*HEADER    RNA BINDING PROTEIN                     03-NOV-06   2NS4              
*TITLE     SOLUTION STRUCTURE OF A BETA-HAIRPIN PEPTIDOMIMETIC                   
*TITLE    2 INHIBITOR OF THE BIV TAT-TAR INTERACTION                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: L-22 CYCLIC PEPTIDE;                                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE L-22 PEPTIDE WAS SYNTHESIZED BY SOLID             
*SOURCE   4 PHASE SYNTHESIS AND PURIFIED BY REVERSE PHASE HPLC.                  
*KEYWDS    NMR, PEPTIDOMIMETICS, PEPTIDE STRUCTURE, RNA RECOGNITION,             
*KEYWDS   2 IMMUNODEFICIENCY VIRUS, TAR RNA                                      
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    K.MOEHLE, K.PATORA, J.A.ROBINSON                                      
*REVDAT   1   30-JAN-07 2NS4    0                                                
 
 INTRARESIDUAL NOE UPPER-DISTANCE LIMITS 

  1 ARG+ HN      1 ARG+ QG      6.00                
  1 ARG+ HA      1 ARG+ QD      5.17                
  2 VAL  HN      2 VAL  HB      2.99                
  3 ARG+ HN      3 ARG+ HA      2.83                
  3 ARG+ HN      3 ARG+ HB2     3.48                
  3 ARG+ HN      3 ARG+ HB3     3.48                
  3 ARG+ HN      3 ARG+ HG2     5.25                
  3 ARG+ HN      3 ARG+ HG3     5.25                
  3 ARG+ HA      3 ARG+ QG      3.93                
  4 THR  HN      4 THR  HB      3.05                
  5 ARG+ HN      5 ARG+ HB2     3.67                
  5 ARG+ HN      5 ARG+ HB3     3.67                
  5 ARG+ HN      5 ARG+ QB      3.39                
  5 ARG+ HN      5 ARG+ QG      6.13                
  5 ARG+ HA      5 ARG+ QB      2.67                
  5 ARG+ HA      5 ARG+ HG2     3.64                
  5 ARG+ HA      5 ARG+ HG3     3.64                
  5 ARG+ HA      5 ARG+ QG      3.18                
  6 LYS+ HN      6 LYS+ HA      2.59                
  6 LYS+ HN      6 LYS+ HB2     4.14                
  6 LYS+ HN      6 LYS+ HB3     4.14                
  6 LYS+ HN      6 LYS+ QB      3.92                
  6 LYS+ HN      6 LYS+ QG      5.69                
  7 GLY  HN      7 GLY  HA1     2.71                
  8 ARG+ HN      8 ARG+ HB2     3.76                
  8 ARG+ HN      8 ARG+ HB3     3.76                
  8 ARG+ HN      8 ARG+ QB      3.41                
  8 ARG+ HN      8 ARG+ HG2     5.50                
  8 ARG+ HN      8 ARG+ HG3     5.50                
  8 ARG+ HA      8 ARG+ HG2     3.89                
  8 ARG+ HA      8 ARG+ HG3     3.89                
  9 ARG+ HN      9 ARG+ HB2     2.96                
  9 ARG+ HN      9 ARG+ HB3     2.80                
  9 ARG+ HN      9 ARG+ QG      5.01                
  9 ARG+ HA      9 ARG+ HB2     3.05                
  9 ARG+ HA      9 ARG+ HG2     4.04                
  9 ARG+ HA      9 ARG+ HG3     4.04                
  9 ARG+ HA      9 ARG+ QG      3.87                
  9 ARG+ HB3     9 ARG+ QD      3.96                
 10 ILE  HN     10 ILE  HB      3.33                
 10 ILE  HN     10 ILE  HG12    4.85                
 10 ILE  HN     10 ILE  HG13    4.85                
 10 ILE  HN     10 ILE  QG1     4.48                
 10 ILE  HN     10 ILE  QD1     5.63                
 10 ILE  HA     10 ILE  HB      2.99                
 11 ARG+ HN     11 ARG+ HB2     2.90                
 11 ARG+ HN     11 ARG+ HB3     2.90                
 11 ARG+ HN     11 ARG+ HG2     4.82                
 11 ARG+ HN     11 ARG+ HG3     4.82                
 11 ARG+ HN     11 ARG+ QG      4.49                
 12 ILE  HN     12 ILE  HB      3.24                
 12 ILE  HN     12 ILE  HG12    5.50                
 12 ILE  HN     12 ILE  HG13    5.50                
 12 ILE  HN     12 ILE  QG1     5.07                
 12 ILE  HN     12 ILE  QD1     6.53                
 12 ILE  HA     12 ILE  HB      2.68                

 SEQUENTIAL NOE UPPER-DISTANCE LIMITS 

  1 ARG+ HN     14 PRO  HA      3.67                
  1 ARG+ HN     14 PRO  HB2     5.22                
  1 ARG+ HN     14 PRO  QG      5.12                
  1 ARG+ HN     14 PRO  HD2     5.50                
  1 ARG+ HN     14 PRO  HD3     4.11                
  1 ARG+ HA      2 VAL  HN      2.56                
  1 ARG+ QB      2 VAL  HN      4.39                
  1 ARG+ QG      2 VAL  HN      6.38                
  2 VAL  HN      3 ARG+ HN      3.98                
  2 VAL  HA      3 ARG+ HN      2.90                
  2 VAL  QG1     3 ARG+ HN      5.81                
  2 VAL  QG2     3 ARG+ HN      5.81                
  2 VAL  QQG     3 ARG+ HN      5.21                
  3 ARG+ HN      4 THR  HN      4.45                
  3 ARG+ HA      4 THR  HN      2.87                
  4 THR  HN      5 ARG+ HN      4.29                
  4 THR  HA      5 ARG+ HN      2.52                
  4 THR  HB      5 ARG+ HN      3.86                
  4 THR  QG2     5 ARG+ HN      5.54                
  5 ARG+ HA      6 LYS+ HN      2.52                
  5 ARG+ HB2     6 LYS+ HN      3.98                
  5 ARG+ HB3     6 LYS+ HN      3.98                
  5 ARG+ QB      6 LYS+ HN      3.80                
  6 LYS+ HN      7 GLY  HN      3.45                
  6 LYS+ HA      7 GLY  HN      2.99                
  6 LYS+ QB      7 GLY  HN      5.32                
  7 GLY  HN      8 ARG+ HN      3.36                
  8 ARG+ HA      9 ARG+ HN      2.49                
  8 ARG+ HB2     9 ARG+ HN      3.70                
  8 ARG+ HB3     9 ARG+ HN      3.70                
  8 ARG+ QB      9 ARG+ HN      3.22                
  9 ARG+ HN     10 ILE  HN      4.57                
  9 ARG+ HA     10 ILE  HN      2.56                
  9 ARG+ HB2    10 ILE  HN      4.11                
  9 ARG+ HB3    10 ILE  HN      4.29                
  9 ARG+ HG2    10 ILE  HN      5.50                
  9 ARG+ HG3    10 ILE  HN      5.50                
  9 ARG+ QD     10 ILE  QD1     6.01                
 10 ILE  HN     11 ARG+ HN      4.38                
 10 ILE  HA     11 ARG+ HN      2.49                
 10 ILE  HB     11 ARG+ HN      3.36                
 10 ILE  QG2    11 ARG+ HN      5.63                
 10 ILE  QG1    11 ARG+ HN      6.38                
 10 ILE  QD1    11 ARG+ HN      6.53                
 11 ARG+ HA     12 ILE  HN      2.83                
 11 ARG+ HB2    12 ILE  HN      4.35                
 11 ARG+ HB3    12 ILE  HN      4.35                
 11 ARG+ QB     12 ILE  HN      3.96                
 11 ARG+ HG2    12 ILE  HN      5.50                
 11 ARG+ HG3    12 ILE  HN      5.50                
 11 ARG+ QG     12 ILE  HN      5.02                
 12 ILE  HA     13 DPR  HD3     2.74                
 12 ILE  HA     13 DPR  HD2     3.11                
 12 ILE  QG2    13 DPR  HD3     5.66                
 12 ILE  QG2    13 DPR  HD2     6.50                
 13 DPR  HA     14 PRO  HD2     3.05                
 13 DPR  HA     14 PRO  HD3     3.02                
 13 DPR  HB3    14 PRO  HD2     4.63                
 13 DPR  HB3    14 PRO  HD3     5.34                

 MEDIUM and LONG RANGE NOE UPPER-DISTANCE LIMITS 

  1 ARG+ HN     12 ILE  HN      3.83                
  1 ARG+ HN     12 ILE  QG2     6.53                
  1 ARG+ HN     13 DPR  HA      4.60                
  2 VAL  HA     11 ARG+ HA      2.87                
  2 VAL  HA     12 ILE  HN      3.73                
  2 VAL  QG1    11 ARG+ HA      5.91                
  2 VAL  QG2    11 ARG+ HA      5.91                
  2 VAL  QQG    11 ARG+ HA      5.51                
  3 ARG+ HN     10 ILE  HN      4.26                
  3 ARG+ HN     10 ILE  HB      4.63                
  3 ARG+ HN     10 ILE  QG1     6.38                
  3 ARG+ HN     11 ARG+ HA      4.17                
  4 THR  HA      8 ARG+ HN      4.35                
  4 THR  HA      9 ARG+ HA      3.24                
  4 THR  HA     10 ILE  HN      3.67                
  4 THR  QG2     7 GLY  HN      5.41                
  4 THR  QG2     7 GLY  HA1     5.38                
  4 THR  QG2     8 ARG+ HN      6.09                
  4 THR  QG2     8 ARG+ HA      6.43                
  4 THR  QG2     9 ARG+ HA      5.85                
  5 ARG+ HN      8 ARG+ HN      3.27                
  6 LYS+ HA      8 ARG+ HN      4.48                
 11 ARG+ QG     13 DPR  HD2     5.54                


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ARG   1          H         ARG   1   2.108   0.244   0.864
    2    HA   ARG   1           HA       ARG   1   1.349  -0.139  -1.890
    3   1HB   ARG   1          1HB       ARG   1   2.139   2.362  -1.177
    4   2HB   ARG   1          2HB       ARG   1   3.725   1.652  -1.405
    5   1HG   ARG   1          1HG       ARG   1   3.497   1.950  -3.639
    6   2HG   ARG   1          2HG       ARG   1   2.196   0.775  -3.635
    7   1HD   ARG   1          1HD       ARG   1   0.999   3.138  -2.639
    8   2HD   ARG   1          2HD       ARG   1   2.057   3.699  -3.919
    9    HE   ARG   1           HE       ARG   1  -0.308   1.968  -4.228
   10   1HH1  ARG   1          2HH2      ARG   1   2.629   3.203  -5.722
   11   2HH1  ARG   1          1HH2      ARG   1   2.096   2.880  -7.338
   12   1HH2  ARG   1          2HH1      ARG   1  -1.013   1.543  -6.359
   13   2HH2  ARG   1          1HH1      ARG   1   0.011   1.929  -7.702
   14    H    VAL   2           H        VAL   2   3.428  -0.831  -3.210
   15    HA   VAL   2           HA       VAL   2   5.306  -2.213  -1.433
   16    HB   VAL   2           HB       VAL   2   3.515  -3.338  -3.541
   17   1HG1  VAL   2          1HG1      VAL   2   5.030  -5.306  -3.771
   18   2HG1  VAL   2          2HG1      VAL   2   5.696  -3.814  -4.476
   19   3HG1  VAL   2          3HG1      VAL   2   6.288  -4.395  -2.902
   20   1HG2  VAL   2          1HG2      VAL   2   3.631  -3.557  -0.802
   21   2HG2  VAL   2          2HG2      VAL   2   2.823  -4.707  -1.895
   22   3HG2  VAL   2          3HG2      VAL   2   4.482  -5.028  -1.333
   23    H    ARG   3           H        ARG   3   7.153  -1.067  -1.814
   24    HA   ARG   3           HA       ARG   3   7.618  -0.082  -4.455
   25   1HB   ARG   3          1HB       ARG   3   8.379   0.702  -1.851
   26   2HB   ARG   3          2HB       ARG   3   9.874   0.127  -2.560
   27   1HG   ARG   3          1HG       ARG   3  10.060   2.038  -3.761
   28   2HG   ARG   3          2HG       ARG   3   8.543   1.694  -4.570
   29   1HD   ARG   3          1HD       ARG   3   7.700   3.531  -3.521
   30   2HD   ARG   3          2HD       ARG   3   7.713   2.589  -2.044
   31    HE   ARG   3           HE       ARG   3  10.338   3.588  -2.362
   32   1HH1  ARG   3          2HH2      ARG   3   7.102   4.892  -1.902
   33   2HH1  ARG   3          1HH2      ARG   3   7.654   6.319  -1.090
   34   1HH2  ARG   3          2HH1      ARG   3  11.067   5.470  -1.290
   35   2HH2  ARG   3          1HH1      ARG   3   9.924   6.649  -0.739
   36    H    THR   4           H        THR   4  10.398  -0.280  -4.764
   37    HA   THR   4           HA       THR   4  11.127  -3.073  -4.436
   38    HB   THR   4           HB       THR   4  11.274  -1.883  -7.220
   39    HG1  THR   4           1HG      THR   4   9.073  -2.844  -7.442
   40   1HG2  THR   4          1HG2      THR   4  12.296  -4.123  -6.800
   41   2HG2  THR   4          2HG2      THR   4  10.758  -4.692  -6.109
   42   3HG2  THR   4          3HG2      THR   4  10.857  -4.274  -7.837
   43    H    ARG   5           H        ARG   5  13.312  -3.403  -4.259
   44    HA   ARG   5           HA       ARG   5  15.037  -1.260  -5.056
   45   1HB   ARG   5          1HB       ARG   5  14.475  -1.981  -2.176
   46   2HB   ARG   5          2HB       ARG   5  16.123  -1.563  -2.600
   47   1HG   ARG   5          1HG       ARG   5  13.726   0.190  -3.309
   48   2HG   ARG   5          2HG       ARG   5  14.651   0.389  -1.834
   49   1HD   ARG   5          1HD       ARG   5  15.832   1.871  -3.169
   50   2HD   ARG   5          2HD       ARG   5  16.723   0.415  -3.564
   51    HE   ARG   5           HE       ARG   5  15.770   0.421  -5.715
   52   1HH1  ARG   5          2HH2      ARG   5  14.052   2.691  -3.647
   53   2HH1  ARG   5          1HH2      ARG   5  13.146   3.388  -4.948
   54   1HH2  ARG   5          2HH1      ARG   5  14.575   1.341  -7.433
   55   2HH2  ARG   5          1HH1      ARG   5  13.446   2.616  -7.116
   56    H    LYS   6           H        LYS   6  17.381  -1.942  -4.939
   57    HA   LYS   6           HA       LYS   6  18.881  -3.448  -5.610
   58   1HB   LYS   6          1HB       LYS   6  18.151  -3.865  -2.882
   59   2HB   LYS   6          2HB       LYS   6  18.501  -5.434  -3.579
   60   1HG   LYS   6          1HG       LYS   6  20.629  -4.682  -2.871
   61   2HG   LYS   6          2HG       LYS   6  20.634  -4.315  -4.585
   62   1HD   LYS   6          1HD       LYS   6  19.460  -2.050  -3.294
   63   2HD   LYS   6          2HD       LYS   6  20.854  -2.490  -2.329
   64   1HE   LYS   6          1HE       LYS   6  22.372  -2.105  -4.078
   65   2HE   LYS   6          2HE       LYS   6  21.186  -2.428  -5.327
   66   1HZ   LYS   6          1HZ       LYS   6  21.922   0.002  -4.537
   67   2HZ   LYS   6          2HZ       LYS   6  20.515  -0.324  -5.299
   68   3HZ   LYS   6          3HZ       LYS   6  20.550  -0.188  -3.672
   69    H    GLY   7           H        GLY   7  16.607  -3.694  -7.164
   70   1HA   GLY   7          1HA       GLY   7  15.485  -5.108  -8.507
   71   2HA   GLY   7          2HA       GLY   7  16.891  -6.145  -8.370
   72    H    ARG   8           H        ARG   8  14.750  -5.180  -5.643
   73    HA   ARG   8           HA       ARG   8  13.662  -7.864  -5.676
   74   1HB   ARG   8          1HB       ARG   8  15.000  -6.487  -3.298
   75   2HB   ARG   8          2HB       ARG   8  13.958  -7.883  -3.113
   76   1HG   ARG   8          1HG       ARG   8  15.722  -8.657  -5.161
   77   2HG   ARG   8          2HG       ARG   8  16.745  -7.745  -4.070
   78   1HD   ARG   8          1HD       ARG   8  15.099  -9.383  -2.403
   79   2HD   ARG   8          2HD       ARG   8  15.625 -10.414  -3.719
   80    HE   ARG   8           HE       ARG   8  17.761 -10.394  -2.790
   81   1HH1  ARG   8          2HH2      ARG   8  16.075  -7.482  -1.760
   82   2HH1  ARG   8          1HH2      ARG   8  17.369  -6.937  -0.747
   83   1HH2  ARG   8          2HH1      ARG   8  19.469  -9.675  -1.453
   84   2HH2  ARG   8          1HH1      ARG   8  19.312  -8.193  -0.572
   85    H    ARG   9           H        ARG   9  11.711  -8.027  -4.107
   86    HA   ARG   9           HA       ARG   9  10.311  -5.494  -4.261
   87   1HB   ARG   9          1HB       ARG   9   9.179  -7.354  -5.385
   88   2HB   ARG   9          2HB       ARG   9   9.331  -8.375  -3.969
   89   1HG   ARG   9          1HG       ARG   9   7.942  -5.761  -3.525
   90   2HG   ARG   9          2HG       ARG   9   7.093  -6.899  -4.553
   91   1HD   ARG   9          1HD       ARG   9   8.216  -7.661  -1.818
   92   2HD   ARG   9          2HD       ARG   9   6.580  -7.076  -2.043
   93    HE   ARG   9           HE       ARG   9   7.552  -9.729  -2.673
   94   1HH1  ARG   9          2HH2      ARG   9   5.255  -7.280  -3.725
   95   2HH1  ARG   9          1HH2      ARG   9   4.179  -8.423  -4.459
   96   1HH2  ARG   9          2HH1      ARG   9   6.133 -11.237  -3.641
   97   2HH2  ARG   9          1HH1      ARG   9   4.681 -10.687  -4.410
   98    H    ILE  10           H        ILE  10   9.118  -4.683  -2.395
   99    HA   ILE  10           HA       ILE  10   9.555  -6.091   0.112
  100    HB   ILE  10           HB       ILE  10  10.174  -3.177   0.076
  101   1HG1  ILE  10          2HG1      ILE  10  12.638  -3.883  -0.217
  102   2HG1  ILE  10          3HG1      ILE  10  12.008  -5.340  -0.959
  103   1HG2  ILE  10          1HG2      ILE  10  11.855  -4.902   1.683
  104   2HG2  ILE  10          2HG2      ILE  10  10.782  -3.571   2.176
  105   3HG2  ILE  10          3HG2      ILE  10  10.131  -5.217   1.991
  106   1HD1  ILE  10          1HD1      ILE  10  12.246  -2.677  -2.094
  107   2HD1  ILE  10          2HD1      ILE  10  11.801  -4.199  -2.902
  108   3HD1  ILE  10          3HD1      ILE  10  10.545  -3.199  -2.133
  109    H    ARG  11           H        ARG  11   8.159  -5.191   1.874
  110    HA   ARG  11           HA       ARG  11   5.861  -3.852   0.686
  111   1HB   ARG  11          1HB       ARG  11   5.718  -6.411   1.439
  112   2HB   ARG  11          2HB       ARG  11   5.578  -5.733   3.049
  113   1HG   ARG  11          1HG       ARG  11   3.580  -4.493   2.459
  114   2HG   ARG  11          2HG       ARG  11   3.807  -4.804   0.750
  115   1HD   ARG  11          1HD       ARG  11   2.143  -6.379   1.362
  116   2HD   ARG  11          2HD       ARG  11   3.611  -7.336   1.368
  117    HE   ARG  11           HE       ARG  11   3.265  -6.219   3.978
  118   1HH1  ARG  11          2HH2      ARG  11   1.785  -8.604   1.855
  119   2HH1  ARG  11          1HH2      ARG  11   1.168  -9.567   3.156
  120   1HH2  ARG  11          2HH1      ARG  11   2.450  -7.489   5.695
  121   2HH2  ARG  11          1HH1      ARG  11   1.548  -8.928   5.355
  122    H    ILE  12           H        ILE  12   4.909  -2.169   1.936
  123    HA   ILE  12           HA       ILE  12   5.546  -1.817   4.674
  124    HB   ILE  12           HB       ILE  12   7.667  -1.138   3.375
  125   1HG1  ILE  12          2HG1      ILE  12   7.516   1.123   4.948
  126   2HG1  ILE  12          3HG1      ILE  12   6.301   0.088   5.673
  127   1HG2  ILE  12          1HG2      ILE  12   6.283   1.503   3.034
  128   2HG2  ILE  12          2HG2      ILE  12   7.759   0.879   2.260
  129   3HG2  ILE  12          3HG2      ILE  12   6.164   0.264   1.762
  130   1HD1  ILE  12          1HD1      ILE  12   8.103  -0.795   6.787
  131   2HD1  ILE  12          2HD1      ILE  12   8.304  -1.741   5.294
  132   3HD1  ILE  12          3HD1      ILE  12   9.259  -0.260   5.545
  133    HA   PRO  13           HA       PRO  13   2.221   0.958   4.823
  134   1HB   PRO  13          1HB       PRO  13   1.732  -0.375   6.663
  135   2HB   PRO  13          2HB       PRO  13   0.246  -0.683   5.749
  136   1HG   PRO  13          1HG       PRO  13   1.699  -2.825   6.532
  137   2HG   PRO  13          2HG       PRO  13   1.130  -2.780   4.845
  138   1HD   PRO  13          1HD       PRO  13   3.938  -2.213   5.893
  139   2HD   PRO  13          2HD       PRO  13   3.443  -3.024   4.376
  140    HA   PRO  14           HA       PRO  14  -1.047   1.191   1.903
  141   1HB   PRO  14          1HB       PRO  14  -0.165   3.400   0.464
  142   2HB   PRO  14          2HB       PRO  14  -0.753   3.454   2.132
  143   1HG   PRO  14          1HG       PRO  14   2.170   3.334   1.202
  144   2HG   PRO  14          2HG       PRO  14   1.450   4.457   2.377
  145   1HD   PRO  14          1HD       PRO  14   2.799   2.174   3.197
  146   2HD   PRO  14          2HD       PRO  14   1.370   2.750   4.100
  Start of MODEL    2
    1   1H    ARG   1          H         ARG   1   2.406   0.443   0.629
    2    HA   ARG   1           HA       ARG   1   1.354  -0.569  -1.821
    3   1HB   ARG   1          1HB       ARG   1   3.091   1.915  -1.695
    4   2HB   ARG   1          2HB       ARG   1   3.260   0.829  -3.060
    5   1HG   ARG   1          1HG       ARG   1   0.956   1.119  -3.714
    6   2HG   ARG   1          2HG       ARG   1   0.534   1.868  -2.187
    7   1HD   ARG   1          1HD       ARG   1   2.642   3.155  -3.950
    8   2HD   ARG   1          2HD       ARG   1   0.945   3.382  -4.325
    9    HE   ARG   1           HE       ARG   1   1.490   3.885  -1.513
   10   1HH1  ARG   1          2HH2      ARG   1   1.675   5.314  -4.723
   11   2HH1  ARG   1          1HH2      ARG   1   1.601   6.944  -4.141
   12   1HH2  ARG   1          2HH1      ARG   1   1.392   6.035  -0.745
   13   2HH2  ARG   1          1HH1      ARG   1   1.438   7.357  -1.863
   14    H    VAL   2           H        VAL   2   3.334  -1.487  -3.199
   15    HA   VAL   2           HA       VAL   2   5.299  -2.519  -1.273
   16    HB   VAL   2           HB       VAL   2   3.759  -3.778  -3.507
   17   1HG1  VAL   2          1HG1      VAL   2   6.615  -4.214  -2.945
   18   2HG1  VAL   2          2HG1      VAL   2   5.635  -5.698  -2.904
   19   3HG1  VAL   2          3HG1      VAL   2   5.639  -4.674  -4.360
   20   1HG2  VAL   2          1HG2      VAL   2   3.196  -3.928  -1.000
   21   2HG2  VAL   2          2HG2      VAL   2   3.249  -5.446  -1.930
