.124
   96    HD2  TYR  10           HD2      TYR  10  -0.366   0.625 -15.149
   97    HE1  TYR  10           HE1      TYR  10   1.328  -2.591 -18.463
   98    HE2  TYR  10           HE2      TYR  10  -0.052   1.326 -17.485
   99    HH   TYR  10           HH       TYR  10   1.264  -0.908 -19.912
  100    H    ARG  11           H        ARG  11   2.517  -0.394 -11.574
  101    HA   ARG  11           HA       ARG  11   0.643  -0.855  -9.421
  102    HB2  ARG  11           2HB      ARG  11   3.478  -1.855  -9.326
  103    HB3  ARG  11           3HB      ARG  11   2.612  -1.427  -7.857
  104    HG2  ARG  11           2HG      ARG  11   0.829  -3.049  -8.548
  105    HG3  ARG  11           3HG      ARG  11   1.912  -3.573  -9.840
  106    HD2  ARG  11           2HD      ARG  11   3.416  -4.523  -8.377
  107    HD3  ARG  11           3HD      ARG  11   2.924  -3.488  -7.037
  108    HE   ARG  11           HE       ARG  11   1.882  -6.046  -7.669
  109   HH11  ARG  11          1HH1      ARG  11   0.950  -2.912  -6.473
  110   HH12  ARG  11          2HH1      ARG  11  -0.394  -3.515  -5.561
  111   HH21  ARG  11          1HH2      ARG  11   0.116  -6.852  -6.472
  112   HH22  ARG  11          2HH2      ARG  11  -0.866  -5.757  -5.560
  113    H    ARG  12           H        ARG  12   1.655   0.302  -7.341
  114    HA   ARG  12           HA       ARG  12   2.924   2.806  -8.219
  115    HB2  ARG  12           2HB      ARG  12   0.602   3.343  -8.004
  116    HB3  ARG  12           3HB      ARG  12   0.487   2.494  -6.468
  117    HG2  ARG  12           2HG      ARG  12   1.525   4.181  -5.300
  118    HG3  ARG  12           3HG      ARG  12   2.355   4.802  -6.729
  119    HD2  ARG  12           2HD      ARG  12   0.599   6.079  -7.356
  120    HD3  ARG  12           3HD      ARG  12  -0.589   4.895  -6.812
  121    HE   ARG  12           HE       ARG  12   0.370   7.144  -5.356
  122   HH11  ARG  12          1HH1      ARG  12  -0.746   3.865  -5.000
  123   HH12  ARG  12          2HH1      ARG  12  -1.310   4.095  -3.378
  124   HH21  ARG  12          1HH2      ARG  12  -0.369   7.459  -3.221
  125   HH22  ARG  12          2HH2      ARG  12  -1.096   6.140  -2.367
  126    H    ARG  13           H        ARG  13   4.586   3.446  -6.996
  127    HA   ARG  13           HA       ARG  13   5.220   1.882  -4.617
  128    HB2  ARG  13           2HB      ARG  13   7.446   2.676  -4.837
  129    HB3  ARG  13           3HB      ARG  13   6.897   2.295  -6.464
  130    HG2  ARG  13           2HG      ARG  13   6.497   4.644  -6.908
  131    HG3  ARG  13           3HG      ARG  13   6.966   5.053  -5.257
  132    HD2  ARG  13           2HD      ARG  13   9.158   3.737  -5.951
  133    HD3  ARG  13           3HD      ARG  13   8.642   4.222  -7.566
  134    HE   ARG  13           HE       ARG  13   9.303   6.348  -7.079
  135   HH11  ARG  13          1HH1      ARG  13   8.846   4.614  -4.095
  136   HH12  ARG  13          2HH1      ARG  13   9.450   5.900  -3.104
  137   HH21  ARG  13          1HH2      ARG  13  10.100   8.049  -5.784
  138   HH22  ARG  13          2HH2      ARG  13  10.162   7.854  -4.065
  Start of MODEL   20
    1    H1   LYS   1           H        LYS   1   0.562  -0.803   0.294
    2    HA   LYS   1           HA       LYS   1   1.016   0.040  -2.418