   22   3HG2  VAL   2          3HG2      VAL   2   4.614  -4.998  -0.878
   23    H    ARG   3           H        ARG   3   6.964  -1.036  -1.564
   24    HA   ARG   3           HA       ARG   3   7.609  -0.051  -4.094
   25   1HB   ARG   3          1HB       ARG   3   8.333   0.488  -1.422
   26   2HB   ARG   3          2HB       ARG   3   9.835  -0.045  -2.152
   27   1HG   ARG   3          1HG       ARG   3   8.524   1.727  -4.020
   28   2HG   ARG   3          2HG       ARG   3   8.510   2.500  -2.448
   29   1HD   ARG   3          1HD       ARG   3  11.107   1.219  -3.039
   30   2HD   ARG   3          2HD       ARG   3  10.678   2.430  -4.230
   31    HE   ARG   3           HE       ARG   3  11.551   2.961  -1.565
   32   1HH1  ARG   3          2HH2      ARG   3   9.091   4.040  -3.837
   33   2HH1  ARG   3          1HH2      ARG   3   8.985   5.632  -3.164
   34   1HH2  ARG   3          2HH1      ARG   3  11.412   5.063  -0.675
   35   2HH2  ARG   3          1HH1      ARG   3  10.313   6.218  -1.354
   36    H    THR   4           H        THR   4  10.462  -0.271  -4.223
   37    HA   THR   4           HA       THR   4  11.189  -3.049  -4.125
   38    HB   THR   4           HB       THR   4  11.036  -1.699  -6.861
   39    HG1  THR   4           1HG      THR   4   8.872  -1.985  -6.205
   40   1HG2  THR   4          1HG2      THR   4  11.296  -3.935  -7.718
   41   2HG2  THR   4          2HG2      THR   4  12.510  -3.804  -6.423
   42   3HG2  THR   4          3HG2      THR   4  10.978  -4.660  -6.124
   43    H    ARG   5           H        ARG   5  13.430  -3.391  -4.323
   44    HA   ARG   5           HA       ARG   5  15.066  -1.198  -5.050
   45   1HB   ARG   5          1HB       ARG   5  14.447  -0.620  -2.670
   46   2HB   ARG   5          2HB       ARG   5  15.122  -2.148  -2.142
   47   1HG   ARG   5          1HG       ARG   5  16.941  -0.492  -3.832
   48   2HG   ARG   5          2HG       ARG   5  16.540   0.210  -2.277
   49   1HD   ARG   5          1HD       ARG   5  17.122  -2.626  -1.935
   50   2HD   ARG   5          2HD       ARG   5  18.432  -1.867  -2.815
   51    HE   ARG   5           HE       ARG   5  17.856  -0.103  -0.711
   52   1HH1  ARG   5          2HH2      ARG   5  18.853  -3.465  -1.003
   53   2HH1  ARG   5          1HH2      ARG   5  19.700  -3.478   0.507
   54   1HH2  ARG   5          2HH1      ARG   5  18.972  -0.120   1.282
   55   2HH2  ARG   5          1HH1      ARG   5  19.768  -1.562   1.816
   56    H    LYS   6           H        LYS   6  17.386  -1.852  -5.145
   57    HA   LYS   6           HA       LYS   6  18.915  -3.321  -5.794
   58   1HB   LYS   6          1HB       LYS   6  18.218  -3.843  -3.079
   59   2HB   LYS   6          2HB       LYS   6  18.558  -5.385  -3.837
   60   1HG   LYS   6          1HG       LYS   6  20.767  -4.756  -4.440
   61   2HG   LYS   6          2HG       LYS   6  20.420  -3.042  -4.320
   62   1HD   LYS   6          1HD       LYS   6  20.581  -3.022  -1.979
   63   2HD   LYS   6          2HD       LYS   6  20.127  -4.708  -1.823
   64   1HE   LYS   6          1HE       LYS   6  22.667  -4.247  -3.317
   65   2HE   LYS   6          2HE       LYS   6  22.717  -3.761  -1.635
   66   1HZ   LYS   6          1HZ       LYS   6  22.797  -5.867  -1.054
   67   2HZ   LYS   6          2HZ       LYS   6  21.434  -6.239  -1.873
   68   3HZ   LYS   6          3HZ       LYS   6  22.883  -6.308  -2.624
   69    H    GLY   7           H        GLY   7  16.222  -3.567  -6.988
   70   1HA   GLY   7          1HA       GLY   7  15.243  -4.913  -8.504
   71   2HA   GLY   7          2HA       GLY   7  16.625  -5.985  -8.400
   72    H    ARG   8           H        ARG   8  14.807  -5.105  -5.474
   73    HA   ARG   8           HA       ARG   8  13.583  -7.743  -5.573
   74   1HB   ARG   8          1HB       ARG   8  14.679  -6.401  -3.052
   75   2HB   ARG   8          2HB       ARG   8  14.026  -8.023  -3.167
   76   1HG   ARG   8          1HG       ARG   8  16.090  -7.812  -5.154
   77   2HG   ARG   8          2HG       ARG   8  16.735  -7.125  -3.677
   78   1HD   ARG   8          1HD       ARG   8  16.007  -9.201  -2.431
   79   2HD   ARG   8          2HD       ARG   8  15.456  -9.890  -3.946
   80    HE   ARG   8           HE       ARG   8  18.187  -9.019  -4.226
   81   1HH1  ARG   8          2HH2      ARG   8  16.253 -11.548  -2.726
   82   2HH1  ARG   8          1HH2      ARG   8  17.533 -12.715  -2.744
   83   1HH2  ARG   8          2HH1      ARG   8  19.876 -10.558  -4.251
   84   2HH2  ARG   8          1HH1      ARG   8  19.608 -12.148  -3.618
   85    H    ARG   9           H        ARG   9  11.540  -7.921  -4.303
   86    HA   ARG   9           HA       ARG   9  10.252  -5.330  -4.192
   87   1HB   ARG   9          1HB       ARG   9   9.085  -6.917  -5.612
   88   2HB   ARG   9          2HB       ARG   9   9.186  -8.181  -4.403
   89   1HG   ARG   9          1HG       ARG   9   7.840  -5.712  -3.441
   90   2HG   ARG   9          2HG       ARG   9   7.009  -6.494  -4.771
   91   1HD   ARG   9          1HD       ARG   9   7.911  -8.485  -2.818
   92   2HD   ARG   9          2HD       ARG   9   6.946  -7.251  -2.031
   93    HE   ARG   9           HE       ARG   9   5.625  -7.999  -4.454
   94   1HH1  ARG   9          2HH2      ARG   9   6.411  -9.345  -1.299
   95   2HH1  ARG   9          1HH2      ARG   9   5.049 -10.414  -1.274
   96   1HH2  ARG   9          2HH1      ARG   9   3.828  -9.409  -4.421
   97   2HH2  ARG   9          1HH1      ARG   9   3.570 -10.452  -3.062
   98    H    ILE  10           H        ILE  10   9.265  -4.562  -2.270
   99    HA   ILE  10           HA       ILE  10   9.327  -6.357   0.034
  100    HB   ILE  10           HB       ILE  10  10.230  -3.549   0.430
  101   1HG1  ILE  10          2HG1      ILE  10  11.567  -4.335  -1.497
  102   2HG1  ILE  10          3HG1      ILE  10  12.531  -4.050  -0.061
  103   1HG2  ILE  10          1HG2      ILE  10  10.809  -4.286   2.456
  104   2HG2  ILE  10          2HG2      ILE  10   9.836  -5.726   2.071
  105   3HG2  ILE  10          3HG2      ILE  10  11.596  -5.744   1.804
  106   1HD1  ILE  10          1HD1      ILE  10  11.588  -6.791  -0.018
  107   2HD1  ILE  10          2HD1      ILE  10  12.352  -6.452  -1.589
  108   3HD1  ILE  10          3HD1      ILE  10  13.262  -6.190  -0.081
  109    H    ARG  11           H        ARG  11   7.911  -5.569   1.821
  110    HA   ARG  11           HA       ARG  11   5.757  -3.998   0.657
  111   1HB   ARG  11          1HB       ARG  11   5.469  -6.516   1.473
  112   2HB   ARG  11          2HB       ARG  11   5.406  -5.804   3.073
  113   1HG   ARG  11          1HG       ARG  11   3.430  -4.569   2.592
  114   2HG   ARG  11          2HG       ARG  11   3.663  -4.681   0.858
  115   1HD   ARG  11          1HD       ARG  11   2.154  -6.397   0.952
  116   2HD   ARG  11          2HD       ARG  11   3.496  -7.360   1.540
  117    HE   ARG  11           HE       ARG  11   2.318  -5.945   3.747
  118   1HH1  ARG  11          2HH2      ARG  11   1.655  -8.617   1.556
  119   2HH1  ARG  11          1HH2      ARG  11   0.631  -9.451   2.677
  120   1HH2  ARG  11          2HH1      ARG  11   0.968  -7.045   5.228
  121   2HH2  ARG  11          1HH1      ARG  11   0.238  -8.550   4.780
  122    H    ILE  12           H        ILE  12   4.907  -2.227   1.855
  123    HA   ILE  12           HA       ILE  12   5.569  -1.826   4.580
  124    HB   ILE  12           HB       ILE  12   7.723  -1.308   3.256
  125   1HG1  ILE  12          2HG1      ILE  12   7.609   1.034   4.777
  126   2HG1  ILE  12          3HG1      ILE  12   6.462  -0.038   5.556
  127   1HG2  ILE  12          1HG2      ILE  12   6.380   1.354   2.804
  128   2HG2  ILE  12          2HG2      ILE  12   7.931   0.756   2.170
  129   3HG2  ILE  12          3HG2      ILE  12   6.401   0.084   1.557
  130   1HD1  ILE  12          1HD1      ILE  12   9.422  -0.289   5.300
  131   2HD1  ILE  12          2HD1      ILE  12   8.341  -0.848   6.598
  132   3HD1  ILE  12          3HD1      ILE  12   8.506  -1.802   5.104
  133    HA   PRO  13           HA       PRO  13   2.404   1.129   4.649
  134   1HB   PRO  13          1HB       PRO  13   1.829  -0.134   6.514
  135   2HB   PRO  13          2HB       PRO  13   0.333  -0.378   5.595
  136   1HG   PRO  13          1HG       PRO  13   1.656  -2.582   6.433
  137   2HG   PRO  13          2HG       PRO  13   1.101  -2.540   4.741
  138   1HD   PRO  13          1HD       PRO  13   3.931  -2.111   5.796
  139   2HD   PRO  13          2HD       PRO  13   3.398  -2.925   4.292
  140    HA   PRO  14           HA       PRO  14  -0.804   1.476   1.679
  141   1HB   PRO  14          1HB       PRO  14   0.208   3.617   0.221
  142   2HB   PRO  14          2HB       PRO  14  -0.393   3.724   1.881
  143   1HG   PRO  14          1HG       PRO  14   2.528   3.440   0.984
  144   2HG   PRO  14          2HG       PRO  14   1.857   4.614   2.137
  145   1HD   PRO  14          1HD       PRO  14   3.076   2.274   3.001
  146   2HD   PRO  14          2HD       PRO  14   1.669   2.937   3.882
  Start of MODEL    3
    1   1H    ARG   1          H         ARG   1   2.201   0.317   0.750
    2    HA   ARG   1           HA       ARG   1   1.374  -0.568  -1.837
    3   1HB   ARG   1          1HB       ARG   1   2.962   1.971  -1.388
    4   2HB   ARG   1          2HB       ARG   1   3.346   0.989  -2.789
    5   1HG   ARG   1          1HG       ARG   1   0.578   1.063  -2.923
    6   2HG   ARG   1          2HG       ARG   1   0.929   2.638  -2.238
    7   1HD   ARG   1          1HD       ARG   1   2.249   1.532  -4.766
    8   2HD   ARG   1          2HD       ARG   1   0.879   2.625  -4.768
    9    HE   ARG   1           HE       ARG   1   3.663   3.314  -4.158
   10   1HH1  ARG   1          2HH2      ARG   1   0.300   4.279  -3.784
   11   2HH1  ARG   1          1HH2      ARG   1   0.675   5.951  -3.525
   12   1HH2  ARG   1          2HH1      ARG   1   4.159   5.518  -3.818
   13   2HH2  ARG   1          1HH1      ARG   1   2.885   6.660  -3.545
   14    H    VAL   2           H        VAL   2   3.431  -1.392  -3.102
   15    HA   VAL   2           HA       VAL   2   5.405  -2.334  -1.139
   16    HB   VAL   2           HB       VAL   2   4.128  -3.810  -3.448
   17   1HG1  VAL   2          1HG1      VAL   2   6.710  -4.123  -2.829
   18   2HG1  VAL   2          2HG1      VAL   2   6.010  -5.169  -1.570
   19   3HG1  VAL   2          3HG1      VAL   2   5.668  -5.492  -3.287
   20   1HG2  VAL   2          1HG2      VAL   2   4.012  -4.215  -0.442
   21   2HG2  VAL   2          2HG2      VAL   2   2.675  -3.755  -1.524
   22   3HG2  VAL   2          3HG2      VAL   2   3.396  -5.378  -1.641
   23    H    ARG   3           H        ARG   3   7.076  -0.913  -1.550
   24    HA   ARG   3           HA       ARG   3   7.615  -0.007  -4.135
   25   1HB   ARG   3          1HB       ARG   3   9.481   1.136  -3.142
   26   2HB   ARG   3          2HB       ARG   3   8.254   1.093  -1.892
   27   1HG   ARG   3          1HG       ARG   3   9.523  -1.264  -1.345
   28   2HG   ARG   3          2HG       ARG   3  10.861  -0.378  -2.047
   29   1HD   ARG   3          1HD       ARG   3  10.516   1.482  -0.437
   30   2HD   ARG   3          2HD       ARG   3   9.113   0.673   0.231
   31    HE   ARG   3           HE       ARG   3  11.428  -1.069   0.309
   32   1HH1  ARG   3          2HH2      ARG   3   9.948   1.682   1.930
   33   2HH1  ARG   3          1HH2      ARG   3  10.707   1.355   3.452
   34   1HH2  ARG   3          2HH1      ARG   3  12.428  -1.500   2.316
   35   2HH2  ARG   3          1HH1      ARG   3  12.128  -0.467   3.673
   36    H    THR   4           H        THR   4  10.438  -0.228  -4.420
   37    HA   THR   4           HA       THR   4  11.163  -3.014  -4.261
   38    HB   THR   4           HB       THR   4  11.011  -1.744  -7.025
   39    HG1  THR   4           1HG      THR   4   8.934  -2.989  -7.076
   40   1HG2  THR   4          1HG2      THR   4  12.324  -3.916  -6.601
   41   2HG2  THR   4          2HG2      THR   4  10.780  -4.654  -6.111
   42   3HG2  THR   4          3HG2      THR   4  10.994  -4.061  -7.776
   43    H    ARG   5           H        ARG   5  13.383  -3.360  -4.414
   44    HA   ARG   5           HA       ARG   5  15.044  -1.264  -5.319
   45   1HB   ARG   5          1HB       ARG   5  14.323  -0.612  -2.895
   46   2HB   ARG   5          2HB       ARG   5  15.308  -1.958  -2.360
   47   1HG   ARG   5          1HG       ARG   5  16.596   0.164  -2.310
   48   2HG   ARG   5          2HG       ARG   5  17.307  -0.977  -3.434
   49   1HD   ARG   5          1HD       ARG   5  15.286   0.651  -4.789
   50   2HD   ARG   5          2HD       ARG   5  16.462   1.679  -3.996
   51    HE   ARG   5           HE       ARG   5  18.090  -0.147  -5.215
   52   1HH1  ARG   5          2HH2      ARG   5  15.362   1.719  -6.422
   53   2HH1  ARG   5          1HH2      ARG   5  15.959   1.783  -8.046
   54   1HH2  ARG   5          2HH1      ARG   5  18.879  -0.064  -7.358
   55   2HH2  ARG   5          1HH1      ARG   5  17.973   0.762  -8.583
   56    H    LYS   6           H        LYS   6  17.421  -1.925  -5.133
   57    HA   LYS   6           HA       LYS   6  18.952  -3.454  -5.623
   58   1HB   LYS   6          1HB       LYS   6  17.751  -4.501  -3.062
   59   2HB   LYS   6          2HB       LYS   6  19.091  -5.329  -3.832
   60   1HG   LYS   6          1HG       LYS   6  20.597  -3.640  -3.357
   61   2HG   LYS   6          2HG       LYS   6  19.413  -2.369  -3.584
   62   1HD   LYS   6          1HD       LYS   6  18.823  -2.348  -1.371
   63   2HD   LYS   6          2HD       LYS   6  18.808  -4.096  -1.257
   64   1HE   LYS   6          1HE       LYS   6  21.510  -3.645  -1.541
   65   2HE   LYS   6          2HE       LYS   6  21.033  -2.179  -0.708
   66   1HZ   LYS   6          1HZ       LYS   6  19.965  -3.561   0.958
   67   2HZ   LYS   6          2HZ       LYS   6  20.454  -4.917   0.190
   68   3HZ   LYS   6          3HZ       LYS   6  21.557  -3.905   0.842
   69    H    GLY   7           H        GLY   7  16.337  -3.695  -6.992
   70   1HA   GLY   7          1HA       GLY   7  15.404  -5.084  -8.494
   71   2HA   GLY   7          2HA       GLY   7  16.783  -6.148  -8.307
   72    H    ARG   8           H        ARG   8  14.782  -5.187  -5.516
   73    HA   ARG   8           HA       ARG   8  13.546  -7.814  -5.618
   74   1HB   ARG   8          1HB       ARG   8  14.785  -6.498  -3.148
   75   2HB   ARG   8          2HB       ARG   8  13.875  -7.996  -3.125
   76   1HG   ARG   8          1HG       ARG   8  15.579  -9.220  -4.123
   77   2HG   ARG   8          2HG       ARG   8  16.147  -7.866  -5.079
   78   1HD   ARG   8          1HD       ARG   8  17.840  -7.667  -3.569
   79   2HD   ARG   8          2HD       ARG   8  16.650  -7.013  -2.461
   80    HE   ARG   8           HE       ARG   8  16.770  -8.993  -1.232
   81   1HH1  ARG   8          2HH2      ARG   8  17.934  -9.619  -4.493
   82   2HH1  ARG   8          1HH2      ARG   8  18.416 -11.247  -4.146
   83   1HH2  ARG   8          2HH1      ARG   8  17.405 -11.140  -0.774
   84   2HH2  ARG   8          1HH1      ARG   8  18.113 -12.118  -2.016
   85    H    ARG   9           H        ARG   9  11.535  -7.940  -4.198
   86    HA   ARG   9           HA       ARG   9  10.264  -5.338  -4.229
   87   1HB   ARG   9          1HB       ARG   9   9.050  -7.007  -5.508
   88   2HB   ARG   9          2HB       ARG   9   9.175  -8.189  -4.221
   89   1HG   ARG   9          1HG       ARG   9   7.884  -5.678  -3.337
   90   2HG   ARG   9          2HG       ARG   9   7.019  -6.453  -4.650
   91   1HD   ARG   9          1HD       ARG   9   7.939  -8.025  -2.206
   92   2HD   ARG   9          2HD       ARG   9   6.410  -7.169  -2.221
   93    HE   ARG   9           HE       ARG   9   6.701  -8.836  -4.582
   94   1HH1  ARG   9          2HH2      ARG   9   5.887  -8.926  -1.160
   95   2HH1  ARG   9          1HH2      ARG   9   4.918 -10.355  -1.297
   96   1HH2  ARG   9          2HH1      ARG   9   5.423 -10.722  -4.763
   97   2HH2  ARG   9          1HH1      ARG   9   4.653 -11.384  -3.361
   98    H    ILE  10           H        ILE  10   9.377  -4.422  -2.332
   99    HA   ILE  10           HA       ILE  10   9.509  -6.064   0.086
  100    HB   ILE  10           HB       ILE  10  10.231  -3.386   0.730
  101   1HG1  ILE  10          2HG1      ILE  10  11.015  -3.339  -1.667
  102   2HG1  ILE  10          3HG1      ILE  10  12.240  -3.007  -0.458
  103   1HG2  ILE  10          1HG2      ILE  10  11.408  -6.131   1.010
  104   2HG2  ILE  10          2HG2      ILE  10  12.382  -4.702   1.432
  105   3HG2  ILE  10          3HG2      ILE  10  10.834  -5.000   2.259
  106   1HD1  ILE  10          1HD1      ILE  10  12.222  -5.845  -0.829
  107   2HD1  ILE  10          2HD1      ILE  10  12.194  -5.104  -2.448
  108   3HD1  ILE  10          3HD1      ILE  10  13.491  -4.691  -1.303
  109    H    ARG  11           H        ARG  11   7.889  -5.616   1.620
  110    HA   ARG  11           HA       ARG  11   5.805  -3.919   0.530
  111   1HB   ARG  11          1HB       ARG  11   5.286  -6.352   1.024
  112   2HB   ARG  11          2HB       ARG  11   5.620  -6.051   2.718
  113   1HG   ARG  11          1HG       ARG  11   3.804  -4.005   1.974
  114   2HG   ARG  11          2HG       ARG  11   3.204  -5.443   1.172
  115   1HD   ARG  11          1HD       ARG  11   3.177  -6.683   3.308
  116   2HD   ARG  11          2HD       ARG  11   3.922  -5.333   4.141
  117    HE   ARG  11           HE       ARG  11   1.661  -4.201   3.010
  118   1HH1  ARG  11          2HH2      ARG  11   2.217  -6.988   5.084
  119   2HH1  ARG  11          1HH2      ARG  11   0.669  -6.886   5.855
  120   1HH2  ARG  11          2HH1      ARG  11  -0.382  -4.065   4.025
  121   2HH2  ARG  11          1HH1      ARG  11  -0.821  -5.213   5.247
  122    H    ILE  12           H        ILE  12   4.815  -2.277   1.847
  123    HA   ILE  12           HA       ILE  12   5.417  -1.977   4.579
  124    HB   ILE  12           HB       ILE  12   7.603  -1.360   3.290
  125   1HG1  ILE  12          2HG1      ILE  12   6.823   0.737   5.264
  126   2HG1  ILE  12          3HG1      ILE  12   6.725  -0.934   5.784
  127   1HG2  ILE  12          1HG2      ILE  12   6.252   0.222   1.776
  128   2HG2  ILE  12          2HG2      ILE  12   6.270   1.338   3.162
  129   3HG2  ILE  12          3HG2      ILE  12   7.803   0.801   2.432
  130   1HD1  ILE  12          1HD1      ILE  12   9.015   0.529   5.911
  131   2HD1  ILE  12          2HD1      ILE  12   9.008  -1.240   5.716
  132   3HD1  ILE  12          3HD1      ILE  12   9.210  -0.189   4.294
  133    HA   PRO  13           HA       PRO  13   2.307   1.054   4.714
  134   1HB   PRO  13          1HB       PRO  13   1.715  -0.220   6.564
  135   2HB   PRO  13          2HB       PRO  13   0.223  -0.446   5.637
  136   1HG   PRO  13          1HG       PRO  13   1.527  -2.666   6.464
  137   2HG   PRO  13          2HG       PRO  13   0.982  -2.607   4.769
  138   1HD   PRO  13          1HD       PRO  13   3.808  -2.205   5.844
  139   2HD   PRO  13          2HD       PRO  13   3.279  -3.003   4.331
  140    HA   PRO  14           HA       PRO  14  -0.893   1.470   1.745
  141   1HB   PRO  14          1HB       PRO  14   0.169   3.574   0.271
  142   2HB   PRO  14          2HB       PRO  14  -0.430   3.708   1.930
  143   1HG   PRO  14          1HG       PRO  14   2.485   3.348   1.035
  144   2HG   PRO  14          2HG       PRO  14   1.841   4.547   2.180
  145   1HD   PRO  14          1HD       PRO  14   3.005   2.186   3.060
  146   2HD   PRO  14          2HD       PRO  14   1.614   2.888   3.936
  Start of MODEL    4
    1   1H    ARG   1          H         ARG   1   1.969   0.071   0.978
    2    HA   ARG   1           HA       ARG   1   1.811   0.392  -1.908
    3   1HB   ARG   1          1HB       ARG   1   2.278   2.577  -0.653
    4   2HB   ARG   1          2HB       ARG   1   3.774   1.866  -0.082
    5   1HG   ARG   1          1HG       ARG   1   4.715   2.696  -1.984
    6   2HG   ARG   1          2HG       ARG   1   3.924   1.370  -2.813
    7   1HD   ARG   1          1HD       ARG   1   2.899   3.000  -4.048
    8   2HD   ARG   1          2HD       ARG   1   1.853   3.199  -2.657
    9    HE   ARG   1           HE       ARG   1   4.269   4.736  -2.295
   10   1HH1  ARG   1          2HH2      ARG   1   1.241   4.734  -4.087
   11   2HH1  ARG   1          1HH2      ARG   1   1.192   6.457  -4.257
   12   1HH2  ARG   1          2HH1      ARG   1   4.206   7.008  -2.519
   13   2HH2  ARG   1          1HH1      ARG   1   2.891   7.760  -3.360
   14    H    VAL   2           H        VAL   2   3.322  -0.839  -3.077
   15    HA   VAL   2           HA       VAL   2   5.339  -2.238  -1.460
   16    HB   VAL   2           HB       VAL   2   3.377  -3.630  -2.151
   17   1HG1  VAL   2          1HG1      VAL   2   3.369  -2.356  -4.484
   18   2HG1  VAL   2          2HG1      VAL   2   4.436  -3.703  -4.949
   19   3HG1  VAL   2          3HG1      VAL   2   2.799  -4.035  -4.334
   20   1HG2  VAL   2          1HG2      VAL   2   4.881  -5.440  -3.256
   21   2HG2  VAL   2          2HG2      VAL   2   6.194  -4.261  -3.019
   22   3HG2  VAL   2          3HG2      VAL   2   5.280  -4.870  -1.617
   23    H    ARG   3           H        ARG   3   7.142  -1.013  -1.929
   24    HA   ARG   3           HA       ARG   3   7.517  -0.165  -4.637
   25   1HB   ARG   3          1HB       ARG   3   8.380   0.723  -2.057
   26   2HB   ARG   3          2HB       ARG   3   9.838   0.259  -2.912
   27   1HG   ARG   3          1HG       ARG   3   9.186   1.704  -4.838
   28   2HG   ARG   3          2HG       ARG   3   7.703   2.146  -4.016
   29   1HD   ARG   3          1HD       ARG   3   8.944   3.254  -2.217
   30   2HD   ARG   3          2HD       ARG   3  10.471   2.648  -2.827
   31    HE   ARG   3           HE       ARG   3   9.048   4.182  -4.849
   32   1HH1  ARG   3          2HH2      ARG   3  11.107   4.475  -2.010
   33   2HH1  ARG   3          1HH2      ARG   3  11.730   6.026  -2.464
   34   1HH2  ARG   3          2HH1      ARG   3   9.870   6.229  -5.449
   35   2HH2  ARG   3          1HH1      ARG   3  11.021   7.030  -4.433
   36    H    THR   4           H        THR   4  10.327  -0.313  -4.930
   37    HA   THR   4           HA       THR   4  11.086  -3.085  -4.486
   38    HB   THR   4           HB       THR   4  11.248  -1.994  -7.310
   39    HG1  THR   4           1HG      THR   4   9.028  -3.380  -5.978
   40   1HG2  THR   4          1HG2      THR   4  12.289  -4.207  -6.798
   41   2HG2  THR   4          2HG2      THR   4  10.749  -4.768  -6.105
   42   3HG2  THR   4          3HG2      THR   4  10.864  -4.411  -7.844
   43    H    ARG   5           H        ARG   5  13.273  -3.386  -4.282
   44    HA   ARG   5           HA       ARG   5  14.975  -1.239  -5.124
   45   1HB   ARG   5          1HB       ARG   5  14.411  -1.916  -2.234
   46   2HB   ARG   5          2HB       ARG   5  16.056  -1.482  -2.659
   47   1HG   ARG   5          1HG       ARG   5  15.251   0.650  -3.666
   48   2HG   ARG   5          2HG       ARG   5  13.594   0.213  -3.300
   49   1HD   ARG   5          1HD       ARG   5  15.236  -0.018  -0.892
   50   2HD   ARG   5          2HD       ARG   5  15.434   1.573  -1.600
   51    HE   ARG   5           HE       ARG   5  12.660   1.031  -1.652
   52   1HH1  ARG   5          2HH2      ARG   5  15.185   1.424   0.767
   53   2HH1  ARG   5          1HH2      ARG   5  14.104   2.015   1.985
   54   1HH2  ARG   5          2HH1      ARG   5  11.233   1.812  -0.047
   55   2HH2  ARG   5          1HH1      ARG   5  11.841   2.238   1.518
   56    H    LYS   6           H        LYS   6  17.329  -1.887  -4.984
   57    HA   LYS   6           HA       LYS   6  18.850  -3.386  -5.625
   58   1HB   LYS   6          1HB       LYS   6  17.843  -4.515  -3.006
   59   2HB   LYS   6          2HB       LYS   6  19.244  -5.165  -3.833
   60   1HG   LYS   6          1HG       LYS   6  20.564  -3.391  -3.250
   61   2HG   LYS   6          2HG       LYS   6  19.322  -2.218  -3.643
   62   1HD   LYS   6          1HD       LYS   6  18.165  -3.163  -1.424
   63   2HD   LYS   6          2HD       LYS   6  19.795  -3.679  -1.038
   64   1HE   LYS   6          1HE       LYS   6  19.362  -0.836  -1.981
   65   2HE   LYS   6          2HE       LYS   6  18.924  -1.251  -0.335
   66   1HZ   LYS   6          1HZ       LYS   6  21.384  -2.368  -0.759
   67   2HZ   LYS   6          2HZ       LYS   6  21.479  -0.879  -1.423
   68   3HZ   LYS   6          3HZ       LYS   6  21.048  -1.048   0.143
   69    H    GLY   7           H        GLY   7  16.581  -3.698  -7.176
   70   1HA   GLY   7          1HA       GLY   7  15.473  -5.157  -8.484
   71   2HA   GLY   7          2HA       GLY   7  16.900  -6.162  -8.337
   72    H    ARG   8           H        ARG   8  14.738  -5.191  -5.626
   73    HA   ARG   8           HA       ARG   8  13.717  -7.902  -5.600
   74   1HB   ARG   8          1HB       ARG   8  15.017  -6.442  -3.250
   75   2HB   ARG   8          2HB       ARG   8  14.016  -7.865  -3.040
   76   1HG   ARG   8          1HG       ARG   8  15.539  -9.254  -4.294
   77   2HG   ARG   8          2HG       ARG   8  16.401  -7.869  -4.932
   78   1HD   ARG   8          1HD       ARG   8  17.860  -8.499  -3.221
   79   2HD   ARG   8          2HD       ARG   8  16.868  -7.340  -2.359
   80    HE   ARG   8           HE       ARG   8  16.863 -10.260  -2.003
   81   1HH1  ARG   8          2HH2      ARG   8  15.134  -7.251  -1.428
   82   2HH1  ARG   8          1HH2      ARG   8  14.208  -7.886  -0.109
   83   1HH2  ARG   8          2HH1      ARG   8  15.642 -11.099  -0.263
   84   2HH2  ARG   8          1HH1      ARG   8  14.500 -10.089   0.559
   85    H    ARG   9           H        ARG   9  11.770  -8.077  -4.026
   86    HA   ARG   9           HA       ARG   9  10.302  -5.592  -4.248
   87   1HB   ARG   9          1HB       ARG   9   9.278  -7.606  -5.284
   88   2HB   ARG   9          2HB       ARG   9   9.355  -8.460  -3.756
   89   1HG   ARG   9          1HG       ARG   9   7.966  -5.820  -3.643
   90   2HG   ARG   9          2HG       ARG   9   7.167  -7.028  -4.630
   91   1HD   ARG   9          1HD       ARG   9   8.129  -7.663  -1.809
   92   2HD   ARG   9          2HD       ARG   9   6.554  -6.951  -2.102
   93    HE   ARG   9           HE       ARG   9   6.591  -9.104  -3.840
   94   1HH1  ARG   9          2HH2      ARG   9   7.173  -8.759  -0.386
   95   2HH1  ARG   9          1HH2      ARG   9   6.627 -10.358  -0.005
   96   1HH2  ARG   9          2HH1      ARG   9   5.870 -11.213  -3.337
   97   2HH2  ARG   9          1HH1      ARG   9   5.881 -11.763  -1.695
   98    H    ILE  10           H        ILE  10   9.137  -4.718  -2.406
   99    HA   ILE  10           HA       ILE  10   9.648  -6.019   0.152
  100    HB   ILE  10           HB       ILE  10  10.120  -3.079  -0.053
  101   1HG1  ILE  10          2HG1      ILE  10  12.634  -3.777  -0.234
  102   2HG1  ILE  10          3HG1      ILE  10  12.006  -5.231  -0.985
  103   1HG2  ILE  10          1HG2      ILE  10  11.890  -4.459   1.700
  104   2HG2  ILE  10          2HG2      ILE  10  10.565  -3.342   2.102
  105   3HG2  ILE  10          3HG2      ILE  10  10.246  -5.087   1.966
  106   1HD1  ILE  10          1HD1      ILE  10  12.124  -2.468  -2.039
  107   2HD1  ILE  10          2HD1      ILE  10  12.031  -4.015  -2.914
  108   3HD1  ILE  10          3HD1      ILE  10  10.548  -3.259  -2.284
  109    H    ARG  11           H        ARG  11   8.244  -5.078   1.905
  110    HA   ARG  11           HA       ARG  11   5.877  -3.879   0.713
  111   1HB   ARG  11          1HB       ARG  11   5.730  -6.416   1.347
  112   2HB   ARG  11          2HB       ARG  11   5.756  -5.875   3.014
  113   1HG   ARG  11          1HG       ARG  11   3.648  -4.891   2.886
  114   2HG   ARG  11          2HG       ARG  11   3.810  -4.497   1.186
  115   1HD   ARG  11          1HD       ARG  11   2.351  -6.265   0.931
  116   2HD   ARG  11          2HD       ARG  11   3.825  -7.211   0.979
  117    HE   ARG  11           HE       ARG  11   2.925  -6.776   3.668
  118   1HH1  ARG  11          2HH2      ARG  11   2.048  -8.574   0.772
  119   2HH1  ARG  11          1HH2      ARG  11   1.249  -9.839   1.646
  120   1HH2  ARG  11          2HH1      ARG  11   1.872  -8.444   4.820
  121   2HH2  ARG  11          1HH1      ARG  11   1.149  -9.765   3.963
  122    H    ILE  12           H        ILE  12   4.844  -2.260   1.994
  123    HA   ILE  12           HA       ILE  12   5.423  -1.912   4.731
  124    HB   ILE  12           HB       ILE  12   7.580  -1.202   3.491
  125   1HG1  ILE  12          2HG1      ILE  12   6.484   0.869   5.381
  126   2HG1  ILE  12          3HG1      ILE  12   6.762  -0.771   5.929
  127   1HG2  ILE  12          1HG2      ILE  12   6.155   1.427   3.187
  128   2HG2  ILE  12          2HG2      ILE  12   7.690   0.877   2.473
  129   3HG2  ILE  12          3HG2      ILE  12   6.146   0.229   1.871
  130   1HD1  ILE  12          1HD1      ILE  12   8.852   1.020   4.605
  131   2HD1  ILE  12          2HD1      ILE  12   8.747   0.654   6.345
  132   3HD1  ILE  12          3HD1      ILE  12   9.132  -0.640   5.185
  133    HA   PRO  13           HA       PRO  13   2.084   0.845   4.821
  134   1HB   PRO  13          1HB       PRO  13   1.520  -0.536   6.602
  135   2HB   PRO  13          2HB       PRO  13   0.075  -0.824   5.617
  136   1HG   PRO  13          1HG       PRO  13   1.499  -2.984   6.404
  137   2HG   PRO  13          2HG       PRO  13   1.003  -2.893   4.696
  138   1HD   PRO  13          1HD       PRO  13   3.761  -2.350   5.878
  139   2HD   PRO  13          2HD       PRO  13   3.334  -3.122   4.319
  140    HA   PRO  14           HA       PRO  14  -1.050   1.157   1.767
  141   1HB   PRO  14          1HB       PRO  14  -0.106   3.401   0.426
  142   2HB   PRO  14          2HB       PRO  14  -0.765   3.413   2.067
  143   1HG   PRO  14          1HG       PRO  14   2.195   3.314   1.260
  144   2HG   PRO  14          2HG       PRO  14   1.425   4.406   2.434
  145   1HD   PRO  14          1HD       PRO  14   2.738   2.101   3.250
  146   2HD   PRO  14          2HD       PRO  14   1.270   2.655   4.106
  Start of MODEL    5
    1   1H    ARG   1          H         ARG   1   1.884   0.000   0.829
    2    HA   ARG   1           HA       ARG   1   1.348  -0.289  -2.006
    3   1HB   ARG   1          1HB       ARG   1   2.963   1.864  -0.624
    4   2HB   ARG   1          2HB       ARG   1   3.515   1.298  -2.189
    5   1HG   ARG   1          1HG       ARG   1   0.784   1.643  -2.626
    6   2HG   ARG   1          2HG       ARG   1   1.142   2.945  -1.508
    7   1HD   ARG   1          1HD       ARG   1   3.269   2.827  -3.473
    8   2HD   ARG   1          2HD       ARG   1   1.736   2.813  -4.322
    9    HE   ARG   1           HE       ARG   1   1.447   4.803  -2.372
   10   1HH1  ARG   1          2HH2      ARG   1   3.649   4.195  -5.050
   11   2HH1  ARG   1          1HH2      ARG   1   3.960   5.873  -5.342
   12   1HH2  ARG   1          2HH1      ARG   1   1.858   7.017  -2.758
   13   2HH2  ARG   1          1HH1      ARG   1   2.934   7.490  -4.030
   14    H    VAL   2           H        VAL   2   3.470  -0.940  -3.215
   15    HA   VAL   2           HA       VAL   2   5.205  -2.467  -1.404
   16    HB   VAL   2           HB       VAL   2   3.811  -3.331  -3.930
   17   1HG1  VAL   2          1HG1      VAL   2   5.660  -4.422  -4.564
   18   2HG1  VAL   2          2HG1      VAL   2   6.496  -4.045  -3.039
   19   3HG1  VAL   2          3HG1      VAL   2   5.425  -5.463  -3.140
   20   1HG2  VAL   2          1HG2      VAL   2   3.989  -5.242  -1.741
   21   2HG2  VAL   2          2HG2      VAL   2   3.259  -3.706  -1.216
   22   3HG2  VAL   2          3HG2      VAL   2   2.558  -4.603  -2.584
   23    H    ARG   3           H        ARG   3   7.027  -1.200  -1.444
   24    HA   ARG   3           HA       ARG   3   7.768   0.156  -3.797
   25   1HB   ARG   3          1HB       ARG   3   9.796   0.793  -2.487
   26   2HB   ARG   3          2HB       ARG   3   8.333   1.034  -1.552
   27   1HG   ARG   3          1HG       ARG   3   8.899  -0.568  -0.016
   28   2HG   ARG   3          2HG       ARG   3   9.455  -1.688  -1.243
   29   1HD   ARG   3          1HD       ARG   3  11.641  -0.800  -1.268
   30   2HD   ARG   3          2HD       ARG   3  11.127   0.768  -0.680
   31    HE   ARG   3           HE       ARG   3  10.639  -1.344   1.270
   32   1HH1  ARG   3          2HH2      ARG   3  13.088   0.836  -0.008
   33   2HH1  ARG   3          1HH2      ARG   3  14.043   0.815   1.436
   34   1HH2  ARG   3          2HH1      ARG   3  11.899  -1.371   3.177
   35   2HH2  ARG   3          1HH1      ARG   3  13.362  -0.449   3.260
   36    H    THR   4           H        THR   4  10.560  -0.169  -3.997
   37    HA   THR   4           HA       THR   4  11.188  -2.971  -4.200
   38    HB   THR   4           HB       THR   4  11.152  -1.334  -6.772
   39    HG1  THR   4           1HG      THR   4   8.975  -1.748  -6.781
   40   1HG2  THR   4          1HG2      THR   4  10.861  -4.338  -6.282
   41   2HG2  THR   4          2HG2      THR   4  11.144  -3.521  -7.838
   42   3HG2  THR   4          3HG2      THR   4  12.431  -3.564  -6.608
   43    H    ARG   5           H        ARG   5  13.409  -3.373  -4.384
   44    HA   ARG   5           HA       ARG   5  15.149  -1.211  -4.910
   45   1HB   ARG   5          1HB       ARG   5  14.598  -0.673  -2.555
   46   2HB   ARG   5          2HB       ARG   5  14.973  -2.312  -2.060
   47   1HG   ARG   5          1HG       ARG   5  17.293  -2.020  -2.338
   48   2HG   ARG   5          2HG       ARG   5  17.101  -0.737  -3.516
   49   1HD   ARG   5          1HD       ARG   5  17.040   0.888  -1.906
   50   2HD   ARG   5          2HD       ARG   5  15.928  -0.022  -0.902
   51    HE   ARG   5           HE       ARG   5  17.754  -0.692   0.376
   52   1HH1  ARG   5          2HH2      ARG   5  18.885   0.024  -2.879
   53   2HH1  ARG   5          1HH2      ARG   5  20.549  -0.281  -2.505
   54   1HH2  ARG   5          2HH1      ARG   5  19.948  -1.093   0.870
   55   2HH2  ARG   5          1HH1      ARG   5  21.158  -0.921  -0.359
   56    H    LYS   6           H        LYS   6  17.443  -1.960  -5.001
   57    HA   LYS   6           HA       LYS   6  18.873  -3.468  -5.802
   58   1HB   LYS   6          1HB       LYS   6  18.487  -3.810  -3.090
   59   2HB   LYS   6          2HB       LYS   6  18.340  -5.448  -3.695
   60   1HG   LYS   6          1HG       LYS   6  20.591  -3.823  -4.830
   61   2HG   LYS   6          2HG       LYS   6  20.737  -4.266  -3.141
   62   1HD   LYS   6          1HD       LYS   6  19.821  -6.541  -4.760
   63   2HD   LYS   6          2HD       LYS   6  21.331  -5.896  -5.371
   64   1HE   LYS   6          1HE       LYS   6  21.130  -6.230  -2.392
   65   2HE   LYS   6          2HE       LYS   6  21.208  -7.703  -3.338
   66   1HZ   LYS   6          1HZ       LYS   6  23.343  -6.426  -2.611
   67   2HZ   LYS   6          2HZ       LYS   6  23.285  -7.225  -4.034
   68   3HZ   LYS   6          3HZ       LYS   6  23.088  -5.604  -3.998
   69    H    GLY   7           H        GLY   7  16.460  -3.599  -7.197
   70   1HA   GLY   7          1HA       GLY   7  15.246  -4.929  -8.543
   71   2HA   GLY   7          2HA       GLY   7  16.636  -5.997  -8.539
   72    H    ARG   8           H        ARG   8  14.704  -5.123  -5.634
   73    HA   ARG   8           HA       ARG   8  13.645  -7.829  -5.686
   74   1HB   ARG   8          1HB       ARG   8  14.863  -6.367  -3.289
   75   2HB   ARG   8          2HB       ARG   8  13.966  -7.866  -3.154
   76   1HG   ARG   8          1HG       ARG   8  15.928  -8.233  -5.228
   77   2HG   ARG   8          2HG       ARG   8  16.745  -7.490  -3.867
   78   1HD   ARG   8          1HD       ARG   8  14.885  -9.645  -3.047
   79   2HD   ARG   8          2HD       ARG   8  16.150 -10.211  -4.119
   80    HE   ARG   8           HE       ARG   8  17.210  -8.485  -2.029
   81   1HH1  ARG   8          2HH2      ARG   8  16.155 -11.770  -2.719
   82   2HH1  ARG   8          1HH2      ARG   8  17.125 -12.480  -1.472
   83   1HH2  ARG   8          2HH1      ARG   8  18.491  -9.421  -0.385
   84   2HH2  ARG   8          1HH1      ARG   8  18.463 -11.135  -0.136
   85    H    ARG   9           H        ARG   9  11.688  -8.060  -4.154
   86    HA   ARG   9           HA       ARG   9  10.228  -5.552  -4.245
   87   1HB   ARG   9          1HB       ARG   9   9.170  -7.352  -5.531
   88   2HB   ARG   9          2HB       ARG   9   9.289  -8.460  -4.179
   89   1HG   ARG   9          1HG       ARG   9   7.805  -5.869  -3.747
   90   2HG   ARG   9          2HG       ARG   9   7.021  -7.109  -4.707
   91   1HD   ARG   9          1HD       ARG   9   7.946  -8.610  -2.575
   92   2HD   ARG   9          2HD       ARG   9   7.628  -7.077  -1.786
   93    HE   ARG   9           HE       ARG   9   5.377  -7.580  -3.406
   94   1HH1  ARG   9          2HH2      ARG   9   6.994  -9.134  -0.694
   95   2HH1  ARG   9          1HH2      ARG   9   5.546  -9.863  -0.084
   96   1HH2  ARG   9          2HH1      ARG   9   3.467  -8.542  -2.601
   97   2HH2  ARG   9          1HH1      ARG   9   3.526  -9.524  -1.176
   98    H    ILE  10           H        ILE  10   9.159  -4.762  -2.356
   99    HA   ILE  10           HA       ILE  10   9.376  -6.384   0.053
  100    HB   ILE  10           HB       ILE  10  10.306  -3.526   0.070
  101   1HG1  ILE  10          2HG1      ILE  10  11.710  -4.865  -1.514
  102   2HG1  ILE  10          3HG1      ILE  10  12.577  -4.197  -0.146
  103   1HG2  ILE  10          1HG2      ILE  10  10.062  -5.732   2.016
  104   2HG2  ILE  10          2HG2      ILE  10  11.588  -4.819   2.083
  105   3HG2  ILE  10          3HG2      ILE  10  10.034  -3.969   2.256
  106   1HD1  ILE  10          1HD1      ILE  10  13.101  -6.257   0.681
  107   2HD1  ILE  10          2HD1      ILE  10  11.458  -6.882   0.401
  108   3HD1  ILE  10          3HD1      ILE  10  12.640  -6.858  -0.930
  109    H    ARG  11           H        ARG  11   8.092  -5.287   1.893
  110    HA   ARG  11           HA       ARG  11   5.828  -3.936   0.656
  111   1HB   ARG  11          1HB       ARG  11   5.658  -6.408   1.703
  112   2HB   ARG  11          2HB       ARG  11   5.523  -5.527   3.212
  113   1HG   ARG  11          1HG       ARG  11   3.675  -4.122   2.040
  114   2HG   ARG  11          2HG       ARG  11   3.696  -5.341   0.782
  115   1HD   ARG  11          1HD       ARG  11   3.428  -7.056   2.783
  116   2HD   ARG  11          2HD       ARG  11   2.903  -5.654   3.695
  117    HE   ARG  11           HE       ARG  11   1.437  -5.536   1.314
  118   1HH1  ARG  11          2HH2      ARG  11   1.834  -7.872   3.915
  119   2HH1  ARG  11          1HH2      ARG  11   0.244  -8.535   3.735
  120   1HH2  ARG  11          2HH1      ARG  11  -0.662  -6.409   1.076
  121   2HH2  ARG  11          1HH1      ARG  11  -1.185  -7.697   2.110
  122    H    ILE  12           H        ILE  12   4.970  -2.106   1.762
  123    HA   ILE  12           HA       ILE  12   5.775  -1.509   4.428
  124    HB   ILE  12           HB       ILE  12   7.789  -0.953   2.940
  125   1HG1  ILE  12          2HG1      ILE  12   6.967   1.471   4.469
  126   2HG1  ILE  12          3HG1      ILE  12   6.993  -0.050   5.339
  127   1HG2  ILE  12          1HG2      ILE  12   6.076   0.275   1.315
  128   2HG2  ILE  12          2HG2      ILE  12   6.461   1.654   2.371
  129   3HG2  ILE  12          3HG2      ILE  12   7.764   0.809   1.501
  130   1HD1  ILE  12          1HD1      ILE  12   9.320  -0.417   4.852
  131   2HD1  ILE  12          2HD1      ILE  12   9.334   0.868   3.620
  132   3HD1  ILE  12          3HD1      ILE  12   9.184   1.289   5.343
  133    HA   PRO  13           HA       PRO  13   2.380   1.172   4.526
  134   1HB   PRO  13          1HB       PRO  13   2.037  -0.019   6.492
  135   2HB   PRO  13          2HB       PRO  13   0.504  -0.425   5.701
  136   1HG   PRO  13          1HG       PRO  13   2.049  -2.474   6.552
  137   2HG   PRO  13          2HG       PRO  13   1.376  -2.570   4.907
  138   1HD   PRO  13          1HD       PRO  13   4.230  -1.875   5.725
  139   2HD   PRO  13          2HD       PRO  13   3.658  -2.811   4.309
  140    HA   PRO  14           HA       PRO  14  -1.076   1.107   1.818
  141   1HB   PRO  14          1HB       PRO  14  -0.354   3.234   0.178
  142   2HB   PRO  14          2HB       PRO  14  -0.840   3.388   1.872
  143   1HG   PRO  14          1HG       PRO  14   2.022   3.284   0.767
  144   2HG   PRO  14          2HG       PRO  14   1.342   4.466   1.907
  145   1HD   PRO  14          1HD       PRO  14   2.811   2.284   2.792
  146   2HD   PRO  14          2HD       PRO  14   1.422   2.883   3.745