    3    HB2  LYS   1           2HB      LYS   1   2.838   1.600  -1.911
    4    HB3  LYS   1           3HB      LYS   1   1.307   2.174  -1.262
    5    HG2  LYS   1           2HG      LYS   1   1.924   1.674   0.941
    6    HG3  LYS   1           3HG      LYS   1   3.264   0.648   0.422
    7    HD2  LYS   1           2HD      LYS   1   4.627   2.436  -0.050
    8    HD3  LYS   1           3HD      LYS   1   3.272   3.521  -0.369
    9    HE2  LYS   1           2HE      LYS   1   3.908   2.457   2.373
   10    HE3  LYS   1           3HE      LYS   1   4.590   3.958   1.749
   11    HZ1  LYS   1           3HZ      LYS   1   1.853   4.069   1.304
   12    HZ2  LYS   1           1HZ      LYS   1   2.756   4.976   2.411
   13    HZ3  LYS   1           2HZ      LYS   1   2.050   3.515   2.890
   14    H    TRP   2           H        TRP   2   3.001  -0.732  -3.275
   15    HA   TRP   2           HA       TRP   2   4.321  -2.741  -1.569
   16    HB2  TRP   2           2HB      TRP   2   4.146  -4.297  -3.195
   17    HB3  TRP   2           3HB      TRP   2   2.878  -3.253  -3.834
   18    HD1  TRP   2           HD1      TRP   2   3.831  -1.366  -5.722
   19    HE1  TRP   2           HE1      TRP   2   5.531  -1.769  -7.612
   20    HE3  TRP   2           HE3      TRP   2   6.067  -5.593  -3.913
   21    HZ2  TRP   2           HZ2      TRP   2   7.553  -3.633  -8.251
   22    HZ3  TRP   2           HZ3      TRP   2   7.876  -6.624  -5.225
   23    HH2  TRP   2           HH2      TRP   2   8.601  -5.663  -7.349
   24    H    PHE   3           H        PHE   3   6.508  -3.407  -2.801
   25    HA   PHE   3           HA       PHE   3   8.302  -1.334  -2.405
   26    HB2  PHE   3           2HB      PHE   3   8.405  -4.052  -3.397
   27    HB3  PHE   3           3HB      PHE   3   9.526  -3.020  -4.278
   28    HD1  PHE   3           HD1      PHE   3  10.706  -1.252  -2.496
   29    HD2  PHE   3           HD2      PHE   3   9.399  -5.226  -1.709
   30    HE1  PHE   3           HE1      PHE   3  12.312  -1.409  -0.638
   31    HE2  PHE   3           HE2      PHE   3  11.002  -5.389   0.150
   32    HZ   PHE   3           HZ       PHE   3  12.461  -3.479   0.688
   33    H    ARG   4           H        ARG   4   9.968  -0.819  -4.328
   34    HA   ARG   4           HA       ARG   4   8.752   1.086  -5.937
   35    HB2  ARG   4           2HB      ARG   4  11.407  -0.289  -6.003
   36    HB3  ARG   4           3HB      ARG   4  10.947   0.748  -7.347
   37    HG2  ARG   4           2HG      ARG   4  10.549   2.578  -5.694
   38    HG3  ARG   4           3HG      ARG   4  11.236   1.524  -4.456
   39    HD2  ARG   4           2HD      ARG   4  13.357   1.640  -5.344
   40    HD3  ARG   4           3HD      ARG   4  12.772   2.014  -6.965
   41    HE   ARG   4           HE       ARG   4  12.858   4.233  -6.434
   42   HH11  ARG   4          1HH1      ARG   4  12.902   2.371  -3.493
   43   HH12  ARG   4          2HH1      ARG   4  13.190   3.743  -2.475
   44   HH21  ARG   4          1HH2      ARG   4  13.237   6.047  -5.104
   45   HH22  ARG   4          2HH2      ARG   4  13.379   5.833  -3.392
   46    H    VAL   5           H        VAL   5   7.657   1.022  -7.791
   47    HA   VAL   5           HA       VAL   5   6.942  -1.456  -8.983