  Start of MODEL    6
    1   1H    ARG   1          H         ARG   1   1.957  -0.050   0.800
    2    HA   ARG   1           HA       ARG   1   1.322  -0.491  -1.992
    3   1HB   ARG   1          1HB       ARG   1   2.127   2.007  -1.011
    4   2HB   ARG   1          2HB       ARG   1   3.638   1.313  -1.566
    5   1HG   ARG   1          1HG       ARG   1   2.580   0.823  -3.791
    6   2HG   ARG   1          2HG       ARG   1   1.087   1.550  -3.233
    7   1HD   ARG   1          1HD       ARG   1   2.371   3.710  -2.810
    8   2HD   ARG   1          2HD       ARG   1   3.780   2.964  -3.537
    9    HE   ARG   1           HE       ARG   1   1.446   2.756  -5.264
   10   1HH1  ARG   1          2HH2      ARG   1   4.019   4.925  -4.237
   11   2HH1  ARG   1          1HH2      ARG   1   3.977   5.870  -5.689
   12   1HH2  ARG   1          2HH1      ARG   1   1.389   4.002  -7.179
   13   2HH2  ARG   1          1HH1      ARG   1   2.470   5.341  -7.373
   14    H    VAL   2           H        VAL   2   3.478  -1.048  -3.248
   15    HA   VAL   2           HA       VAL   2   5.288  -2.477  -1.429
   16    HB   VAL   2           HB       VAL   2   3.629  -3.968  -2.530
   17   1HG1  VAL   2          1HG1      VAL   2   3.434  -4.227  -4.817
   18   2HG1  VAL   2          2HG1      VAL   2   3.740  -2.478  -4.702
   19   3HG1  VAL   2          3HG1      VAL   2   5.062  -3.587  -5.141
   20   1HG2  VAL   2          1HG2      VAL   2   5.505  -5.143  -1.881
   21   2HG2  VAL   2          2HG2      VAL   2   5.508  -5.454  -3.634
   22   3HG2  VAL   2          3HG2      VAL   2   6.590  -4.219  -2.947
   23    H    ARG   3           H        ARG   3   7.078  -1.177  -1.485
   24    HA   ARG   3           HA       ARG   3   7.746   0.259  -3.798
   25   1HB   ARG   3          1HB       ARG   3   8.636   0.067  -1.044
   26   2HB   ARG   3          2HB       ARG   3  10.045  -0.026  -2.080
   27   1HG   ARG   3          1HG       ARG   3   8.599   2.022  -3.282
   28   2HG   ARG   3          2HG       ARG   3   8.208   2.258  -1.590
   29   1HD   ARG   3          1HD       ARG   3  11.069   1.697  -1.918
   30   2HD   ARG   3          2HD       ARG   3  10.587   3.057  -2.914
   31    HE   ARG   3           HE       ARG   3  10.225   4.321  -0.977
   32   1HH1  ARG   3          2HH2      ARG   3  10.358   0.911  -0.120
   33   2HH1  ARG   3          1HH2      ARG   3  10.335   1.208   1.587
   34   1HH2  ARG   3          2HH1      ARG   3  10.196   4.713   1.275
   35   2HH2  ARG   3          1HH1      ARG   3  10.242   3.385   2.385
   36    H    THR   4           H        THR   4  10.555  -0.037  -4.058
   37    HA   THR   4           HA       THR   4  11.137  -2.834  -4.485
   38    HB   THR   4           HB       THR   4  11.256  -0.991  -6.899
   39    HG1  THR   4           1HG      THR   4   9.070  -2.032  -7.303
   40   1HG2  THR   4          1HG2      THR   4  12.319  -3.172  -7.210
   41   2HG2  THR   4          2HG2      THR   4  10.945  -4.001  -6.440
   42   3HG2  THR   4          3HG2      THR   4  10.740  -3.229  -8.030
   43    H    ARG   5           H        ARG   5  13.332  -3.280  -4.564
   44    HA   ARG   5           HA       ARG   5  15.182  -1.211  -4.979
   45   1HB   ARG   5          1HB       ARG   5  14.310  -0.826  -2.553
   46   2HB   ARG   5          2HB       ARG   5  15.142  -2.311  -2.134
   47   1HG   ARG   5          1HG       ARG   5  16.890  -0.554  -3.700
   48   2HG   ARG   5          2HG       ARG   5  16.268   0.286  -2.294
   49   1HD   ARG   5          1HD       ARG   5  17.098  -2.466  -1.639
   50   2HD   ARG   5          2HD       ARG   5  18.414  -1.539  -2.330
   51    HE   ARG   5           HE       ARG   5  17.311   0.210  -0.484
   52   1HH1  ARG   5          2HH2      ARG   5  18.518  -3.090  -0.305
   53   2HH1  ARG   5          1HH2      ARG   5  19.011  -2.956   1.349
   54   1HH2  ARG   5          2HH1      ARG   5  17.961   0.388   1.700
   55   2HH2  ARG   5          1HH1      ARG   5  18.693  -0.964   2.498
   56    H    LYS   6           H        LYS   6  17.478  -2.065  -4.767
   57    HA   LYS   6           HA       LYS   6  18.928  -3.631  -5.376
   58   1HB   LYS   6          1HB       LYS   6  17.998  -4.148  -2.787
   59   2HB   LYS   6          2HB       LYS   6  18.025  -5.720  -3.558
   60   1HG   LYS   6          1HG       LYS   6  20.246  -5.693  -2.994
   61   2HG   LYS   6          2HG       LYS   6  20.418  -4.735  -4.451
   62   1HD   LYS   6          1HD       LYS   6  20.451  -2.670  -3.236
   63   2HD   LYS   6          2HD       LYS   6  19.785  -3.407  -1.792
   64   1HE   LYS   6          1HE       LYS   6  21.903  -3.696  -1.033
   65   2HE   LYS   6          2HE       LYS   6  22.150  -4.878  -2.303
   66   1HZ   LYS   6          1HZ       LYS   6  23.256  -2.337  -2.081
   67   2HZ   LYS   6          2HZ       LYS   6  23.556  -3.474  -3.213
   68   3HZ   LYS   6          3HZ       LYS   6  22.369  -2.379  -3.451
   69    H    GLY   7           H        GLY   7  16.258  -3.577  -6.772
   70   1HA   GLY   7          1HA       GLY   7  15.281  -4.729  -8.436
   71   2HA   GLY   7          2HA       GLY   7  16.648  -5.825  -8.422
   72    H    ARG   8           H        ARG   8  14.683  -5.241  -5.501
   73    HA   ARG   8           HA       ARG   8  13.488  -7.859  -5.927
   74   1HB   ARG   8          1HB       ARG   8  13.934  -8.510  -3.669
   75   2HB   ARG   8          2HB       ARG   8  15.427  -7.767  -4.204
   76   1HG   ARG   8          1HG       ARG   8  13.966  -5.587  -3.221
   77   2HG   ARG   8          2HG       ARG   8  13.531  -6.877  -2.117
   78   1HD   ARG   8          1HD       ARG   8  16.443  -6.696  -2.795
   79   2HD   ARG   8          2HD       ARG   8  15.803  -5.355  -1.864
   80    HE   ARG   8           HE       ARG   8  14.805  -7.648  -0.598
   81   1HH1  ARG   8          2HH2      ARG   8  17.990  -6.367  -1.369
   82   2HH1  ARG   8          1HH2      ARG   8  18.761  -7.120  -0.012
   83   1HH2  ARG   8          2HH1      ARG   8  15.822  -8.641   1.192
   84   2HH2  ARG   8          1HH1      ARG   8  17.520  -8.422   1.453
   85    H    ARG   9           H        ARG   9  11.623  -8.129  -4.076
   86    HA   ARG   9           HA       ARG   9  10.111  -5.657  -4.264
   87   1HB   ARG   9          1HB       ARG   9   9.019  -7.557  -5.366
   88   2HB   ARG   9          2HB       ARG   9   9.226  -8.566  -3.949
   89   1HG   ARG   9          1HG       ARG   9   7.769  -5.994  -3.487
   90   2HG   ARG   9          2HG       ARG   9   6.937  -7.156  -4.501
   91   1HD   ARG   9          1HD       ARG   9   8.100  -7.828  -1.755
   92   2HD   ARG   9          2HD       ARG   9   6.426  -7.382  -2.021
   93    HE   ARG   9           HE       ARG   9   7.335  -9.589  -3.730
   94   1HH1  ARG   9          2HH2      ARG   9   5.936  -8.724  -0.619
   95   2HH1  ARG   9          1HH2      ARG   9   5.219 -10.281  -0.365
   96   1HH2  ARG   9          2HH1      ARG   9   6.389 -11.642  -3.396
   97   2HH2  ARG   9          1HH1      ARG   9   5.479 -11.952  -1.956
   98    H    ILE  10           H        ILE  10   9.150  -4.746  -2.375
   99    HA   ILE  10           HA       ILE  10   9.543  -6.199   0.122
  100    HB   ILE  10           HB       ILE  10  10.249  -3.320   0.151
  101   1HG1  ILE  10          2HG1      ILE  10  12.670  -4.011  -0.359
  102   2HG1  ILE  10          3HG1      ILE  10  11.992  -5.441  -1.111
  103   1HG2  ILE  10          1HG2      ILE  10  11.075  -5.818   1.627
  104   2HG2  ILE  10          2HG2      ILE  10  11.972  -4.288   1.778
  105   3HG2  ILE  10          3HG2      ILE  10  10.258  -4.364   2.249
  106   1HD1  ILE  10          1HD1      ILE  10  11.225  -4.281  -2.925
  107   2HD1  ILE  10          2HD1      ILE  10  10.654  -2.921  -1.930
  108   3HD1  ILE  10          3HD1      ILE  10  12.370  -3.026  -2.393
  109    H    ARG  11           H        ARG  11   8.175  -5.347   1.885
  110    HA   ARG  11           HA       ARG  11   5.865  -4.010   0.727
  111   1HB   ARG  11          1HB       ARG  11   5.841  -6.468   1.837
  112   2HB   ARG  11          2HB       ARG  11   5.694  -5.551   3.323
  113   1HG   ARG  11          1HG       ARG  11   3.586  -4.710   2.771
  114   2HG   ARG  11          2HG       ARG  11   3.896  -4.752   1.047
  115   1HD   ARG  11          1HD       ARG  11   4.026  -7.466   1.843
  116   2HD   ARG  11          2HD       ARG  11   2.688  -6.808   2.765
  117    HE   ARG  11           HE       ARG  11   2.476  -5.889   0.056
  118   1HH1  ARG  11          2HH2      ARG  11   2.133  -8.831   1.956
  119   2HH1  ARG  11          1HH2      ARG  11   0.985  -9.548   0.874
  120   1HH2  ARG  11          2HH1      ARG  11   0.963  -6.835  -1.372
  121   2HH2  ARG  11          1HH1      ARG  11   0.317  -8.404  -1.031
  122    H    ILE  12           H        ILE  12   4.978  -2.190   1.824
  123    HA   ILE  12           HA       ILE  12   5.788  -1.513   4.455
  124    HB   ILE  12           HB       ILE  12   7.805  -0.979   2.939
  125   1HG1  ILE  12          2HG1      ILE  12   8.114   1.241   4.233
  126   2HG1  ILE  12          3HG1      ILE  12   6.559   0.885   4.957
  127   1HG2  ILE  12          1HG2      ILE  12   6.277   0.169   1.230
  128   2HG2  ILE  12          2HG2      ILE  12   6.251   1.542   2.363
  129   3HG2  ILE  12          3HG2      ILE  12   7.795   0.989   1.670
  130   1HD1  ILE  12          1HD1      ILE  12   9.139  -0.228   5.616
  131   2HD1  ILE  12          2HD1      ILE  12   7.573  -0.517   6.413
  132   3HD1  ILE  12          3HD1      ILE  12   8.081  -1.542   5.050
  133    HA   PRO  13           HA       PRO  13   2.436   1.233   4.497
  134   1HB   PRO  13          1HB       PRO  13   2.099   0.132   6.515
  135   2HB   PRO  13          2HB       PRO  13   0.558  -0.298   5.752
  136   1HG   PRO  13          1HG       PRO  13   2.096  -2.317   6.686
  137   2HG   PRO  13          2HG       PRO  13   1.412  -2.482   5.050
  138   1HD   PRO  13          1HD       PRO  13   4.276  -1.769   5.820
  139   2HD   PRO  13          2HD       PRO  13   3.689  -2.764   4.451
  140    HA   PRO  14           HA       PRO  14  -1.031   1.080   1.810
  141   1HB   PRO  14          1HB       PRO  14  -0.290   3.107   0.058
  142   2HB   PRO  14          2HB       PRO  14  -0.762   3.357   1.744
  143   1HG   PRO  14          1HG       PRO  14   2.091   3.154   0.630
  144   2HG   PRO  14          2HG       PRO  14   1.435   4.403   1.711
  145   1HD   PRO  14          1HD       PRO  14   2.878   2.248   2.700
  146   2HD   PRO  14          2HD       PRO  14   1.505   2.916   3.628
  Start of MODEL    7
    1   1H    ARG   1          H         ARG   1   2.051  -0.103   0.908
    2    HA   ARG   1           HA       ARG   1   1.388  -0.401  -1.903
    3   1HB   ARG   1          1HB       ARG   1   3.080   1.746  -0.581
    4   2HB   ARG   1          2HB       ARG   1   3.461   1.247  -2.216
    5   1HG   ARG   1          1HG       ARG   1   0.670   1.578  -2.277
    6   2HG   ARG   1          2HG       ARG   1   1.209   2.882  -1.239
    7   1HD   ARG   1          1HD       ARG   1   1.275   3.767  -3.473
    8   2HD   ARG   1          2HD       ARG   1   2.945   3.469  -3.038
    9    HE   ARG   1           HE       ARG   1   1.710   1.168  -4.348
   10   1HH1  ARG   1          2HH2      ARG   1   3.321   4.248  -4.902
   11   2HH1  ARG   1          1HH2      ARG   1   3.871   3.820  -6.488
   12   1HH2  ARG   1          2HH1      ARG   1   2.435   0.603  -6.440
   13   2HH2  ARG   1          1HH1      ARG   1   3.364   1.733  -7.368
   14    H    VAL   2           H        VAL   2   3.257  -1.233  -3.222
   15    HA   VAL   2           HA       VAL   2   5.247  -2.581  -1.531
   16    HB   VAL   2           HB       VAL   2   3.745  -3.642  -3.930
   17   1HG1  VAL   2          1HG1      VAL   2   5.146  -5.463  -4.052
   18   2HG1  VAL   2          2HG1      VAL   2   6.311  -4.201  -3.584
   19   3HG1  VAL   2          3HG1      VAL   2   5.668  -5.319  -2.357
   20   1HG2  VAL   2          1HG2      VAL   2   2.727  -5.195  -2.460
   21   2HG2  VAL   2          2HG2      VAL   2   3.843  -4.796  -1.133
   22   3HG2  VAL   2          3HG2      VAL   2   2.609  -3.619  -1.644
   23    H    ARG   3           H        ARG   3   6.895  -1.069  -1.858
   24    HA   ARG   3           HA       ARG   3   7.382  -0.066  -4.449
   25   1HB   ARG   3          1HB       ARG   3   9.177   1.165  -3.428
   26   2HB   ARG   3          2HB       ARG   3   7.931   1.072  -2.200
   27   1HG   ARG   3          1HG       ARG   3   9.274  -1.207  -1.585
   28   2HG   ARG   3          2HG       ARG   3  10.594  -0.317  -2.316
   29   1HD   ARG   3          1HD       ARG   3   8.943   1.266  -0.399
   30   2HD   ARG   3          2HD       ARG   3   9.821  -0.068   0.323
   31    HE   ARG   3           HE       ARG   3  11.567   1.385  -1.448
   32   1HH1  ARG   3          2HH2      ARG   3  10.006   1.650   1.695
   33   2HH1  ARG   3          1HH2      ARG   3  11.214   2.704   2.349
   34   1HH2  ARG   3          2HH1      ARG   3  13.162   2.776  -0.585
   35   2HH2  ARG   3          1HH1      ARG   3  13.022   3.349   1.043
   36    H    THR   4           H        THR   4  10.251  -0.162  -4.606
   37    HA   THR   4           HA       THR   4  10.948  -2.990  -4.586
   38    HB   THR   4           HB       THR   4  11.353  -1.422  -7.148
   39    HG1  THR   4           1HG      THR   4   9.073  -1.243  -6.553
   40   1HG2  THR   4          1HG2      THR   4  11.057  -4.318  -6.289
   41   2HG2  THR   4          2HG2      THR   4  10.623  -3.851  -7.951
   42   3HG2  THR   4          3HG2      THR   4  12.281  -3.592  -7.357
   43    H    ARG   5           H        ARG   5  13.106  -3.381  -4.266
   44    HA   ARG   5           HA       ARG   5  14.939  -1.238  -4.660
   45   1HB   ARG   5          1HB       ARG   5  13.977  -0.771  -2.368
   46   2HB   ARG   5          2HB       ARG   5  14.507  -2.357  -1.843
   47   1HG   ARG   5          1HG       ARG   5  16.782  -1.774  -1.886
   48   2HG   ARG   5          2HG       ARG   5  16.555  -0.533  -3.103
   49   1HD   ARG   5          1HD       ARG   5  16.657   0.948  -1.366
   50   2HD   ARG   5          2HD       ARG   5  15.010   0.459  -1.021
   51    HE   ARG   5           HE       ARG   5  16.793  -1.427   0.195
   52   1HH1  ARG   5          2HH2      ARG   5  15.738   1.912   0.543
   53   2HH1  ARG   5          1HH2      ARG   5  16.048   1.966   2.246
   54   1HH2  ARG   5          2HH1      ARG   5  17.201  -1.356   2.442
   55   2HH2  ARG   5          1HH1      ARG   5  16.885   0.095   3.334
   56    H    LYS   6           H        LYS   6  17.240  -1.999  -4.308
   57    HA   LYS   6           HA       LYS   6  18.807  -3.493  -4.784
   58   1HB   LYS   6          1HB       LYS   6  17.255  -4.820  -2.571
   59   2HB   LYS   6          2HB       LYS   6  18.640  -5.621  -3.281
   60   1HG   LYS   6          1HG       LYS   6  20.156  -3.988  -2.531
   61   2HG   LYS   6          2HG       LYS   6  18.939  -2.728  -2.472
   62   1HD   LYS   6          1HD       LYS   6  18.318  -3.253  -0.330
   63   2HD   LYS   6          2HD       LYS   6  18.351  -4.978  -0.639
   64   1HE   LYS   6          1HE       LYS   6  21.057  -3.807  -0.689
   65   2HE   LYS   6          2HE       LYS   6  20.249  -3.511   0.838
   66   1HZ   LYS   6          1HZ       LYS   6  21.138  -5.985  -0.286
   67   2HZ   LYS   6          2HZ       LYS   6  20.928  -5.566   1.279
   68   3HZ   LYS   6          3HZ       LYS   6  19.652  -6.063   0.390
   69    H    GLY   7           H        GLY   7  16.248  -3.504  -6.403
   70   1HA   GLY   7          1HA       GLY   7  15.531  -4.625  -8.220
   71   2HA   GLY   7          2HA       GLY   7  16.893  -5.716  -8.054
   72    H    ARG   8           H        ARG   8  14.689  -5.228  -5.316
   73    HA   ARG   8           HA       ARG   8  13.346  -7.699  -6.013
   74   1HB   ARG   8          1HB       ARG   8  13.565  -8.162  -3.383
   75   2HB   ARG   8          2HB       ARG   8  14.831  -8.658  -4.487
   76   1HG   ARG   8          1HG       ARG   8  15.977  -6.414  -4.051
   77   2HG   ARG   8          2HG       ARG   8  14.778  -6.108  -2.809
   78   1HD   ARG   8          1HD       ARG   8  16.583  -8.574  -2.839
   79   2HD   ARG   8          2HD       ARG   8  16.958  -7.111  -1.951
   80    HE   ARG   8           HE       ARG   8  14.319  -7.887  -1.224
   81   1HH1  ARG   8          2HH2      ARG   8  17.616  -9.070  -0.889
   82   2HH1  ARG   8          1HH2      ARG   8  17.298  -9.915   0.588
   83   1HH2  ARG   8          2HH1      ARG   8  13.898  -9.003   0.725
   84   2HH2  ARG   8          1HH1      ARG   8  15.169  -9.877   1.513
   85    H    ARG   9           H        ARG   9  11.227  -7.947  -4.934
   86    HA   ARG   9           HA       ARG   9  10.052  -5.404  -4.477
   87   1HB   ARG   9          1HB       ARG   9   8.723  -6.978  -5.723
   88   2HB   ARG   9          2HB       ARG   9   9.002  -8.261  -4.563
   89   1HG   ARG   9          1HG       ARG   9   7.603  -5.729  -3.662
   90   2HG   ARG   9          2HG       ARG   9   6.701  -6.935  -4.558
   91   1HD   ARG   9          1HD       ARG   9   8.065  -8.478  -2.661
   92   2HD   ARG   9          2HD       ARG   9   7.686  -7.020  -1.767
   93    HE   ARG   9           HE       ARG   9   5.330  -7.719  -3.161
   94   1HH1  ARG   9          2HH2      ARG   9   7.384  -9.116  -0.669
   95   2HH1  ARG   9          1HH2      ARG   9   6.096 -10.001   0.078
   96   1HH2  ARG   9          2HH1      ARG   9   3.629  -8.886  -2.177
   97   2HH2  ARG   9          1HH1      ARG   9   3.945  -9.869  -0.786
   98    H    ILE  10           H        ILE  10   9.199  -4.601  -2.495
   99    HA   ILE  10           HA       ILE  10   9.538  -6.318  -0.155
  100    HB   ILE  10           HB       ILE  10  10.391  -3.448  -0.054
  101   1HG1  ILE  10          2HG1      ILE  10  11.663  -4.524  -1.899
  102   2HG1  ILE  10          3HG1      ILE  10  12.665  -4.013  -0.556
  103   1HG2  ILE  10          1HG2      ILE  10  10.626  -5.882   1.658
  104   2HG2  ILE  10          2HG2      ILE  10  11.937  -4.679   1.711
  105   3HG2  ILE  10          3HG2      ILE  10  10.268  -4.196   2.098
  106   1HD1  ILE  10          1HD1      ILE  10  12.480  -6.621  -1.683
  107   2HD1  ILE  10          2HD1      ILE  10  13.411  -6.127  -0.250
  108   3HD1  ILE  10          3HD1      ILE  10  11.744  -6.722  -0.066
  109    H    ARG  11           H        ARG  11   8.376  -5.297   1.801
  110    HA   ARG  11           HA       ARG  11   5.969  -4.034   0.758
  111   1HB   ARG  11          1HB       ARG  11   6.043  -6.449   1.963
  112   2HB   ARG  11          2HB       ARG  11   5.991  -5.472   3.416
  113   1HG   ARG  11          1HG       ARG  11   3.887  -4.475   2.807
  114   2HG   ARG  11          2HG       ARG  11   4.016  -5.020   1.146
  115   1HD   ARG  11          1HD       ARG  11   2.968  -6.967   1.662
  116   2HD   ARG  11          2HD       ARG  11   4.185  -7.342   2.866
  117    HE   ARG  11           HE       ARG  11   2.727  -6.598   4.544
  118   1HH1  ARG  11          2HH2      ARG  11   1.603  -5.415   1.426
  119   2HH1  ARG  11          1HH2      ARG  11   0.113  -4.794   2.056
  120   1HH2  ARG  11          2HH1      ARG  11   0.761  -5.780   5.374
  121   2HH2  ARG  11          1HH1      ARG  11  -0.368  -5.004   4.316
  122    H    ILE  12           H        ILE  12   5.167  -2.165   1.828
  123    HA   ILE  12           HA       ILE  12   6.145  -1.389   4.375
  124    HB   ILE  12           HB       ILE  12   8.065  -0.921   2.731
  125   1HG1  ILE  12          2HG1      ILE  12   8.346  -0.075   4.867
  126   2HG1  ILE  12          3HG1      ILE  12   8.434   1.370   3.879
  127   1HG2  ILE  12          1HG2      ILE  12   6.394   0.146   1.071
  128   2HG2  ILE  12          2HG2      ILE  12   6.526   1.588   2.106
  129   3HG2  ILE  12          3HG2      ILE  12   7.977   0.921   1.318
  130   1HD1  ILE  12          1HD1      ILE  12   5.985   0.374   5.405
  131   2HD1  ILE  12          2HD1      ILE  12   6.974   1.802   5.794
  132   3HD1  ILE  12          3HD1      ILE  12   5.985   1.781   4.314
  133    HA   PRO  13           HA       PRO  13   2.753   1.298   4.496
  134   1HB   PRO  13          1HB       PRO  13   2.533   0.240   6.555
  135   2HB   PRO  13          2HB       PRO  13   0.958  -0.219   5.886
  136   1HG   PRO  13          1HG       PRO  13   2.561  -2.204   6.779
  137   2HG   PRO  13          2HG       PRO  13   1.790  -2.412   5.187
  138   1HD   PRO  13          1HD       PRO  13   4.685  -1.661   5.785
  139   2HD   PRO  13          2HD       PRO  13   4.034  -2.691   4.472
  140    HA   PRO  14           HA       PRO  14  -0.857   1.047   2.009
  141   1HB   PRO  14          1HB       PRO  14  -0.245   3.060   0.191
  142   2HB   PRO  14          2HB       PRO  14  -0.630   3.327   1.897
  143   1HG   PRO  14          1HG       PRO  14   2.162   3.152   0.633
  144   2HG   PRO  14          2HG       PRO  14   1.544   4.407   1.730
  145   1HD   PRO  14          1HD       PRO  14   3.075   2.290   2.669
  146   2HD   PRO  14          2HD       PRO  14   1.742   2.950   3.661
  Start of MODEL    8
    1   1H    ARG   1          H         ARG   1   2.323   0.209   0.670
    2    HA   ARG   1           HA       ARG   1   1.232  -0.699  -1.835
    3   1HB   ARG   1          1HB       ARG   1   2.520   0.834  -3.197
    4   2HB   ARG   1          2HB       ARG   1   1.674   1.814  -2.016
    5   1HG   ARG   1          1HG       ARG   1   3.755   1.772  -0.565
    6   2HG   ARG   1          2HG       ARG   1   4.587   0.908  -1.843
    7   1HD   ARG   1          1HD       ARG   1   3.216   3.571  -2.385
    8   2HD   ARG   1          2HD       ARG   1   4.848   3.506  -1.752
    9    HE   ARG   1           HE       ARG   1   4.469   1.803  -4.103
   10   1HH1  ARG   1          2HH2      ARG   1   5.221   5.060  -3.003
   11   2HH1  ARG   1          1HH2      ARG   1   6.047   5.499  -4.461
   12   1HH2  ARG   1          2HH1      ARG   1   5.559   2.382  -6.027
   13   2HH2  ARG   1          1HH1      ARG   1   6.240   3.965  -6.192
   14    H    VAL   2           H        VAL   2   3.022  -1.718  -3.233
   15    HA   VAL   2           HA       VAL   2   5.059  -2.849  -1.450
   16    HB   VAL   2           HB       VAL   2   3.578  -4.522  -2.222
   17   1HG1  VAL   2          1HG1      VAL   2   3.950  -3.338  -4.990
   18   2HG1  VAL   2          2HG1      VAL   2   3.164  -4.902  -4.671
   19   3HG1  VAL   2          3HG1      VAL   2   2.454  -3.402  -4.027
   20   1HG2  VAL   2          1HG2      VAL   2   6.324  -4.510  -2.909
   21   2HG2  VAL   2          2HG2      VAL   2   5.271  -5.916  -2.623
   22   3HG2  VAL   2          3HG2      VAL   2   5.464  -5.269  -4.269
   23    H    ARG   3           H        ARG   3   6.693  -1.292  -1.654
   24    HA   ARG   3           HA       ARG   3   7.351  -0.232  -4.164
   25   1HB   ARG   3          1HB       ARG   3   8.277   0.000  -1.369
   26   2HB   ARG   3          2HB       ARG   3   9.610   0.085  -2.503
   27   1HG   ARG   3          1HG       ARG   3   8.074   1.780  -3.820
   28   2HG   ARG   3          2HG       ARG   3   7.180   1.894  -2.317
   29   1HD   ARG   3          1HD       ARG   3  10.165   2.459  -2.668
   30   2HD   ARG   3          2HD       ARG   3   8.913   3.662  -2.433
   31    HE   ARG   3           HE       ARG   3   9.044   1.608  -0.324
   32   1HH1  ARG   3          2HH2      ARG   3  10.112   4.790  -1.382
   33   2HH1  ARG   3          1HH2      ARG   3  10.513   5.327   0.216
   34   1HH2  ARG   3          2HH1      ARG   3   9.572   2.317   1.783
   35   2HH2  ARG   3          1HH1      ARG   3  10.203   3.911   2.028
   36    H    THR   4           H        THR   4  10.172  -0.350  -4.311
   37    HA   THR   4           HA       THR   4  10.911  -3.162  -4.277
   38    HB   THR   4           HB       THR   4  11.221  -1.617  -6.871
   39    HG1  THR   4           1HG      THR   4   8.957  -1.522  -6.374
   40   1HG2  THR   4          1HG2      THR   4  10.925  -3.916  -7.819
   41   2HG2  THR   4          2HG2      THR   4  12.287  -3.869  -6.673
   42   3HG2  THR   4          3HG2      THR   4  10.724  -4.559  -6.172
   43    H    ARG   5           H        ARG   5  13.089  -3.511  -4.017
   44    HA   ARG   5           HA       ARG   5  14.830  -1.266  -4.388
   45   1HB   ARG   5          1HB       ARG   5  14.101  -2.402  -1.685
   46   2HB   ARG   5          2HB       ARG   5  15.765  -1.916  -1.937
   47   1HG   ARG   5          1HG       ARG   5  15.161   0.234  -1.555
   48   2HG   ARG   5          2HG       ARG   5  14.198   0.198  -3.019
   49   1HD   ARG   5          1HD       ARG   5  12.311   0.363  -1.771
   50   2HD   ARG   5          2HD       ARG   5  12.670  -1.186  -1.035
   51    HE   ARG   5           HE       ARG   5  13.112   1.452   0.150
   52   1HH1  ARG   5          2HH2      ARG   5  14.117  -1.921   0.204
   53   2HH1  ARG   5          1HH2      ARG   5  14.711  -1.850   1.829
   54   1HH2  ARG   5          2HH1      ARG   5  13.897   1.545   2.294
   55   2HH2  ARG   5          1HH1      ARG   5  14.585   0.134   3.026
   56    H    LYS   6           H        LYS   6  17.171  -1.941  -4.231
   57    HA   LYS   6           HA       LYS   6  18.750  -3.321  -4.973
   58   1HB   LYS   6          1HB       LYS   6  19.208  -5.215  -3.510
   59   2HB   LYS   6          2HB       LYS   6  18.736  -3.807  -2.580
   60   1HG   LYS   6          1HG       LYS   6  16.478  -4.679  -2.258
   61   2HG   LYS   6          2HG       LYS   6  16.756  -5.980  -3.399
   62   1HD   LYS   6          1HD       LYS   6  17.882  -7.264  -1.866
   63   2HD   LYS   6          2HD       LYS   6  18.752  -5.894  -1.204
   64   1HE   LYS   6          1HE       LYS   6  17.019  -5.339   0.305
   65   2HE   LYS   6          2HE       LYS   6  15.786  -6.131  -0.656
   66   1HZ   LYS   6          1HZ       LYS   6  17.656  -8.039   0.075
   67   2HZ   LYS   6          2HZ       LYS   6  17.271  -7.200   1.423
   68   3HZ   LYS   6          3HZ       LYS   6  16.097  -7.925   0.550
   69    H    GLY   7           H        GLY   7  16.442  -3.306  -6.637
   70   1HA   GLY   7          1HA       GLY   7  15.536  -4.445  -8.345
   71   2HA   GLY   7          2HA       GLY   7  16.918  -5.518  -8.255
   72    H    ARG   8           H        ARG   8  14.641  -5.018  -5.536
   73    HA   ARG   8           HA       ARG   8  13.446  -7.580  -6.160
   74   1HB   ARG   8          1HB       ARG   8  14.743  -6.807  -3.503
   75   2HB   ARG   8          2HB       ARG   8  13.640  -8.160  -3.658
   76   1HG   ARG   8          1HG       ARG   8  15.951  -8.013  -5.589
   77   2HG   ARG   8          2HG       ARG   8  16.305  -8.456  -3.932
   78   1HD   ARG   8          1HD       ARG   8  14.774 -10.356  -4.025
   79   2HD   ARG   8          2HD       ARG   8  14.133  -9.837  -5.573
   80    HE   ARG   8           HE       ARG   8  17.026 -10.264  -5.636
   81   1HH1  ARG   8          2HH2      ARG   8  13.890 -11.836  -5.916
   82   2HH1  ARG   8          1HH2      ARG   8  14.495 -13.161  -6.853
   83   1HH2  ARG   8          2HH1      ARG   8  17.824 -12.012  -6.874
   84   2HH2  ARG   8          1HH1      ARG   8  16.747 -13.261  -7.402
   85    H    ARG   9           H        ARG   9  11.431  -7.966  -4.710
   86    HA   ARG   9           HA       ARG   9  10.098  -5.419  -4.482
   87   1HB   ARG   9          1HB       ARG   9   8.866  -7.058  -5.762
   88   2HB   ARG   9          2HB       ARG   9   9.138  -8.312  -4.569
   89   1HG   ARG   9          1HG       ARG   9   7.737  -5.870  -3.558
   90   2HG   ARG   9          2HG       ARG   9   6.839  -6.819  -4.725
   91   1HD   ARG   9          1HD       ARG   9   8.145  -8.014  -2.234
   92   2HD   ARG   9          2HD       ARG   9   6.473  -7.496  -2.293
   93    HE   ARG   9           HE       ARG   9   7.539  -9.942  -3.397
   94   1HH1  ARG   9          2HH2      ARG   9   5.115  -7.463  -3.995
   95   2HH1  ARG   9          1HH2      ARG   9   4.078  -8.515  -4.899
   96   1HH2  ARG   9          2HH1      ARG   9   6.172 -11.330  -4.590
   97   2HH2  ARG   9          1HH1      ARG   9   4.682 -10.729  -5.240
   98    H    ILE  10           H        ILE  10   9.211  -4.638  -2.514
   99    HA   ILE  10           HA       ILE  10   9.485  -6.359  -0.176
  100    HB   ILE  10           HB       ILE  10  10.425  -3.520  -0.029
  101   1HG1  ILE  10          2HG1      ILE  10  11.695  -4.614  -1.868
  102   2HG1  ILE  10          3HG1      ILE  10  12.687  -4.141  -0.504
  103   1HG2  ILE  10          1HG2      ILE  10  10.412  -4.172   2.116
  104   2HG2  ILE  10          2HG2      ILE  10  10.375  -5.902   1.700
  105   3HG2  ILE  10          3HG2      ILE  10  11.920  -5.019   1.694
  106   1HD1  ILE  10          1HD1      ILE  10  13.300  -6.288  -0.075
  107   2HD1  ILE  10          2HD1      ILE  10  11.620  -6.866  -0.183
  108   3HD1  ILE  10          3HD1      ILE  10  12.595  -6.686  -1.661
  109    H    ARG  11           H        ARG  11   8.269  -5.397   1.740
  110    HA   ARG  11           HA       ARG  11   5.952  -4.006   0.661
  111   1HB   ARG  11          1HB       ARG  11   5.714  -6.401   1.647
  112   2HB   ARG  11          2HB       ARG  11   6.019  -5.678   3.214
  113   1HG   ARG  11          1HG       ARG  11   3.882  -4.930   3.359
  114   2HG   ARG  11          2HG       ARG  11   4.011  -4.103   1.820
  115   1HD   ARG  11          1HD       ARG  11   3.441  -6.169   0.600
  116   2HD   ARG  11          2HD       ARG  11   3.474  -7.101   2.084
  117    HE   ARG  11           HE       ARG  11   1.630  -4.938   2.420
  118   1HH1  ARG  11          2HH2      ARG  11   1.958  -7.947   0.627
  119   2HH1  ARG  11          1HH2      ARG  11   0.251  -8.218   0.518
  120   1HH2  ARG  11          2HH1      ARG  11  -0.623  -5.295   2.278
  121   2HH2  ARG  11          1HH1      ARG  11  -1.227  -6.699   1.464
  122    H    ILE  12           H        ILE  12   5.124  -2.174   1.810
  123    HA   ILE  12           HA       ILE  12   6.048  -1.478   4.383
  124    HB   ILE  12           HB       ILE  12   8.044  -1.051   2.770
  125   1HG1  ILE  12          2HG1      ILE  12   8.020   1.379   4.189
  126   2HG1  ILE  12          3HG1      ILE  12   7.055   0.277   5.152
  127   1HG2  ILE  12          1HG2      ILE  12   6.567   0.215   1.144
  128   2HG2  ILE  12          2HG2      ILE  12   6.554   1.540   2.331
  129   3HG2  ILE  12          3HG2      ILE  12   8.091   1.006   1.610
  130   1HD1  ILE  12          1HD1      ILE  12   9.840  -0.355   4.066
  131   2HD1  ILE  12          2HD1      ILE  12   9.482   0.158   5.734
  132   3HD1  ILE  12          3HD1      ILE  12   8.867  -1.400   5.130
  133    HA   PRO  13           HA       PRO  13   2.894   1.506   4.461
  134   1HB   PRO  13          1HB       PRO  13   2.573   0.516   6.539
  135   2HB   PRO  13          2HB       PRO  13   0.982   0.142   5.853
  136   1HG   PRO  13          1HG       PRO  13   2.440  -1.920   6.821
  137   2HG   PRO  13          2HG       PRO  13   1.685  -2.116   5.219
  138   1HD   PRO  13          1HD       PRO  13   4.612  -1.537   5.853
  139   2HD   PRO  13          2HD       PRO  13   3.918  -2.555   4.552
  140    HA   PRO  14           HA       PRO  14  -0.666   1.445   1.900
  141   1HB   PRO  14          1HB       PRO  14   0.136   3.331   0.020
  142   2HB   PRO  14          2HB       PRO  14  -0.254   3.693   1.707
  143   1HG   PRO  14          1HG       PRO  14   2.535   3.248   0.506
  144   2HG   PRO  14          2HG       PRO  14   2.002   4.590   1.543
  145   1HD   PRO  14          1HD       PRO  14   3.341   2.397   2.592
  146   2HD   PRO  14          2HD       PRO  14   2.048   3.199   3.531
  Start of MODEL    9
    1   1H    ARG   1          H         ARG   1   1.846  -0.102   0.871
    2    HA   ARG   1           HA       ARG   1   1.257  -0.445  -1.954
    3   1HB   ARG   1          1HB       ARG   1   2.828   1.735  -0.582
    4   2HB   ARG   1          2HB       ARG   1   3.431   1.167  -2.126
    5   1HG   ARG   1          1HG       ARG   1   1.009   1.500  -3.013
    6   2HG   ARG   1          2HG       ARG   1   0.704   2.386  -1.531
    7   1HD   ARG   1          1HD       ARG   1   3.062   3.567  -2.348
    8   2HD   ARG   1          2HD       ARG   1   2.353   3.161  -3.898
    9    HE   ARG   1           HE       ARG   1   0.459   4.432  -2.054
   10   1HH1  ARG   1          2HH2      ARG   1   2.914   4.991  -4.513
   11   2HH1  ARG   1          1HH2      ARG   1   2.321   6.564  -4.929
   12   1HH2  ARG   1          2HH1      ARG   1  -0.322   6.507  -2.603
   13   2HH2  ARG   1          1HH1      ARG   1   0.468   7.432  -3.835
   14    H    VAL   2           H        VAL   2   3.436  -0.971  -3.199
   15    HA   VAL   2           HA       VAL   2   5.180  -2.547  -1.440
   16    HB   VAL   2           HB       VAL   2   3.437  -3.902  -2.661
   17   1HG1  VAL   2          1HG1      VAL   2   3.386  -4.106  -4.956
   18   2HG1  VAL   2          2HG1      VAL   2   3.821  -2.388  -4.793
   19   3HG1  VAL   2          3HG1      VAL   2   5.079  -3.594  -5.152
   20   1HG2  VAL   2          1HG2      VAL   2   6.390  -4.402  -3.135
   21   2HG2  VAL   2          2HG2      VAL   2   5.374  -5.010  -1.806
   22   3HG2  VAL   2          3HG2      VAL   2   5.121  -5.606  -3.464
   23    H    ARG   3           H        ARG   3   6.997  -1.279  -1.441
   24    HA   ARG   3           HA       ARG   3   7.712   0.181  -3.740
   25   1HB   ARG   3          1HB       ARG   3   8.578  -0.061  -0.955
   26   2HB   ARG   3          2HB       ARG   3   9.977  -0.032  -2.012
   27   1HG   ARG   3          1HG       ARG   3   7.974   1.960  -2.832
   28   2HG   ARG   3          2HG       ARG   3   8.459   2.193  -1.165
   29   1HD   ARG   3          1HD       ARG   3  10.810   1.614  -2.793
   30   2HD   ARG   3          2HD       ARG   3   9.908   2.933  -3.513
   31    HE   ARG   3           HE       ARG   3  10.355   4.277  -1.619
   32   1HH1  ARG   3          2HH2      ARG   3  11.374   0.960  -1.039
   33   2HH1  ARG   3          1HH2      ARG   3  12.257   1.348   0.400
   34   1HH2  ARG   3          2HH1      ARG   3  11.521   4.790   0.278
   35   2HH2  ARG   3          1HH1      ARG   3  12.342   3.541   1.154
   36    H    THR   4           H        THR   4  10.540  -0.132  -3.884
   37    HA   THR   4           HA       THR   4  11.115  -2.933  -4.295
   38    HB   THR   4           HB       THR   4  11.313  -1.070  -6.695
   39    HG1  THR   4           1HG      THR   4   9.165  -2.045  -7.199
   40   1HG2  THR   4          1HG2      THR   4  11.046  -4.091  -6.279
   41   2HG2  THR   4          2HG2      THR   4  10.906  -3.303  -7.868
   42   3HG2  THR   4          3HG2      THR   4  12.440  -3.229  -6.970
   43    H    ARG   5           H        ARG   5  13.319  -3.393  -4.347
   44    HA   ARG   5           HA       ARG   5  15.156  -1.255  -4.579
   45   1HB   ARG   5          1HB       ARG   5  14.411  -0.975  -2.199
   46   2HB   ARG   5          2HB       ARG   5  14.856  -2.635  -1.864
   47   1HG   ARG   5          1HG       ARG   5  17.013  -1.001  -3.118
   48   2HG   ARG   5          2HG       ARG   5  16.533  -0.470  -1.519
   49   1HD   ARG   5          1HD       ARG   5  16.797  -3.402  -1.649
   50   2HD   ARG   5          2HD       ARG   5  18.283  -2.600  -2.118
   51    HE   ARG   5           HE       ARG   5  17.127  -1.424   0.284
   52   1HH1  ARG   5          2HH2      ARG   5  19.099  -4.083  -0.907
   53   2HH1  ARG   5          1HH2      ARG   5  19.915  -4.322   0.602
   54   1HH2  ARG   5          2HH1      ARG   5  18.203  -1.738   2.275
   55   2HH2  ARG   5          1HH1      ARG   5  19.402  -2.979   2.425
   56    H    LYS   6           H        LYS   6  17.409  -2.069  -4.675
   57    HA   LYS   6           HA       LYS   6  18.824  -3.555  -5.541
   58   1HB   LYS   6          1HB       LYS   6  17.994  -4.425  -2.879
   59   2HB   LYS   6          2HB       LYS   6  18.611  -5.753  -3.841
   60   1HG   LYS   6          1HG       LYS   6  20.116  -3.121  -3.799
   61   2HG   LYS   6          2HG       LYS   6  20.280  -4.228  -2.450
   62   1HD   LYS   6          1HD       LYS   6  20.515  -5.629  -5.027
   63   2HD   LYS   6          2HD       LYS   6  21.689  -4.335  -4.892
   64   1HE   LYS   6          1HE       LYS   6  22.781  -5.313  -3.069
   65   2HE   LYS   6          2HE       LYS   6  21.336  -6.119  -2.492
   66   1HZ   LYS   6          1HZ       LYS   6  22.050  -7.056  -5.047
   67   2HZ   LYS   6          2HZ       LYS   6  23.306  -7.213  -4.016
   68   3HZ   LYS   6          3HZ       LYS   6  21.867  -7.895  -3.658
   69    H    GLY   7           H        GLY   7  16.445  -3.531  -7.004
   70   1HA   GLY   7          1HA       GLY   7  15.220  -4.741  -8.452
   71   2HA   GLY   7          2HA       GLY   7  16.604  -5.814  -8.519
   72    H    ARG   8           H        ARG   8  14.638  -5.164  -5.578
   73    HA   ARG   8           HA       ARG   8  13.559  -7.846  -5.862
   74   1HB   ARG   8          1HB       ARG   8  14.767  -6.612  -3.336
   75   2HB   ARG   8          2HB       ARG   8  13.869  -8.117  -3.350
   76   1HG   ARG   8          1HG       ARG   8  15.861  -8.273  -5.430
   77   2HG   ARG   8          2HG       ARG   8  16.655  -7.686  -3.982
   78   1HD   ARG   8          1HD       ARG   8  16.442  -9.698  -2.906
   79   2HD   ARG   8          2HD       ARG   8  14.777  -9.899  -3.413
   80    HE   ARG   8           HE       ARG   8  16.731 -10.266  -5.579
   81   1HH1  ARG   8          2HH2      ARG   8  14.916 -11.834  -3.004
   82   2HH1  ARG   8          1HH2      ARG   8  15.039 -13.413  -3.705
   83   1HH2  ARG   8          2HH1      ARG   8  16.892 -12.349  -6.505
   84   2HH2  ARG   8          1HH1      ARG   8  16.170 -13.708  -5.710
   85    H    ARG   9           H        ARG   9  11.582  -8.186  -4.388
   86    HA   ARG   9           HA       ARG   9  10.065  -5.740  -4.442
   87   1HB   ARG   9          1HB       ARG   9   8.942  -7.610  -5.472
   88   2HB   ARG   9          2HB       ARG   9   9.338  -8.686  -4.147
   89   1HG   ARG   9          1HG       ARG   9   7.767  -6.264  -3.379
   90   2HG   ARG   9          2HG       ARG   9   6.923  -7.395  -4.419
   91   1HD   ARG   9          1HD       ARG   9   8.350  -8.213  -1.843
   92   2HD   ARG   9          2HD       ARG   9   6.640  -7.840  -1.927
   93    HE   ARG   9           HE       ARG   9   7.453  -9.833  -3.906
   94   1HH1  ARG   9          2HH2      ARG   9   6.454  -9.354  -0.566
   95   2HH1  ARG   9          1HH2      ARG   9   5.873 -10.974  -0.374
   96   1HH2  ARG   9          2HH1      ARG   9   6.686 -11.971  -3.653
   97   2HH2  ARG   9          1HH1      ARG   9   6.006 -12.473  -2.141
   98    H    ILE  10           H        ILE  10   9.206  -4.742  -2.576
   99    HA   ILE  10           HA       ILE  10   9.635  -6.127  -0.038
  100    HB   ILE  10           HB       ILE  10  10.301  -3.219  -0.286
  101   1HG1  ILE  10          2HG1      ILE  10  11.652  -4.338  -2.008
  102   2HG1  ILE  10          3HG1      ILE  10  12.634  -3.726  -0.691
  103   1HG2  ILE  10          1HG2      ILE  10  11.964  -4.504   1.550
  104   2HG2  ILE  10          2HG2      ILE  10  10.536  -3.502   1.905
  105   3HG2  ILE  10          3HG2      ILE  10  10.372  -5.270   1.764
  106   1HD1  ILE  10          1HD1      ILE  10  13.422  -5.799  -0.236
  107   2HD1  ILE  10          2HD1      ILE  10  11.769  -6.442  -0.085
  108   3HD1  ILE  10          3HD1      ILE  10  12.559  -6.383  -1.679
  109    H    ARG  11           H        ARG  11   8.358  -5.045   1.764
  110    HA   ARG  11           HA       ARG  11   5.964  -3.872   0.590
  111   1HB   ARG  11          1HB       ARG  11   5.925  -6.311   1.660
  112   2HB   ARG  11          2HB       ARG  11   5.907  -5.447   3.184
  113   1HG   ARG  11          1HG       ARG  11   3.797  -4.487   2.784
  114   2HG   ARG  11          2HG       ARG  11   3.959  -4.590   1.043
  115   1HD   ARG  11          1HD       ARG  11   2.699  -6.481   1.130
  116   2HD   ARG  11          2HD       ARG  11   4.073  -7.279   1.867
  117    HE   ARG  11           HE       ARG  11   2.557  -5.784   3.840
  118   1HH1  ARG  11          2HH2      ARG  11   2.577  -8.783   1.999
  119   2HH1  ARG  11          1HH2      ARG  11   1.629  -9.651   3.161
  120   1HH2  ARG  11          2HH1      ARG  11   1.308  -6.929   5.373
  121   2HH2  ARG  11          1HH1      ARG  11   0.902  -8.590   5.092
  122    H    ILE  12           H        ILE  12   5.024  -2.083   1.714
  123    HA   ILE  12           HA       ILE  12   5.896  -1.361   4.316
  124    HB   ILE  12           HB       ILE  12   7.835  -0.761   2.713
  125   1HG1  ILE  12          2HG1      ILE  12   8.128   1.456   4.006