   48    HB   VAL   5           HB       VAL   5   5.685  -0.159 -10.590
   49   HG11  VAL   5          1HG1      VAL   5   5.588   0.839  -7.758
   50   HG12  VAL   5          2HG1      VAL   5   4.415   1.345  -8.975
   51   HG13  VAL   5          3HG1      VAL   5   4.555  -0.358  -8.538
   52   HG21  VAL   5          3HG2      VAL   5   6.697   1.686 -11.363
   53   HG22  VAL   5          1HG2      VAL   5   5.967   2.490  -9.973
   54   HG23  VAL   5          2HG2      VAL   5   7.629   1.907  -9.882
   55    H    TYR   6           H        TYR   6   7.213  -1.981 -11.280
   56    HA   TYR   6           HA       TYR   6   9.620  -0.872 -12.522
   57    HB2  TYR   6           2HB      TYR   6  10.109  -2.989 -11.130
   58    HB3  TYR   6           3HB      TYR   6   9.237  -3.855 -12.390
   59    HD1  TYR   6           HD2      TYR   6  12.098  -1.524 -11.883
   60    HD2  TYR   6           HD1      TYR   6  10.356  -4.553 -14.311
   61    HE1  TYR   6           HE2      TYR   6  14.152  -1.614 -13.234
   62    HE2  TYR   6           HE1      TYR   6  12.405  -4.652 -15.668
   63    HH   TYR   6           HH       TYR   6  15.294  -2.884 -14.765
   64    H    ARG   7           H        ARG   7   9.835  -1.459 -14.798
   65    HA   ARG   7           HA       ARG   7   7.386  -1.202 -16.184
   66    HB2  ARG   7           2HB      ARG   7  10.206  -1.773 -17.071
   67    HB3  ARG   7           3HB      ARG   7   8.873  -1.705 -18.217
   68    HG2  ARG   7           2HG      ARG   7   9.811   0.426 -18.283
   69    HG3  ARG   7           3HG      ARG   7   8.391   0.607 -17.252
   70    HD2  ARG   7           2HD      ARG   7   9.636   0.894 -15.353
   71    HD3  ARG   7           3HD      ARG   7  10.986  -0.061 -15.966
   72    HE   ARG   7           HE       ARG   7  10.689   2.336 -17.450
   73   HH11  ARG   7          1HH1      ARG   7  11.821   1.107 -14.396
   74   HH12  ARG   7          2HH1      ARG   7  12.973   2.380 -14.162
   75   HH21  ARG   7          1HH2      ARG   7  12.201   4.018 -17.154
   76   HH22  ARG   7          2HH2      ARG   7  13.188   4.036 -15.731
   77    H    GLY   8           H        GLY   8   5.916  -2.762 -16.358
   78    HA2  GLY   8           2HA      GLY   8   5.736  -4.916 -17.770
   79    HA3  GLY   8           3HA      GLY   8   6.829  -5.553 -16.551
   80    H    ILE   9           H        ILE   9   5.385  -3.785 -14.531
   81    HA   ILE   9           HA       ILE   9   2.871  -5.286 -14.321
   82    HB   ILE   9           HB       ILE   9   4.479  -6.481 -12.935
   83   HG12  ILE   9          2HG1      ILE   9   3.277  -6.330 -10.771
   84   HG13  ILE   9          3HG1      ILE   9   2.512  -4.843 -11.320
   85   HG21  ILE   9          1HG2      ILE   9   4.805  -4.031 -11.236
   86   HG22  ILE   9          2HG2      ILE   9   5.763  -5.511 -11.241
   87   HG23  ILE   9          3HG2      ILE   9   5.893  -4.372 -12.581
   88   HD11  ILE   9          3HD1      ILE   9   0.917  -5.989 -12.327
   89   HD12  ILE   9          1HD1      ILE   9   2.101  -6.913 -13.251
   90   HD13  ILE   9          2HD1      ILE   9   1.604  -7.466 -11.651
   91    H    TYR  10           H        TYR  10   1.197  -4.024 -13.841
   92    HA   TYR  10           HA       TYR  10   1.600  -1.228 -13.328
   93    HB2  TYR  10           2HB      TYR  10  -0.851  -2.953 -13.639