  126   2HG1  ILE  12          3HG1      ILE  12   6.612   1.058   4.787
  127   1HG2  ILE  12          1HG2      ILE  12   6.229   1.736   2.229
  128   2HG2  ILE  12          2HG2      ILE  12   7.702   1.158   1.413
  129   3HG2  ILE  12          3HG2      ILE  12   6.142   0.358   1.106
  130   1HD1  ILE  12          1HD1      ILE  12   9.215   0.063   5.417
  131   2HD1  ILE  12          2HD1      ILE  12   7.667  -0.385   6.171
  132   3HD1  ILE  12          3HD1      ILE  12   8.278  -1.307   4.776
  133    HA   PRO  13           HA       PRO  13   2.468   1.287   4.474
  134   1HB   PRO  13          1HB       PRO  13   2.239   0.194   6.512
  135   2HB   PRO  13          2HB       PRO  13   0.686  -0.294   5.809
  136   1HG   PRO  13          1HG       PRO  13   2.322  -2.252   6.702
  137   2HG   PRO  13          2HG       PRO  13   1.587  -2.455   5.092
  138   1HD   PRO  13          1HD       PRO  13   4.451  -1.641   5.753
  139   2HD   PRO  13          2HD       PRO  13   3.849  -2.667   4.414
  140    HA   PRO  14           HA       PRO  14  -1.079   0.998   1.907
  141   1HB   PRO  14          1HB       PRO  14  -0.463   3.030   0.113
  142   2HB   PRO  14          2HB       PRO  14  -0.883   3.281   1.812
  143   1HG   PRO  14          1HG       PRO  14   1.934   3.155   0.601
  144   2HG   PRO  14          2HG       PRO  14   1.277   4.394   1.694
  145   1HD   PRO  14          1HD       PRO  14   2.820   2.295   2.650
  146   2HD   PRO  14          2HD       PRO  14   1.460   2.928   3.620
  Start of MODEL   10
    1   1H    ARG   1          H         ARG   1   2.811   0.537   0.637
    2    HA   ARG   1           HA       ARG   1   1.370  -0.602  -1.429
    3   1HB   ARG   1          1HB       ARG   1   2.090   1.971  -2.140
    4   2HB   ARG   1          2HB       ARG   1   3.478   1.076  -2.727
    5   1HG   ARG   1          1HG       ARG   1   0.979  -0.307  -3.402
    6   2HG   ARG   1          2HG       ARG   1   0.965   1.339  -4.004
    7   1HD   ARG   1          1HD       ARG   1   3.580   0.127  -4.487
    8   2HD   ARG   1          2HD       ARG   1   2.318  -0.900  -5.136
    9    HE   ARG   1           HE       ARG   1   1.728   1.801  -5.866
   10   1HH1  ARG   1          2HH2      ARG   1   4.081  -0.719  -6.569
   11   2HH1  ARG   1          1HH2      ARG   1   4.416  -0.138  -8.167
   12   1HH2  ARG   1          2HH1      ARG   1   2.169   2.567  -7.973
   13   2HH2  ARG   1          1HH1      ARG   1   3.322   1.744  -8.970
   14    H    VAL   2           H        VAL   2   3.006  -1.811  -3.012
   15    HA   VAL   2           HA       VAL   2   5.308  -2.598  -1.370
   16    HB   VAL   2           HB       VAL   2   3.475  -4.258  -1.812
   17   1HG1  VAL   2          1HG1      VAL   2   2.896  -4.980  -3.892
   18   2HG1  VAL   2          2HG1      VAL   2   3.423  -3.339  -4.338
   19   3HG1  VAL   2          3HG1      VAL   2   4.525  -4.718  -4.560
   20   1HG2  VAL   2          1HG2      VAL   2   5.093  -6.087  -2.530
   21   2HG2  VAL   2          2HG2      VAL   2   6.312  -4.803  -2.722
   22   3HG2  VAL   2          3HG2      VAL   2   5.584  -5.108  -1.127
   23    H    ARG   3           H        ARG   3   6.839  -1.090  -2.093
   24    HA   ARG   3           HA       ARG   3   7.107  -0.644  -4.882
   25   1HB   ARG   3          1HB       ARG   3   8.997   0.820  -4.220
   26   2HB   ARG   3          2HB       ARG   3   7.600   1.137  -3.211
   27   1HG   ARG   3          1HG       ARG   3   8.577  -0.459  -1.478
   28   2HG   ARG   3          2HG       ARG   3  10.020  -0.571  -2.467
   29   1HD   ARG   3          1HD       ARG   3  10.457   1.125  -0.798
   30   2HD   ARG   3          2HD       ARG   3  10.236   1.967  -2.320
   31    HE   ARG   3           HE       ARG   3   7.706   1.712  -0.944
   32   1HH1  ARG   3          2HH2      ARG   3  10.720   3.528  -0.896
   33   2HH1  ARG   3          1HH2      ARG   3  10.018   4.921  -0.143
   34   1HH2  ARG   3          2HH1      ARG   3   6.779   3.551   0.050
   35   2HH2  ARG   3          1HH1      ARG   3   7.761   4.934   0.399
   36    H    THR   4           H        THR   4   9.904  -0.555  -5.282
   37    HA   THR   4           HA       THR   4  10.900  -3.212  -4.592
   38    HB   THR   4           HB       THR   4  11.073  -2.306  -7.472
   39    HG1  THR   4           1HG      THR   4   8.911  -3.038  -7.747
   40   1HG2  THR   4          1HG2      THR   4  10.312  -5.061  -6.481
   41   2HG2  THR   4          2HG2      THR   4  11.251  -4.607  -7.924
   42   3HG2  THR   4          3HG2      THR   4  12.007  -4.542  -6.313
   43    H    ARG   5           H        ARG   5  13.073  -3.294  -4.250
   44    HA   ARG   5           HA       ARG   5  14.668  -1.153  -5.275
   45   1HB   ARG   5          1HB       ARG   5  13.986  -1.463  -2.349
   46   2HB   ARG   5          2HB       ARG   5  15.621  -0.980  -2.752
   47   1HG   ARG   5          1HG       ARG   5  14.761   0.940  -4.070
   48   2HG   ARG   5          2HG       ARG   5  13.110   0.437  -3.762
   49   1HD   ARG   5          1HD       ARG   5  13.282   1.933  -2.016
   50   2HD   ARG   5          2HD       ARG   5  13.988   0.559  -1.189
   51    HE   ARG   5           HE       ARG   5  16.003   2.016  -2.683
   52   1HH1  ARG   5          2HH2      ARG   5  14.122   2.086   0.290
   53   2HH1  ARG   5          1HH2      ARG   5  15.287   3.032   1.155
   54   1HH2  ARG   5          2HH1      ARG   5  17.540   3.264  -1.542
   55   2HH2  ARG   5          1HH1      ARG   5  17.245   3.707   0.106
   56    H    LYS   6           H        LYS   6  17.078  -1.567  -4.727
   57    HA   LYS   6           HA       LYS   6  18.792  -2.956  -4.942
   58   1HB   LYS   6          1HB       LYS   6  18.236  -3.021  -2.465
   59   2HB   LYS   6          2HB       LYS   6  17.458  -4.565  -2.751
   60   1HG   LYS   6          1HG       LYS   6  19.517  -5.485  -2.423
   61   2HG   LYS   6          2HG       LYS   6  19.889  -4.926  -4.042
   62   1HD   LYS   6          1HD       LYS   6  20.193  -2.906  -1.844
   63   2HD   LYS   6          2HD       LYS   6  21.349  -4.223  -1.848
   64   1HE   LYS   6          1HE       LYS   6  21.567  -3.656  -4.440
   65   2HE   LYS   6          2HE       LYS   6  20.879  -2.113  -3.970
   66   1HZ   LYS   6          1HZ       LYS   6  23.400  -3.301  -3.119
   67   2HZ   LYS   6          2HZ       LYS   6  23.119  -1.807  -3.715
   68   3HZ   LYS   6          3HZ       LYS   6  22.680  -2.172  -2.184
   69    H    GLY   7           H        GLY   7  16.284  -3.464  -6.567
   70   1HA   GLY   7          1HA       GLY   7  15.757  -4.909  -8.217
   71   2HA   GLY   7          2HA       GLY   7  17.182  -5.851  -7.825
   72    H    ARG   8           H        ARG   8  14.841  -5.099  -5.272
   73    HA   ARG   8           HA       ARG   8  13.673  -7.725  -5.611
   74   1HB   ARG   8          1HB       ARG   8  13.858  -7.782  -2.933
   75   2HB   ARG   8          2HB       ARG   8  15.165  -8.374  -3.940
   76   1HG   ARG   8          1HG       ARG   8  16.181  -6.021  -3.836
   77   2HG   ARG   8          2HG       ARG   8  14.963  -5.619  -2.643
   78   1HD   ARG   8          1HD       ARG   8  16.529  -8.134  -2.147
   79   2HD   ARG   8          2HD       ARG   8  17.407  -6.625  -1.981
   80    HE   ARG   8           HE       ARG   8  16.077  -6.052  -0.109
   81   1HH1  ARG   8          2HH2      ARG   8  14.813  -8.934  -1.683
   82   2HH1  ARG   8          1HH2      ARG   8  13.737  -9.326  -0.384
   83   1HH2  ARG   8          2HH1      ARG   8  14.658  -6.570   1.605
   84   2HH2  ARG   8          1HH1      ARG   8  13.648  -7.973   1.499
   85    H    ARG   9           H        ARG   9  11.537  -7.933  -4.582
   86    HA   ARG   9           HA       ARG   9  10.276  -5.372  -4.383
   87   1HB   ARG   9          1HB       ARG   9   9.042  -6.976  -5.669
   88   2HB   ARG   9          2HB       ARG   9   9.293  -8.250  -4.491
   89   1HG   ARG   9          1HG       ARG   9   7.771  -5.753  -3.687
   90   2HG   ARG   9          2HG       ARG   9   6.956  -6.998  -4.615
   91   1HD   ARG   9          1HD       ARG   9   8.404  -8.328  -2.512
   92   2HD   ARG   9          2HD       ARG   9   7.569  -6.972  -1.781
   93    HE   ARG   9           HE       ARG   9   5.495  -7.976  -2.286
   94   1HH1  ARG   9          2HH2      ARG   9   8.096  -9.683  -3.930
   95   2HH1  ARG   9          1HH2      ARG   9   7.095 -11.013  -4.405
   96   1HH2  ARG   9          2HH1      ARG   9   4.173  -9.731  -2.913
   97   2HH2  ARG   9          1HH1      ARG   9   4.848 -11.042  -3.823
   98    H    ILE  10           H        ILE  10   9.277  -4.524  -2.491
   99    HA   ILE  10           HA       ILE  10   9.491  -6.167  -0.080
  100    HB   ILE  10           HB       ILE  10  10.090  -3.339   0.346
  101   1HG1  ILE  10          2HG1      ILE  10  12.561  -3.846  -0.396
  102   2HG1  ILE  10          3HG1      ILE  10  11.802  -4.969  -1.507
  103   1HG2  ILE  10          1HG2      ILE  10  11.537  -4.161   1.980
  104   2HG2  ILE  10          2HG2      ILE  10  10.204  -5.341   1.958
  105   3HG2  ILE  10          3HG2      ILE  10  11.744  -5.723   1.152
  106   1HD1  ILE  10          1HD1      ILE  10  11.785  -3.043  -2.813
  107   2HD1  ILE  10          2HD1      ILE  10  10.203  -2.878  -2.013
  108   3HD1  ILE  10          3HD1      ILE  10  11.606  -1.967  -1.406
  109    H    ARG  11           H        ARG  11   7.933  -5.630   1.570
  110    HA   ARG  11           HA       ARG  11   5.793  -3.968   0.500
  111   1HB   ARG  11          1HB       ARG  11   5.528  -6.621   0.815
  112   2HB   ARG  11          2HB       ARG  11   5.247  -6.187   2.489
  113   1HG   ARG  11          1HG       ARG  11   3.471  -4.537   1.683
  114   2HG   ARG  11          2HG       ARG  11   3.682  -5.182   0.067
  115   1HD   ARG  11          1HD       ARG  11   2.426  -7.027   0.536
  116   2HD   ARG  11          2HD       ARG  11   3.318  -7.351   2.010
  117    HE   ARG  11           HE       ARG  11   0.784  -5.918   1.791
  118   1HH1  ARG  11          2HH2      ARG  11   3.684  -6.296   3.747
  119   2HH1  ARG  11          1HH2      ARG  11   2.929  -5.742   5.203
  120   1HH2  ARG  11          2HH1      ARG  11  -0.214  -5.188   3.712
  121   2HH2  ARG  11          1HH1      ARG  11   0.696  -5.107   5.184
  122    H    ILE  12           H        ILE  12   4.842  -2.456   1.941
  123    HA   ILE  12           HA       ILE  12   5.021  -2.569   4.703
  124    HB   ILE  12           HB       ILE  12   7.509  -2.140   3.798
  125   1HG1  ILE  12          2HG1      ILE  12   6.498  -0.726   6.269
  126   2HG1  ILE  12          3HG1      ILE  12   6.559  -2.474   6.162
  127   1HG2  ILE  12          1HG2      ILE  12   6.308   0.624   4.115
  128   2HG2  ILE  12          2HG2      ILE  12   8.048   0.260   4.042
  129   3HG2  ILE  12          3HG2      ILE  12   7.007  -0.079   2.637
  130   1HD1  ILE  12          1HD1      ILE  12   8.623  -1.596   7.199
  131   2HD1  ILE  12          2HD1      ILE  12   8.996  -2.367   5.638
  132   3HD1  ILE  12          3HD1      ILE  12   8.931  -0.593   5.762
  133    HA   PRO  13           HA       PRO  13   2.981   1.377   4.846
  134   1HB   PRO  13          1HB       PRO  13   2.193   0.469   6.834
  135   2HB   PRO  13          2HB       PRO  13   0.646   0.521   5.971
  136   1HG   PRO  13          1HG       PRO  13   1.423  -1.857   6.995
  137   2HG   PRO  13          2HG       PRO  13   0.827  -1.832   5.317
  138   1HD   PRO  13          1HD       PRO  13   3.716  -2.023   6.276
  139   2HD   PRO  13          2HD       PRO  13   2.939  -2.812   4.868
  140    HA   PRO  14           HA       PRO  14  -0.110   2.260   1.879
  141   1HB   PRO  14          1HB       PRO  14   1.382   3.856   0.159
  142   2HB   PRO  14          2HB       PRO  14   0.915   4.311   1.804
  143   1HG   PRO  14          1HG       PRO  14   3.597   3.121   0.902
  144   2HG   PRO  14          2HG       PRO  14   3.333   4.557   1.917
  145   1HD   PRO  14          1HD       PRO  14   3.898   2.080   3.035
  146   2HD   PRO  14          2HD       PRO  14   2.775   3.203   3.853
  Start of MODEL   11
    1   1H    ARG   1          H         ARG   1   2.170   0.327   0.989
    2    HA   ARG   1           HA       ARG   1   1.104  -0.092  -1.655
    3   1HB   ARG   1          1HB       ARG   1   2.646   2.271  -0.828
    4   2HB   ARG   1          2HB       ARG   1   3.478   1.399  -2.100
    5   1HG   ARG   1          1HG       ARG   1   1.703   1.670  -3.642
    6   2HG   ARG   1          2HG       ARG   1   0.511   1.930  -2.384
    7   1HD   ARG   1          1HD       ARG   1   0.916   4.181  -2.302
    8   2HD   ARG   1          2HD       ARG   1   2.654   3.961  -2.317
    9    HE   ARG   1           HE       ARG   1   1.004   4.583  -4.595
   10   1HH1  ARG   1          2HH2      ARG   1   3.830   2.694  -3.683
   11   2HH1  ARG   1          1HH2      ARG   1   4.530   2.739  -5.267
   12   1HH2  ARG   1          2HH1      ARG   1   1.927   4.642  -6.685
   13   2HH2  ARG   1          1HH1      ARG   1   3.440   3.854  -6.986
   14    H    VAL   2           H        VAL   2   3.090  -0.802  -3.174
   15    HA   VAL   2           HA       VAL   2   5.041  -2.271  -1.558
   16    HB   VAL   2           HB       VAL   2   3.041  -3.666  -2.260
   17   1HG1  VAL   2          1HG1      VAL   2   3.222  -2.496  -4.659
   18   2HG1  VAL   2          2HG1      VAL   2   4.252  -3.911  -4.978
   19   3HG1  VAL   2          3HG1      VAL   2   2.569  -4.138  -4.446
   20   1HG2  VAL   2          1HG2      VAL   2   4.482  -5.583  -2.986
   21   2HG2  VAL   2          2HG2      VAL   2   5.842  -4.444  -3.133
   22   3HG2  VAL   2          3HG2      VAL   2   5.083  -4.725  -1.547
   23    H    ARG   3           H        ARG   3   6.942  -1.312  -2.092
   24    HA   ARG   3           HA       ARG   3   7.232  -0.467  -4.846
   25   1HB   ARG   3          1HB       ARG   3   8.047   0.626  -2.307
   26   2HB   ARG   3          2HB       ARG   3   9.510   0.238  -3.188
   27   1HG   ARG   3          1HG       ARG   3   7.485   1.515  -4.913
   28   2HG   ARG   3          2HG       ARG   3   7.914   2.524  -3.545
   29   1HD   ARG   3          1HD       ARG   3  10.416   1.778  -4.254
   30   2HD   ARG   3          2HD       ARG   3   9.649   1.563  -5.815
   31    HE   ARG   3           HE       ARG   3   8.774   4.073  -4.899
   32   1HH1  ARG   3          2HH2      ARG   3  11.862   2.559  -5.647
   33   2HH1  ARG   3          1HH2      ARG   3  12.627   4.046  -6.098
   34   1HH2  ARG   3          2HH1      ARG   3   9.784   6.035  -5.494
   35   2HH2  ARG   3          1HH1      ARG   3  11.437   6.036  -6.010
   36    H    THR   4           H        THR   4  10.119  -0.463  -4.934
   37    HA   THR   4           HA       THR   4  10.892  -3.227  -4.410
   38    HB   THR   4           HB       THR   4  11.363  -2.049  -7.166
   39    HG1  THR   4           1HG      THR   4   9.216  -2.487  -7.630
   40   1HG2  THR   4          1HG2      THR   4  12.413  -4.240  -6.607
   41   2HG2  THR   4          2HG2      THR   4  10.829  -4.870  -6.094
   42   3HG2  THR   4          3HG2      THR   4  11.114  -4.462  -7.803
   43    H    ARG   5           H        ARG   5  13.052  -3.506  -3.969
   44    HA   ARG   5           HA       ARG   5  14.761  -1.243  -4.472
   45   1HB   ARG   5          1HB       ARG   5  13.818  -0.906  -2.163
   46   2HB   ARG   5          2HB       ARG   5  14.430  -2.478  -1.690
   47   1HG   ARG   5          1HG       ARG   5  16.760  -1.732  -2.171
   48   2HG   ARG   5          2HG       ARG   5  16.163  -0.167  -2.687
   49   1HD   ARG   5          1HD       ARG   5  15.057  -0.741  -0.071
   50   2HD   ARG   5          2HD       ARG   5  16.784  -1.031  -0.013
   51    HE   ARG   5           HE       ARG   5  17.188   1.264  -0.415
   52   1HH1  ARG   5          2HH2      ARG   5  13.772   0.528  -0.826
   53   2HH1  ARG   5          1HH2      ARG   5  13.290   2.191  -0.878
   54   1HH2  ARG   5          2HH1      ARG   5  16.552   3.457  -0.483
   55   2HH2  ARG   5          1HH1      ARG   5  14.881   3.868  -0.681
   56    H    LYS   6           H        LYS   6  17.110  -1.831  -4.230
   57    HA   LYS   6           HA       LYS   6  18.755  -3.193  -4.841
   58   1HB   LYS   6          1HB       LYS   6  17.574  -4.241  -2.357
   59   2HB   LYS   6          2HB       LYS   6  18.546  -5.415  -3.222
   60   1HG   LYS   6          1HG       LYS   6  20.332  -4.414  -2.216
   61   2HG   LYS   6          2HG       LYS   6  20.136  -3.158  -3.423
   62   1HD   LYS   6          1HD       LYS   6  19.397  -1.639  -1.888
   63   2HD   LYS   6          2HD       LYS   6  18.289  -2.786  -1.159
   64   1HE   LYS   6          1HE       LYS   6  19.816  -2.400   0.593
   65   2HE   LYS   6          2HE       LYS   6  20.441  -3.877  -0.113
   66   1HZ   LYS   6          1HZ       LYS   6  22.171  -2.771  -1.056
   67   2HZ   LYS   6          2HZ       LYS   6  21.399  -1.335  -1.144
   68   3HZ   LYS   6          3HZ       LYS   6  21.978  -1.864   0.288
   69    H    GLY   7           H        GLY   7  16.429  -3.363  -6.521
   70   1HA   GLY   7          1HA       GLY   7  15.605  -4.626  -8.187
   71   2HA   GLY   7          2HA       GLY   7  17.048  -5.611  -8.044
   72    H    ARG   8           H        ARG   8  14.727  -5.127  -5.358
   73    HA   ARG   8           HA       ARG   8  13.711  -7.793  -5.866
   74   1HB   ARG   8          1HB       ARG   8  14.838  -6.777  -3.210
   75   2HB   ARG   8          2HB       ARG   8  13.894  -8.246  -3.355
   76   1HG   ARG   8          1HG       ARG   8  15.586  -9.099  -5.048
   77   2HG   ARG   8          2HG       ARG   8  16.557  -7.672  -4.737
   78   1HD   ARG   8          1HD       ARG   8  17.287  -8.448  -2.694
   79   2HD   ARG   8          2HD       ARG   8  15.728  -9.129  -2.276
   80    HE   ARG   8           HE       ARG   8  16.388 -11.181  -3.200
   81   1HH1  ARG   8          2HH2      ARG   8  18.597  -8.656  -4.261
   82   2HH1  ARG   8          1HH2      ARG   8  19.718  -9.762  -4.983
   83   1HH2  ARG   8          2HH1      ARG   8  17.867 -12.641  -4.152
   84   2HH2  ARG   8          1HH1      ARG   8  19.301 -12.043  -4.920
   85    H    ARG   9           H        ARG   9  11.672  -8.232  -4.500
   86    HA   ARG   9           HA       ARG   9  10.162  -5.784  -4.446
   87   1HB   ARG   9          1HB       ARG   9   9.062  -7.569  -5.627
   88   2HB   ARG   9          2HB       ARG   9   9.434  -8.740  -4.376
   89   1HG   ARG   9          1HG       ARG   9   7.721  -6.329  -3.706
   90   2HG   ARG   9          2HG       ARG   9   7.002  -7.698  -4.530
   91   1HD   ARG   9          1HD       ARG   9   8.535  -8.837  -2.424
   92   2HD   ARG   9          2HD       ARG   9   7.762  -7.435  -1.713
   93    HE   ARG   9           HE       ARG   9   5.797  -8.800  -3.258
   94   1HH1  ARG   9          2HH2      ARG   9   7.725  -9.312  -0.359
   95   2HH1  ARG   9          1HH2      ARG   9   6.560 -10.355   0.386
   96   1HH2  ARG   9          2HH1      ARG   9   4.260 -10.177  -2.276
   97   2HH2  ARG   9          1HH1      ARG   9   4.576 -10.850  -0.711
   98    H    ILE  10           H        ILE  10   9.277  -4.879  -2.553
   99    HA   ILE  10           HA       ILE  10   9.506  -6.435  -0.098
  100    HB   ILE  10           HB       ILE  10  10.461  -3.591  -0.162
  101   1HG1  ILE  10          2HG1      ILE  10  11.794  -4.893  -1.815
  102   2HG1  ILE  10          3HG1      ILE  10  12.729  -4.281  -0.466
  103   1HG2  ILE  10          1HG2      ILE  10  11.840  -4.792   1.795
  104   2HG2  ILE  10          2HG2      ILE  10  10.223  -4.090   2.035
  105   3HG2  ILE  10          3HG2      ILE  10  10.403  -5.842   1.779
  106   1HD1  ILE  10          1HD1      ILE  10  13.250  -6.375   0.278
  107   2HD1  ILE  10          2HD1      ILE  10  11.589  -6.967   0.040
  108   3HD1  ILE  10          3HD1      ILE  10  12.721  -6.914  -1.333
  109    H    ARG  11           H        ARG  11   8.267  -5.302   1.728
  110    HA   ARG  11           HA       ARG  11   5.939  -4.071   0.497
  111   1HB   ARG  11          1HB       ARG  11   5.943  -6.351   1.941
  112   2HB   ARG  11          2HB       ARG  11   5.863  -5.232   3.287
  113   1HG   ARG  11          1HG       ARG  11   3.783  -4.305   2.555
  114   2HG   ARG  11          2HG       ARG  11   3.965  -4.941   0.932
  115   1HD   ARG  11          1HD       ARG  11   3.028  -6.945   1.501
  116   2HD   ARG  11          2HD       ARG  11   4.021  -7.095   2.937
  117    HE   ARG  11           HE       ARG  11   1.297  -6.101   2.825
  118   1HH1  ARG  11          2HH2      ARG  11   4.332  -5.780   4.578
  119   2HH1  ARG  11          1HH2      ARG  11   3.578  -5.239   6.040
  120   1HH2  ARG  11          2HH1      ARG  11   0.302  -5.387   4.755
  121   2HH2  ARG  11          1HH1      ARG  11   1.270  -5.014   6.141
  122    H    ILE  12           H        ILE  12   5.198  -2.059   1.278
  123    HA   ILE  12           HA       ILE  12   6.438  -1.024   3.700
  124    HB   ILE  12           HB       ILE  12   6.407   1.077   1.784
  125   1HG1  ILE  12          2HG1      ILE  12   6.596  -0.876   0.161
  126   2HG1  ILE  12          3HG1      ILE  12   7.822   0.371   0.054
  127   1HG2  ILE  12          1HG2      ILE  12   7.851   1.444   3.498
  128   2HG2  ILE  12          2HG2      ILE  12   8.335  -0.264   3.613
  129   3HG2  ILE  12          3HG2      ILE  12   9.000   0.764   2.321
  130   1HD1  ILE  12          1HD1      ILE  12   8.202  -2.429   0.503
  131   2HD1  ILE  12          2HD1      ILE  12   9.445  -1.158   0.430
  132   3HD1  ILE  12          3HD1      ILE  12   8.701  -1.588   1.989
  133    HA   PRO  13           HA       PRO  13   2.802   0.893   4.940
  134   1HB   PRO  13          1HB       PRO  13   2.835  -0.720   6.612
  135   2HB   PRO  13          2HB       PRO  13   1.256  -1.130   5.921
  136   1HG   PRO  13          1HG       PRO  13   3.085  -3.112   6.118
  137   2HG   PRO  13          2HG       PRO  13   2.213  -2.939   4.575
  138   1HD   PRO  13          1HD       PRO  13   5.072  -2.093   5.216
  139   2HD   PRO  13          2HD       PRO  13   4.410  -2.770   3.696
  140    HA   PRO  14           HA       PRO  14  -0.757   1.085   2.438
  141   1HB   PRO  14          1HB       PRO  14  -0.288   3.519   1.178
  142   2HB   PRO  14          2HB       PRO  14  -0.599   3.325   2.908
  143   1HG   PRO  14          1HG       PRO  14   2.133   3.590   1.535
  144   2HG   PRO  14          2HG       PRO  14   1.533   4.496   2.943
  145   1HD   PRO  14          1HD       PRO  14   3.165   2.273   3.245
  146   2HD   PRO  14          2HD       PRO  14   1.863   2.603   4.424
  Start of MODEL   12
    1   1H    ARG   1          H         ARG   1   1.855   0.069   0.949
    2    HA   ARG   1           HA       ARG   1   2.015   0.684  -1.892
    3   1HB   ARG   1          1HB       ARG   1   3.023   2.170   0.471
    4   2HB   ARG   1          2HB       ARG   1   4.258   1.903  -0.744
    5   1HG   ARG   1          1HG       ARG   1   2.793   2.897  -2.488
    6   2HG   ARG   1          2HG       ARG   1   1.507   3.106  -1.315
    7   1HD   ARG   1          1HD       ARG   1   2.672   5.240  -1.568
    8   2HD   ARG   1          2HD       ARG   1   3.015   4.614   0.033
    9    HE   ARG   1           HE       ARG   1   4.977   3.843  -2.027
   10   1HH1  ARG   1          2HH2      ARG   1   4.114   6.171   0.467
   11   2HH1  ARG   1          1HH2      ARG   1   5.734   6.749   0.668
   12   1HH2  ARG   1          2HH1      ARG   1   7.116   4.605  -1.761
   13   2HH2  ARG   1          1HH1      ARG   1   7.453   5.852  -0.608
   14    H    VAL   2           H        VAL   2   3.518  -0.537  -3.049
   15    HA   VAL   2           HA       VAL   2   5.419  -2.103  -1.447
   16    HB   VAL   2           HB       VAL   2   3.472  -3.423  -2.254
   17   1HG1  VAL   2          1HG1      VAL   2   4.567  -3.185  -5.050
   18   2HG1  VAL   2          2HG1      VAL   2   2.970  -3.749  -4.503
   19   3HG1  VAL   2          3HG1      VAL   2   3.369  -2.015  -4.449
   20   1HG2  VAL   2          1HG2      VAL   2   5.164  -5.003  -3.711
   21   2HG2  VAL   2          2HG2      VAL   2   6.316  -3.978  -2.823
   22   3HG2  VAL   2          3HG2      VAL   2   5.110  -4.940  -1.933
   23    H    ARG   3           H        ARG   3   7.286  -0.945  -1.789
   24    HA   ARG   3           HA       ARG   3   7.766   0.106  -4.400
   25   1HB   ARG   3          1HB       ARG   3   8.483   0.931  -1.875
   26   2HB   ARG   3          2HB       ARG   3   9.956   0.110  -2.352
   27   1HG   ARG   3          1HG       ARG   3  10.492   1.696  -3.924
   28   2HG   ARG   3          2HG       ARG   3   8.836   1.855  -4.477
   29   1HD   ARG   3          1HD       ARG   3   8.284   3.446  -2.809
   30   2HD   ARG   3          2HD       ARG   3   9.578   2.935  -1.745
   31    HE   ARG   3           HE       ARG   3  10.684   3.942  -4.211
   32   1HH1  ARG   3          2HH2      ARG   3   9.157   5.020  -1.231
   33   2HH1  ARG   3          1HH2      ARG   3   9.912   6.580  -1.258
   34   1HH2  ARG   3          2HH1      ARG   3  11.680   5.998  -4.248
   35   2HH2  ARG   3          1HH1      ARG   3  11.356   7.140  -2.986
   36    H    THR   4           H        THR   4  10.556  -0.178  -4.698
   37    HA   THR   4           HA       THR   4  11.274  -2.950  -4.402
   38    HB   THR   4           HB       THR   4  11.014  -1.827  -7.228
   39    HG1  THR   4           1HG      THR   4   8.870  -1.982  -6.506
   40   1HG2  THR   4          1HG2      THR   4  12.430  -3.944  -6.675
   41   2HG2  THR   4          2HG2      THR   4  10.885  -4.710  -6.232
   42   3HG2  THR   4          3HG2      THR   4  11.149  -4.137  -7.897
   43    H    ARG   5           H        ARG   5  13.497  -3.327  -4.662
   44    HA   ARG   5           HA       ARG   5  15.134  -1.291  -5.707
   45   1HB   ARG   5          1HB       ARG   5  14.586  -0.328  -3.436
   46   2HB   ARG   5          2HB       ARG   5  15.253  -1.763  -2.684
   47   1HG   ARG   5          1HG       ARG   5  17.462  -1.215  -3.255
   48   2HG   ARG   5          2HG       ARG   5  16.985  -0.284  -4.661
   49   1HD   ARG   5          1HD       ARG   5  16.311   1.600  -3.332
   50   2HD   ARG   5          2HD       ARG   5  16.262   0.654  -1.857
   51    HE   ARG   5           HE       ARG   5  18.550   1.030  -1.591
   52   1HH1  ARG   5          2HH2      ARG   5  17.715   1.520  -4.974
   53   2HH1  ARG   5          1HH2      ARG   5  19.296   2.071  -5.417
   54   1HH2  ARG   5          2HH1      ARG   5  20.636   1.759  -2.175
   55   2HH2  ARG   5          1HH1      ARG   5  20.969   2.208  -3.814
   56    H    LYS   6           H        LYS   6  17.491  -1.962  -5.618
   57    HA   LYS   6           HA       LYS   6  18.974  -3.549  -6.092
   58   1HB   LYS   6          1HB       LYS   6  18.009  -4.484  -3.375
   59   2HB   LYS   6          2HB       LYS   6  19.450  -5.093  -4.165
   60   1HG   LYS   6          1HG       LYS   6  19.573  -2.227  -4.306
   61   2HG   LYS   6          2HG       LYS   6  19.111  -2.634  -2.666
   62   1HD   LYS   6          1HD       LYS   6  21.305  -3.056  -2.263
   63   2HD   LYS   6          2HD       LYS   6  21.124  -4.502  -3.235
   64   1HE   LYS   6          1HE       LYS   6  22.654  -3.621  -4.665
   65   2HE   LYS   6          2HE       LYS   6  21.429  -2.464  -5.150
   66   1HZ   LYS   6          1HZ       LYS   6  22.208  -1.168  -3.135
   67   2HZ   LYS   6          2HZ       LYS   6  23.529  -2.128  -3.148
   68   3HZ   LYS   6          3HZ       LYS   6  23.191  -1.187  -4.439
   69    H    GLY   7           H        GLY   7  16.432  -3.937  -7.370
   70   1HA   GLY   7          1HA       GLY   7  15.317  -5.494  -8.546
   71   2HA   GLY   7          2HA       GLY   7  16.729  -6.516  -8.367
   72    H    ARG   8           H        ARG   8  14.825  -5.252  -5.603
   73    HA   ARG   8           HA       ARG   8  13.770  -7.939  -5.260
   74   1HB   ARG   8          1HB       ARG   8  15.039  -6.155  -3.122
   75   2HB   ARG   8          2HB       ARG   8  14.127  -7.604  -2.748
   76   1HG   ARG   8          1HG       ARG   8  16.544  -7.611  -4.610
   77   2HG   ARG   8          2HG       ARG   8  16.675  -7.891  -2.884
   78   1HD   ARG   8          1HD       ARG   8  14.714  -9.529  -4.521
   79   2HD   ARG   8          2HD       ARG   8  16.414  -9.951  -4.532
   80    HE   ARG   8           HE       ARG   8  16.290 -10.540  -2.225
   81   1HH1  ARG   8          2HH2      ARG   8  13.243  -9.213  -3.382
   82   2HH1  ARG   8          1HH2      ARG   8  12.340  -9.753  -2.007
   83   1HH2  ARG   8          2HH1      ARG   8  15.097 -11.253  -0.410
   84   2HH2  ARG   8          1HH1      ARG   8  13.401 -10.920  -0.305
   85    H    ARG   9           H        ARG   9  11.837  -7.957  -3.683
   86    HA   ARG   9           HA       ARG   9  10.412  -5.441  -4.010
   87   1HB   ARG   9          1HB       ARG   9   9.383  -7.342  -5.225
   88   2HB   ARG   9          2HB       ARG   9   9.353  -8.301  -3.759
   89   1HG   ARG   9          1HG       ARG   9   8.030  -5.634  -3.537
   90   2HG   ARG   9          2HG       ARG   9   7.253  -6.752  -4.641
   91   1HD   ARG   9          1HD       ARG   9   8.032  -8.098  -2.146
   92   2HD   ARG   9          2HD       ARG   9   7.001  -6.717  -1.825
   93    HE   ARG   9           HE       ARG   9   6.040  -8.419  -4.016
   94   1HH1  ARG   9          2HH2      ARG   9   5.981  -7.855  -0.544
   95   2HH1  ARG   9          1HH2      ARG   9   4.487  -8.696  -0.304
   96   1HH2  ARG   9          2HH1      ARG   9   4.070  -9.530  -3.700
   97   2HH2  ARG   9          1HH1      ARG   9   3.392  -9.657  -2.111
   98    H    ILE  10           H        ILE  10   9.263  -4.567  -2.190
   99    HA   ILE  10           HA       ILE  10   9.549  -6.044   0.317
  100    HB   ILE  10           HB       ILE  10  10.083  -3.107   0.298
  101   1HG1  ILE  10          2HG1      ILE  10  11.560  -4.010  -1.458
  102   2HG1  ILE  10          3HG1      ILE  10  12.448  -3.426  -0.066
  103   1HG2  ILE  10          1HG2      ILE  10  10.003  -5.164   2.225
  104   2HG2  ILE  10          2HG2      ILE  10  11.714  -4.709   2.045
  105   3HG2  ILE  10          3HG2      ILE  10  10.501  -3.469   2.445
  106   1HD1  ILE  10          1HD1      ILE  10  11.793  -6.211   0.374
  107   2HD1  ILE  10          2HD1      ILE  10  12.543  -6.033  -1.231
  108   3HD1  ILE  10          3HD1      ILE  10  13.399  -5.457   0.220
  109    H    ARG  11           H        ARG  11   8.062  -5.171   2.035
  110    HA   ARG  11           HA       ARG  11   5.780  -3.883   0.769
  111   1HB   ARG  11          1HB       ARG  11   5.643  -6.463   1.399
  112   2HB   ARG  11          2HB       ARG  11   5.447  -5.875   3.038
  113   1HG   ARG  11          1HG       ARG  11   3.485  -4.523   2.354
  114   2HG   ARG  11          2HG       ARG  11   3.709  -4.997   0.682
  115   1HD   ARG  11          1HD       ARG  11   3.633  -7.456   2.054
  116   2HD   ARG  11          2HD       ARG  11   2.436  -6.486   2.889
  117    HE   ARG  11           HE       ARG  11   2.267  -7.474   0.145
  118   1HH1  ARG  11          2HH2      ARG  11   1.158  -4.967   2.351
  119   2HH1  ARG  11          1HH2      ARG  11  -0.284  -4.634   1.451
  120   1HH2  ARG  11          2HH1      ARG  11   0.365  -7.036  -1.043
  121   2HH2  ARG  11          1HH1      ARG  11  -0.738  -5.819  -0.492
  122    H    ILE  12           H        ILE  12   4.724  -2.271   2.031
  123    HA   ILE  12           HA       ILE  12   5.216  -2.009   4.809
  124    HB   ILE  12           HB       ILE  12   7.382  -1.236   3.673
  125   1HG1  ILE  12          2HG1      ILE  12   6.288   0.930   5.417
  126   2HG1  ILE  12          3HG1      ILE  12   6.305  -0.701   6.058
  127   1HG2  ILE  12          1HG2      ILE  12   6.032   1.403   3.297
  128   2HG2  ILE  12          2HG2      ILE  12   7.491   0.737   2.526
  129   3HG2  ILE  12          3HG2      ILE  12   5.881   0.177   2.014
  130   1HD1  ILE  12          1HD1      ILE  12   8.728   0.716   4.855
  131   2HD1  ILE  12          2HD1      ILE  12   8.403   0.539   6.595
  132   3HD1  ILE  12          3HD1      ILE  12   8.725  -0.900   5.600
  133    HA   PRO  13           HA       PRO  13   1.715   0.521   4.825
  134   1HB   PRO  13          1HB       PRO  13   1.110  -1.036   6.441
  135   2HB   PRO  13          2HB       PRO  13  -0.260  -1.291   5.347
  136   1HG   PRO  13          1HG       PRO  13   1.209  -3.455   6.029
  137   2HG   PRO  13          2HG       PRO  13   0.811  -3.232   4.308
  138   1HD   PRO  13          1HD       PRO  13   3.468  -2.689   5.702
  139   2HD   PRO  13          2HD       PRO  13   3.167  -3.333   4.058
  140    HA   PRO  14           HA       PRO  14  -1.189   0.940   1.566
  141   1HB   PRO  14          1HB       PRO  14  -0.344   3.399   0.582
  142   2HB   PRO  14          2HB       PRO  14  -1.115   3.156   2.155
  143   1HG   PRO  14          1HG       PRO  14   1.892   3.378   1.583
  144   2HG   PRO  14          2HG       PRO  14   0.953   4.255   2.811
  145   1HD   PRO  14          1HD       PRO  14   2.393   1.969   3.450
  146   2HD   PRO  14          2HD       PRO  14   0.828   2.302   4.246
  Start of MODEL   13
    1   1H    ARG   1          H         ARG   1   1.895   0.121   1.078
    2    HA   ARG   1           HA       ARG   1   2.199   0.957  -1.695
    3   1HB   ARG   1          1HB       ARG   1   2.724   2.812  -0.207
    4   2HB   ARG   1          2HB       ARG   1   3.704   1.792   0.827
    5   1HG   ARG   1          1HG       ARG   1   5.295   1.422  -1.103
    6   2HG   ARG   1          2HG       ARG   1   4.339   2.529  -2.069
    7   1HD   ARG   1          1HD       ARG   1   5.990   3.972  -1.232
    8   2HD   ARG   1          2HD       ARG   1   4.711   4.213  -0.058
    9    HE   ARG   1           HE       ARG   1   6.186   2.072   0.962
   10   1HH1  ARG   1          2HH2      ARG   1   6.907   5.386   0.023
   11   2HH1  ARG   1          1HH2      ARG   1   8.204   5.560   1.158
   12   1HH2  ARG   1          2HH1      ARG   1   7.897   2.302   2.460
   13   2HH2  ARG   1          1HH1      ARG   1   8.771   3.794   2.554
   14    H    VAL   2           H        VAL   2   3.528  -0.318  -2.969
   15    HA   VAL   2           HA       VAL   2   5.423  -2.067  -1.567
   16    HB   VAL   2           HB       VAL   2   3.275  -3.191  -2.314
   17   1HG1  VAL   2          1HG1      VAL   2   2.769  -3.519  -4.553
   18   2HG1  VAL   2          2HG1      VAL   2   3.361  -1.841  -4.556
   19   3HG1  VAL   2          3HG1      VAL   2   4.427  -3.162  -5.093
   20   1HG2  VAL   2          1HG2      VAL   2   4.738  -4.857  -1.935
   21   2HG2  VAL   2          2HG2      VAL   2   4.868  -4.943  -3.709
   22   3HG2  VAL   2          3HG2      VAL   2   6.065  -4.015  -2.773
   23    H    ARG   3           H        ARG   3   7.335  -1.057  -2.045
   24    HA   ARG   3           HA       ARG   3   7.647  -0.095  -4.750
   25   1HB   ARG   3          1HB       ARG   3   8.461   0.896  -2.241
   26   2HB   ARG   3          2HB       ARG   3   9.946   0.273  -2.930
   27   1HG   ARG   3          1HG       ARG   3   9.710   2.601  -3.614
   28   2HG   ARG   3          2HG       ARG   3   9.498   1.591  -5.031
   29   1HD   ARG   3          1HD       ARG   3   7.467   2.539  -5.381
   30   2HD   ARG   3          2HD       ARG   3   6.900   1.860  -3.869
   31    HE   ARG   3           HE       ARG   3   8.480   4.256  -3.419
   32   1HH1  ARG   3          2HH2      ARG   3   5.285   3.130  -4.372
   33   2HH1  ARG   3          1HH2      ARG   3   4.481   4.575  -3.852
   34   1HH2  ARG   3          2HH1      ARG   3   7.420   6.160  -2.732
   35   2HH2  ARG   3          1HH1      ARG   3   5.704   6.309  -2.913
   36    H    THR   4           H        THR   4  10.379  -0.300  -5.192
   37    HA   THR   4           HA       THR   4  11.217  -3.015  -4.611
   38    HB   THR   4           HB       THR   4  11.079  -2.163  -7.522
   39    HG1  THR   4           1HG      THR   4   8.898  -2.027  -6.904
   40   1HG2  THR   4          1HG2      THR   4  10.790  -4.619  -7.838
   41   2HG2  THR   4          2HG2      THR   4  12.274  -4.285  -6.911
   42   3HG2  THR   4          3HG2      THR   4  10.808  -4.851  -6.073
   43    H    ARG   5           H        ARG   5  13.432  -3.294  -4.657
   44    HA   ARG   5           HA       ARG   5  15.035  -1.304  -5.881
   45   1HB   ARG   5          1HB       ARG   5  14.409  -0.227  -3.675
   46   2HB   ARG   5          2HB       ARG   5  15.136  -1.581  -2.834
   47   1HG   ARG   5          1HG       ARG   5  17.311  -0.939  -3.369
   48   2HG   ARG   5          2HG       ARG   5  16.842  -0.206  -4.890
   49   1HD   ARG   5          1HD       ARG   5  16.764   1.838  -3.909
   50   2HD   ARG   5          2HD       ARG   5  15.543   1.276  -2.785
   51    HE   ARG   5           HE       ARG   5  18.249   0.413  -2.067
   52   1HH1  ARG   5          2HH2      ARG   5  15.880   3.000  -1.781
   53   2HH1  ARG   5          1HH2      ARG   5  16.578   3.652  -0.336
   54   1HH2  ARG   5          2HH1      ARG   5  19.169   1.273  -0.160
   55   2HH2  ARG   5          1HH1      ARG   5  18.461   2.663   0.592
   56    H    LYS   6           H        LYS   6  17.414  -1.890  -5.698
   57    HA   LYS   6           HA       LYS   6  18.948  -3.460  -6.052
   58   1HB   LYS   6          1HB       LYS   6  17.960  -4.141  -3.277
   59   2HB   LYS   6          2HB       LYS   6  19.355  -4.921  -3.994
   60   1HG   LYS   6          1HG       LYS   6  20.517  -2.787  -4.244
   61   2HG   LYS   6          2HG       LYS   6  19.080  -1.889  -3.801
   62   1HD   LYS   6          1HD       LYS   6  20.652  -3.772  -1.980
   63   2HD   LYS   6          2HD       LYS   6  20.637  -2.022  -1.886
   64   1HE   LYS   6          1HE       LYS   6  17.934  -2.546  -1.764
   65   2HE   LYS   6          2HE       LYS   6  18.569  -3.986  -0.995
   66   1HZ   LYS   6          1HZ       LYS   6  18.294  -1.521   0.133
   67   2HZ   LYS   6          2HZ       LYS   6  19.060  -2.809   0.784
   68   3HZ   LYS   6          3HZ       LYS   6  19.906  -1.697  -0.062
   69    H    GLY   7           H        GLY   7  16.486  -4.013  -7.378
   70   1HA   GLY   7          1HA       GLY   7  15.423  -5.674  -8.452
   71   2HA   GLY   7          2HA       GLY   7  16.864  -6.637  -8.186
   72    H    ARG   8           H        ARG   8  14.860  -5.263  -5.546
   73    HA   ARG   8           HA       ARG   8  13.870  -7.949  -5.056
   74   1HB   ARG   8          1HB       ARG   8  15.100  -6.035  -3.012
   75   2HB   ARG   8          2HB       ARG   8  14.198  -7.468  -2.560
   76   1HG   ARG   8          1HG       ARG   8  16.023  -8.448  -4.448
   77   2HG   ARG   8          2HG       ARG   8  16.958  -7.237  -3.593
   78   1HD   ARG   8          1HD       ARG   8  17.315  -8.903  -2.061
   79   2HD   ARG   8          2HD       ARG   8  15.717  -8.485  -1.473
   80    HE   ARG   8           HE       ARG   8  14.901 -10.502  -2.333
   81   1HH1  ARG   8          2HH2      ARG   8  17.986  -9.771  -3.861
   82   2HH1  ARG   8          1HH2      ARG   8  18.084 -11.293  -4.683
   83   1HH2  ARG   8          2HH1      ARG   8  15.031 -12.508  -3.417
   84   2HH2  ARG   8          1HH1      ARG   8  16.392 -12.860  -4.429
   85    H    ARG   9           H        ARG   9  11.930  -7.914  -3.482
   86    HA   ARG   9           HA       ARG   9  10.465  -5.442  -3.948
   87   1HB   ARG   9          1HB       ARG   9   9.480  -7.418  -5.083
   88   2HB   ARG   9          2HB       ARG   9   9.446  -8.304  -3.571
   89   1HG   ARG   9          1HG       ARG   9   7.336  -7.497  -3.300
   90   2HG   ARG   9          2HG       ARG   9   8.083  -5.961  -2.909
   91   1HD   ARG   9          1HD       ARG   9   7.164  -5.035  -4.764
   92   2HD   ARG   9          2HD       ARG   9   8.057  -6.156  -5.774
   93    HE   ARG   9           HE       ARG   9   5.243  -6.393  -4.955
   94   1HH1  ARG   9          2HH2      ARG   9   8.053  -8.082  -6.234
   95   2HH1  ARG   9          1HH2      ARG   9   7.121  -9.353  -6.952
   96   1HH2  ARG   9          2HH1      ARG   9   4.013  -8.070  -5.903
   97   2HH2  ARG   9          1HH1      ARG   9   4.807  -9.347  -6.763
   98    H    ILE  10           H        ILE  10   9.414  -4.435  -2.172
   99    HA   ILE  10           HA       ILE  10   9.634  -5.817   0.399
  100    HB   ILE  10           HB       ILE  10  10.043  -3.050   0.833
  101   1HG1  ILE  10          2HG1      ILE  10  12.284  -2.828  -0.325
  102   2HG1  ILE  10          3HG1      ILE  10  11.836  -4.201  -1.319
  103   1HG2  ILE  10          1HG2      ILE  10  11.589  -5.591   1.250
  104   2HG2  ILE  10          2HG2      ILE  10  12.335  -4.015   1.607