   94    HB3  TYR  10           3HB      TYR  10  -0.960  -1.249 -13.211
   95    HD1  TYR  10           HD1      TYR  10   0.421  -3.537 -15.804
   96    HD2  TYR  10           HD2      TYR  10  -0.970   0.376 -14.883
   97    HE1  TYR  10           HE1      TYR  10   0.548  -2.939 -18.187
   98    HE2  TYR  10           HE2      TYR  10  -0.849   0.986 -17.263
   99    HH   TYR  10           HH       TYR  10   0.847  -0.541 -19.467
  100    H    ARG  11           H        ARG  11   2.148  -0.553 -11.363
  101    HA   ARG  11           HA       ARG  11   0.457  -1.188  -9.111
  102    HB2  ARG  11           2HB      ARG  11   3.305  -2.124  -9.283
  103    HB3  ARG  11           3HB      ARG  11   2.584  -1.738  -7.727
  104    HG2  ARG  11           2HG      ARG  11   0.690  -3.349  -8.553
  105    HG3  ARG  11           3HG      ARG  11   1.969  -3.962  -9.603
  106    HD2  ARG  11           2HD      ARG  11   3.218  -4.754  -7.848
  107    HD3  ARG  11           3HD      ARG  11   2.554  -3.584  -6.709
  108    HE   ARG  11           HE       ARG  11   1.580  -6.201  -7.214
  109   HH11  ARG  11          1HH1      ARG  11   0.542  -2.964  -6.462
  110   HH12  ARG  11          2HH1      ARG  11  -0.916  -3.473  -5.677
  111   HH21  ARG  11          1HH2      ARG  11  -0.336  -6.884  -6.182
  112   HH22  ARG  11          2HH2      ARG  11  -1.414  -5.704  -5.518
  113    H    ARG  12           H        ARG  12   1.588  -0.095  -7.051
  114    HA   ARG  12           HA       ARG  12   2.758   2.468  -7.877
  115    HB2  ARG  12           2HB      ARG  12   0.218   2.547  -7.458
  116    HB3  ARG  12           3HB      ARG  12   0.624   2.326  -5.761
  117    HG2  ARG  12           2HG      ARG  12   0.528   4.593  -5.836
  118    HG3  ARG  12           3HG      ARG  12   2.230   4.364  -6.244
  119    HD2  ARG  12           2HD      ARG  12   1.921   4.929  -8.440
  120    HD3  ARG  12           3HD      ARG  12   0.244   4.386  -8.456
  121    HE   ARG  12           HE       ARG  12  -0.405   6.488  -7.826
  122   HH11  ARG  12          1HH1      ARG  12   3.014   6.136  -7.275
  123   HH12  ARG  12          2HH1      ARG  12   3.257   7.808  -6.891
  124   HH21  ARG  12          1HH2      ARG  12  -0.099   8.692  -7.322
  125   HH22  ARG  12          2HH2      ARG  12   1.485   9.261  -6.918
  126    H    ARG  13           H        ARG  13   4.542   2.904  -6.769
  127    HA   ARG  13           HA       ARG  13   5.269   1.300  -4.488
  128    HB2  ARG  13           2HB      ARG  13   7.416   2.375  -4.628
  129    HB3  ARG  13           3HB      ARG  13   6.897   1.961  -6.256
  130    HG2  ARG  13           2HG      ARG  13   6.315   4.227  -6.725
  131    HG3  ARG  13           3HG      ARG  13   6.572   4.693  -5.042
  132    HD2  ARG  13           2HD      ARG  13   8.861   4.604  -5.225
  133    HD3  ARG  13           3HD      ARG  13   8.816   3.442  -6.551
  134    HE   ARG  13           HE       ARG  13   7.703   5.756  -7.543
  135   HH11  ARG  13          1HH1      ARG  13  10.754   4.807  -6.161
  136   HH12  ARG  13          2HH1      ARG  13  11.671   5.973  -7.057
  137   HH21  ARG  13          1HH2      ARG  13   8.899   7.295  -8.729
  138   HH22  ARG  13          2HH2      ARG  13  10.614   7.388  -8.516