  105   3HG2  ILE  10          3HG2      ILE  10  10.842  -4.502   2.443
  106   1HD1  ILE  10          1HD1      ILE  10   9.586  -2.452  -1.363
  107   2HD1  ILE  10          2HD1      ILE  10  11.024  -1.428  -1.583
  108   3HD1  ILE  10          3HD1      ILE  10  10.723  -2.787  -2.690
  109    H    ARG  11           H        ARG  11   7.911  -5.452   1.820
  110    HA   ARG  11           HA       ARG  11   5.781  -3.860   0.631
  111   1HB   ARG  11          1HB       ARG  11   5.630  -6.525   1.026
  112   2HB   ARG  11          2HB       ARG  11   5.195  -6.032   2.651
  113   1HG   ARG  11          1HG       ARG  11   3.413  -4.518   1.647
  114   2HG   ARG  11          2HG       ARG  11   3.794  -5.185   0.072
  115   1HD   ARG  11          1HD       ARG  11   3.399  -7.528   1.270
  116   2HD   ARG  11          2HD       ARG  11   2.532  -6.571   2.455
  117    HE   ARG  11           HE       ARG  11   1.767  -5.999  -0.325
  118   1HH1  ARG  11          2HH2      ARG  11   1.130  -7.972   2.518
  119   2HH1  ARG  11          1HH2      ARG  11  -0.490  -8.360   2.044
  120   1HH2  ARG  11          2HH1      ARG  11  -0.369  -6.510  -0.953
  121   2HH2  ARG  11          1HH1      ARG  11  -1.349  -7.523   0.055
  122    H    ILE  12           H        ILE  12   4.658  -2.386   2.001
  123    HA   ILE  12           HA       ILE  12   4.917  -2.450   4.809
  124    HB   ILE  12           HB       ILE  12   7.219  -1.645   3.894
  125   1HG1  ILE  12          2HG1      ILE  12   6.778  -1.709   6.227
  126   2HG1  ILE  12          3HG1      ILE  12   7.428  -0.120   5.873
  127   1HG2  ILE  12          1HG2      ILE  12   6.028   0.082   2.407
  128   2HG2  ILE  12          2HG2      ILE  12   5.832   1.031   3.901
  129   3HG2  ILE  12          3HG2      ILE  12   7.461   0.607   3.323
  130   1HD1  ILE  12          1HD1      ILE  12   5.605   0.503   7.165
  131   2HD1  ILE  12          2HD1      ILE  12   4.823   0.487   5.566
  132   3HD1  ILE  12          3HD1      ILE  12   4.636  -0.903   6.662
  133    HA   PRO  13           HA       PRO  13   1.714   0.479   4.958
  134   1HB   PRO  13          1HB       PRO  13   0.945  -1.047   6.534
  135   2HB   PRO  13          2HB       PRO  13  -0.418  -1.167   5.406
  136   1HG   PRO  13          1HG       PRO  13   0.849  -3.458   6.082
  137   2HG   PRO  13          2HG       PRO  13   0.509  -3.175   4.358
  138   1HD   PRO  13          1HD       PRO  13   3.172  -2.881   5.816
  139   2HD   PRO  13          2HD       PRO  13   2.854  -3.472   4.155
  140    HA   PRO  14           HA       PRO  14  -1.067   1.224   1.657
  141   1HB   PRO  14          1HB       PRO  14   0.062   3.569   0.680
  142   2HB   PRO  14          2HB       PRO  14  -0.753   3.420   2.242
  143   1HG   PRO  14          1HG       PRO  14   2.268   3.301   1.710
  144   2HG   PRO  14          2HG       PRO  14   1.418   4.281   2.925
  145   1HD   PRO  14          1HD       PRO  14   2.582   1.850   3.586
  146   2HD   PRO  14          2HD       PRO  14   1.054   2.359   4.361
  Start of MODEL   14
    1   1H    ARG   1          H         ARG   1   1.744   0.449   1.088
    2    HA   ARG   1           HA       ARG   1   1.079   0.163  -1.618
    3   1HB   ARG   1          1HB       ARG   1   2.765   1.755  -2.561
    4   2HB   ARG   1          2HB       ARG   1   1.495   2.596  -1.696
    5   1HG   ARG   1          1HG       ARG   1   2.954   3.434  -0.161
    6   2HG   ARG   1          2HG       ARG   1   3.688   1.866   0.113
    7   1HD   ARG   1          1HD       ARG   1   4.959   2.181  -2.097
    8   2HD   ARG   1          2HD       ARG   1   4.353   3.826  -2.134
    9    HE   ARG   1           HE       ARG   1   6.445   2.778  -0.380
   10   1HH1  ARG   1          2HH2      ARG   1   4.002   5.286  -0.740
   11   2HH1  ARG   1          1HH2      ARG   1   4.797   6.393   0.329
   12   1HH2  ARG   1          2HH1      ARG   1   7.494   4.239   1.030
   13   2HH2  ARG   1          1HH1      ARG   1   6.797   5.793   1.343
   14    H    VAL   2           H        VAL   2   3.224  -0.497  -2.902
   15    HA   VAL   2           HA       VAL   2   4.754  -2.167  -1.055
   16    HB   VAL   2           HB       VAL   2   4.944  -2.434  -4.012
   17   1HG1  VAL   2          1HG1      VAL   2   6.042  -4.235  -3.258
   18   2HG1  VAL   2          2HG1      VAL   2   5.393  -4.040  -1.612
   19   3HG1  VAL   2          3HG1      VAL   2   4.446  -4.907  -2.844
   20   1HG2  VAL   2          1HG2      VAL   2   2.651  -2.243  -4.106
   21   2HG2  VAL   2          2HG2      VAL   2   2.814  -3.976  -3.735
   22   3HG2  VAL   2          3HG2      VAL   2   2.421  -2.820  -2.438
   23    H    ARG   3           H        ARG   3   6.844  -2.461  -3.256
   24    HA   ARG   3           HA       ARG   3   7.959  -0.055  -3.866
   25   1HB   ARG   3          1HB       ARG   3   8.108  -0.231  -1.153
   26   2HB   ARG   3          2HB       ARG   3   9.571  -1.110  -1.550
   27   1HG   ARG   3          1HG       ARG   3  10.667   0.784  -2.201
   28   2HG   ARG   3          2HG       ARG   3   9.309   1.347  -3.156
   29   1HD   ARG   3          1HD       ARG   3   8.701   2.813  -1.530
   30   2HD   ARG   3          2HD       ARG   3   8.606   1.527  -0.342
   31    HE   ARG   3           HE       ARG   3  10.890   3.327  -0.802
   32   1HH1  ARG   3          2HH2      ARG   3   9.798   0.313   0.649
   33   2HH1  ARG   3          1HH2      ARG   3  11.107   0.235   1.781
   34   1HH2  ARG   3          2HH1      ARG   3  12.617   3.225   0.691
   35   2HH2  ARG   3          1HH1      ARG   3  12.720   1.903   1.806
   36    H    THR   4           H        THR   4  10.531  -0.386  -4.237
   37    HA   THR   4           HA       THR   4  11.295  -3.151  -4.529
   38    HB   THR   4           HB       THR   4  11.129  -1.442  -7.048
   39    HG1  THR   4           1HG      THR   4   9.020  -2.318  -7.272
   40   1HG2  THR   4          1HG2      THR   4  10.935  -3.750  -8.081
   41   2HG2  THR   4          2HG2      THR   4  12.486  -3.494  -7.246
   42   3HG2  THR   4          3HG2      THR   4  11.203  -4.449  -6.466
   43    H    ARG   5           H        ARG   5  13.524  -3.439  -4.764
   44    HA   ARG   5           HA       ARG   5  15.201  -1.306  -5.382
   45   1HB   ARG   5          1HB       ARG   5  14.611  -0.452  -3.151
   46   2HB   ARG   5          2HB       ARG   5  14.932  -2.011  -2.418
   47   1HG   ARG   5          1HG       ARG   5  17.304  -1.833  -2.821
   48   2HG   ARG   5          2HG       ARG   5  17.093  -0.498  -3.938
   49   1HD   ARG   5          1HD       ARG   5  16.747   1.068  -2.231
   50   2HD   ARG   5          2HD       ARG   5  16.066  -0.115  -1.131
   51    HE   ARG   5           HE       ARG   5  18.816   0.653  -1.252
   52   1HH1  ARG   5          2HH2      ARG   5  16.854  -2.253  -0.957
   53   2HH1  ARG   5          1HH2      ARG   5  18.063  -3.135  -0.085
   54   1HH2  ARG   5          2HH1      ARG   5  20.411  -0.509  -0.102
   55   2HH2  ARG   5          1HH1      ARG   5  20.099  -2.136   0.406
   56    H    LYS   6           H        LYS   6  17.525  -1.990  -5.289
   57    HA   LYS   6           HA       LYS   6  19.019  -3.544  -5.849
   58   1HB   LYS   6          1HB       LYS   6  18.086  -4.194  -3.089
   59   2HB   LYS   6          2HB       LYS   6  19.145  -5.349  -3.871
   60   1HG   LYS   6          1HG       LYS   6  20.377  -2.925  -4.483
   61   2HG   LYS   6          2HG       LYS   6  19.740  -2.617  -2.880
   62   1HD   LYS   6          1HD       LYS   6  21.193  -4.081  -1.875
   63   2HD   LYS   6          2HD       LYS   6  21.022  -5.281  -3.141
   64   1HE   LYS   6          1HE       LYS   6  22.692  -2.729  -3.364
   65   2HE   LYS   6          2HE       LYS   6  23.337  -4.327  -3.042
   66   1HZ   LYS   6          1HZ       LYS   6  21.728  -4.528  -5.274
   67   2HZ   LYS   6          2HZ       LYS   6  22.662  -3.207  -5.497
   68   3HZ   LYS   6          3HZ       LYS   6  23.354  -4.657  -5.202
   69    H    GLY   7           H        GLY   7  16.652  -3.909  -7.292
   70   1HA   GLY   7          1HA       GLY   7  15.502  -5.428  -8.488
   71   2HA   GLY   7          2HA       GLY   7  16.935  -6.428  -8.350
   72    H    ARG   8           H        ARG   8  14.928  -5.332  -5.575
   73    HA   ARG   8           HA       ARG   8  14.005  -8.079  -5.336
   74   1HB   ARG   8          1HB       ARG   8  14.985  -6.272  -3.069
   75   2HB   ARG   8          2HB       ARG   8  14.275  -7.857  -2.839
   76   1HG   ARG   8          1HG       ARG   8  16.407  -8.045  -4.809
   77   2HG   ARG   8          2HG       ARG   8  17.014  -7.228  -3.383
   78   1HD   ARG   8          1HD       ARG   8  16.134  -9.099  -1.951
   79   2HD   ARG   8          2HD       ARG   8  15.562  -9.920  -3.389
   80    HE   ARG   8           HE       ARG   8  18.299  -9.832  -2.435
   81   1HH1  ARG   8          2HH2      ARG   8  16.363  -9.995  -5.369
   82   2HH1  ARG   8          1HH2      ARG   8  17.602 -10.775  -6.296
   83   1HH2  ARG   8          2HH1      ARG   8  19.933 -10.860  -3.657
   84   2HH2  ARG   8          1HH1      ARG   8  19.646 -11.270  -5.314
   85    H    ARG   9           H        ARG   9  11.984  -8.267  -3.934
   86    HA   ARG   9           HA       ARG   9  10.372  -5.910  -4.396
   87   1HB   ARG   9          1HB       ARG   9   9.402  -7.911  -5.343
   88   2HB   ARG   9          2HB       ARG   9   9.714  -8.844  -3.893
   89   1HG   ARG   9          1HG       ARG   9   7.321  -8.233  -4.035
   90   2HG   ARG   9          2HG       ARG   9   8.062  -7.495  -2.629
   91   1HD   ARG   9          1HD       ARG   9   7.663  -5.383  -3.401
   92   2HD   ARG   9          2HD       ARG   9   8.306  -5.757  -4.989
   93    HE   ARG   9           HE       ARG   9   5.489  -5.896  -4.160
   94   1HH1  ARG   9          2HH2      ARG   9   7.872  -6.921  -6.538
   95   2HH1  ARG   9          1HH2      ARG   9   6.695  -7.238  -7.769
   96   1HH2  ARG   9          2HH1      ARG   9   3.936  -6.314  -5.784
   97   2HH2  ARG   9          1HH1      ARG   9   4.442  -6.890  -7.337
   98    H    ILE  10           H        ILE  10   9.446  -4.739  -2.690
   99    HA   ILE  10           HA       ILE  10   9.588  -5.925  -0.027
  100    HB   ILE  10           HB       ILE  10  10.420  -3.080  -0.357
  101   1HG1  ILE  10          2HG1      ILE  10  11.792  -4.351  -1.990
  102   2HG1  ILE  10          3HG1      ILE  10  12.727  -3.640  -0.690
  103   1HG2  ILE  10          1HG2      ILE  10  10.053  -3.758   1.877
  104   2HG2  ILE  10          2HG2      ILE  10  10.932  -5.288   1.641
  105   3HG2  ILE  10          3HG2      ILE  10  11.819  -3.745   1.650
  106   1HD1  ILE  10          1HD1      ILE  10  11.832  -6.302   0.089
  107   2HD1  ILE  10          2HD1      ILE  10  12.684  -6.365  -1.473
  108   3HD1  ILE  10          3HD1      ILE  10  13.491  -5.672  -0.046
  109    H    ARG  11           H        ARG  11   8.163  -4.765   1.542
  110    HA   ARG  11           HA       ARG  11   6.113  -3.254   0.147
  111   1HB   ARG  11          1HB       ARG  11   5.575  -5.793   0.670
  112   2HB   ARG  11          2HB       ARG  11   5.389  -5.248   2.325
  113   1HG   ARG  11          1HG       ARG  11   3.774  -3.447   1.402
  114   2HG   ARG  11          2HG       ARG  11   3.812  -4.324  -0.115
  115   1HD   ARG  11          1HD       ARG  11   2.865  -5.380   2.589
  116   2HD   ARG  11          2HD       ARG  11   1.882  -5.098   1.166
  117    HE   ARG  11           HE       ARG  11   3.956  -6.909   0.432
  118   1HH1  ARG  11          2HH2      ARG  11   1.108  -6.820   2.495
  119   2HH1  ARG  11          1HH2      ARG  11   0.813  -8.523   2.379
  120   1HH2  ARG  11          2HH1      ARG  11   3.568  -9.157   0.278
  121   2HH2  ARG  11          1HH1      ARG  11   2.222  -9.861   1.109
  122    H    ILE  12           H        ILE  12   4.837  -1.817   1.610
  123    HA   ILE  12           HA       ILE  12   5.645  -1.594   4.340
  124    HB   ILE  12           HB       ILE  12   7.508  -0.521   2.959
  125   1HG1  ILE  12          2HG1      ILE  12   7.437   1.553   4.566
  126   2HG1  ILE  12          3HG1      ILE  12   6.042   0.748   5.257
  127   1HG2  ILE  12          1HG2      ILE  12   5.657   0.664   1.512
  128   2HG2  ILE  12          2HG2      ILE  12   5.751   1.895   2.793
  129   3HG2  ILE  12          3HG2      ILE  12   7.206   1.468   1.861
  130   1HD1  ILE  12          1HD1      ILE  12   7.353  -1.276   5.708
  131   2HD1  ILE  12          2HD1      ILE  12   8.762  -0.584   4.869
  132   3HD1  ILE  12          3HD1      ILE  12   8.196   0.133   6.397
  133    HA   PRO  13           HA       PRO  13   1.833   0.286   5.004
  134   1HB   PRO  13          1HB       PRO  13   1.551  -1.588   6.348
  135   2HB   PRO  13          2HB       PRO  13   0.136  -1.830   5.311
  136   1HG   PRO  13          1HG       PRO  13   1.902  -3.867   5.505
  137   2HG   PRO  13          2HG       PRO  13   1.341  -3.408   3.879
  138   1HD   PRO  13          1HD       PRO  13   4.021  -2.768   5.185
  139   2HD   PRO  13          2HD       PRO  13   3.664  -3.156   3.473
  140    HA   PRO  14           HA       PRO  14  -1.409   0.897   2.113
  141   1HB   PRO  14          1HB       PRO  14  -0.866   3.535   1.424
  142   2HB   PRO  14          2HB       PRO  14  -1.463   3.009   3.004
  143   1HG   PRO  14          1HG       PRO  14   1.448   3.592   2.224
  144   2HG   PRO  14          2HG       PRO  14   0.561   4.202   3.639
  145   1HD   PRO  14          1HD       PRO  14   2.238   1.998   3.823
  146   2HD   PRO  14          2HD       PRO  14   0.733   2.070   4.785
  Start of MODEL   15
    1   1H    ARG   1          H         ARG   1   2.299   0.585   1.318
    2    HA   ARG   1           HA       ARG   1   2.332   1.439  -1.460
    3   1HB   ARG   1          1HB       ARG   1   4.146   2.260   0.821
    4   2HB   ARG   1          2HB       ARG   1   4.838   2.136  -0.784
    5   1HG   ARG   1          1HG       ARG   1   2.855   3.616  -1.583
    6   2HG   ARG   1          2HG       ARG   1   2.544   3.926   0.114
    7   1HD   ARG   1          1HD       ARG   1   5.395   4.271  -0.666
    8   2HD   ARG   1          2HD       ARG   1   4.301   5.381  -1.467
    9    HE   ARG   1           HE       ARG   1   3.801   6.395   0.609
   10   1HH1  ARG   1          2HH2      ARG   1   5.707   3.477   1.094
   11   2HH1  ARG   1          1HH2      ARG   1   6.036   3.815   2.761
   12   1HH2  ARG   1          2HH1      ARG   1   4.234   6.841   2.809
   13   2HH2  ARG   1          1HH1      ARG   1   5.191   5.741   3.743
   14    H    VAL   2           H        VAL   2   3.580   0.112  -2.852
   15    HA   VAL   2           HA       VAL   2   5.307  -1.879  -1.635
   16    HB   VAL   2           HB       VAL   2   3.106  -2.695  -3.531
   17   1HG1  VAL   2          1HG1      VAL   2   5.169  -4.165  -1.884
   18   2HG1  VAL   2          2HG1      VAL   2   3.692  -4.968  -2.466
   19   3HG1  VAL   2          3HG1      VAL   2   4.844  -4.273  -3.631
   20   1HG2  VAL   2          1HG2      VAL   2   2.082  -3.766  -1.447
   21   2HG2  VAL   2          2HG2      VAL   2   3.123  -2.672  -0.504
   22   3HG2  VAL   2          3HG2      VAL   2   1.904  -2.002  -1.614
   23    H    ARG   3           H        ARG   3   7.199  -1.590  -2.690
   24    HA   ARG   3           HA       ARG   3   7.019  -1.342  -5.570
   25   1HB   ARG   3          1HB       ARG   3   7.781   0.783  -3.812
   26   2HB   ARG   3          2HB       ARG   3   9.266   0.223  -4.552
   27   1HG   ARG   3          1HG       ARG   3   7.359   0.293  -6.663
   28   2HG   ARG   3          2HG       ARG   3   7.079   1.757  -5.742
   29   1HD   ARG   3          1HD       ARG   3   9.316   2.539  -6.064
   30   2HD   ARG   3          2HD       ARG   3   9.909   0.949  -6.503
   31    HE   ARG   3           HE       ARG   3   8.763   2.880  -8.300
   32   1HH1  ARG   3          2HH2      ARG   3   8.812  -0.585  -7.682
   33   2HH1  ARG   3          1HH2      ARG   3   8.498  -1.013  -9.332
   34   1HH2  ARG   3          2HH1      ARG   3   8.348   2.316 -10.475
   35   2HH2  ARG   3          1HH1      ARG   3   8.232   0.649 -10.931
   36    H    THR   4           H        THR   4   9.847  -1.060  -6.031
   37    HA   THR   4           HA       THR   4  10.902  -3.496  -4.752
   38    HB   THR   4           HB       THR   4  10.116  -3.187  -7.432
   39    HG1  THR   4           1HG      THR   4  12.299  -4.806  -6.335
   40   1HG2  THR   4          1HG2      THR   4  13.161  -3.288  -7.334
   41   2HG2  THR   4          2HG2      THR   4  12.111  -3.140  -8.762
   42   3HG2  THR   4          3HG2      THR   4  12.304  -1.762  -7.653
   43    H    ARG   5           H        ARG   5  13.433  -3.588  -5.331
   44    HA   ARG   5           HA       ARG   5  14.836  -1.296  -5.648
   45   1HB   ARG   5          1HB       ARG   5  13.894  -0.345  -3.624
   46   2HB   ARG   5          2HB       ARG   5  14.131  -1.832  -2.727
   47   1HG   ARG   5          1HG       ARG   5  16.492  -1.532  -2.601
   48   2HG   ARG   5          2HG       ARG   5  16.517  -0.394  -3.932
   49   1HD   ARG   5          1HD       ARG   5  16.189   1.369  -2.531
   50   2HD   ARG   5          2HD       ARG   5  14.780   0.613  -1.813
   51    HE   ARG   5           HE       ARG   5  17.140  -0.693  -0.827
   52   1HH1  ARG   5          2HH2      ARG   5  15.402   2.354  -0.553
   53   2HH1  ARG   5          1HH2      ARG   5  15.982   2.688   1.045
   54   1HH2  ARG   5          2HH1      ARG   5  17.904  -0.254   1.281
   55   2HH2  ARG   5          1HH1      ARG   5  17.415   1.195   2.096
   56    H    LYS   6           H        LYS   6  17.168  -1.674  -5.342
   57    HA   LYS   6           HA       LYS   6  18.920  -3.023  -5.537
   58   1HB   LYS   6          1HB       LYS   6  18.294  -2.794  -2.951
   59   2HB   LYS   6          2HB       LYS   6  18.103  -4.530  -3.088
   60   1HG   LYS   6          1HG       LYS   6  20.356  -4.895  -3.440
   61   2HG   LYS   6          2HG       LYS   6  20.557  -3.436  -4.389
   62   1HD   LYS   6          1HD       LYS   6  21.759  -2.948  -2.412
   63   2HD   LYS   6          2HD       LYS   6  20.225  -2.144  -2.146
   64   1HE   LYS   6          1HE       LYS   6  20.424  -5.005  -1.240
   65   2HE   LYS   6          2HE       LYS   6  21.336  -3.823  -0.322
   66   1HZ   LYS   6          1HZ       LYS   6  19.425  -3.413   0.678
   67   2HZ   LYS   6          2HZ       LYS   6  18.926  -2.658  -0.681
   68   3HZ   LYS   6          3HZ       LYS   6  18.536  -4.223  -0.427
   69    H    GLY   7           H        GLY   7  16.497  -3.852  -6.978
   70   1HA   GLY   7          1HA       GLY   7  15.888  -5.582  -8.283
   71   2HA   GLY   7          2HA       GLY   7  17.348  -6.420  -7.795
   72    H    ARG   8           H        ARG   8  14.929  -5.233  -5.442
   73    HA   ARG   8           HA       ARG   8  13.918  -7.931  -5.196
   74   1HB   ARG   8          1HB       ARG   8  15.150  -6.287  -2.932
   75   2HB   ARG   8          2HB       ARG   8  14.120  -7.672  -2.636
   76   1HG   ARG   8          1HG       ARG   8  15.917  -8.705  -4.484
   77   2HG   ARG   8          2HG       ARG   8  16.930  -7.578  -3.604
   78   1HD   ARG   8          1HD       ARG   8  15.142  -9.597  -2.178
   79   2HD   ARG   8          2HD       ARG   8  16.780  -9.987  -2.665
   80    HE   ARG   8           HE       ARG   8  15.980  -8.154  -0.506
   81   1HH1  ARG   8          2HH2      ARG   8  18.580  -9.188  -2.639
   82   2HH1  ARG   8          1HH2      ARG   8  19.836  -8.577  -1.615
   83   1HH2  ARG   8          2HH1      ARG   8  17.636  -7.347   0.846
   84   2HH2  ARG   8          1HH1      ARG   8  19.296  -7.523   0.380
   85    H    ARG   9           H        ARG   9  11.914  -7.958  -3.683
   86    HA   ARG   9           HA       ARG   9  10.508  -5.456  -4.114
   87   1HB   ARG   9          1HB       ARG   9   9.431  -7.369  -5.187
   88   2HB   ARG   9          2HB       ARG   9   9.526  -8.322  -3.720
   89   1HG   ARG   9          1HG       ARG   9   7.271  -7.549  -3.783
   90   2HG   ARG   9          2HG       ARG   9   8.054  -6.515  -2.604
   91   1HD   ARG   9          1HD       ARG   9   7.188  -4.788  -3.831
   92   2HD   ARG   9          2HD       ARG   9   8.521  -5.092  -4.927
   93    HE   ARG   9           HE       ARG   9   6.964  -5.827  -6.494
   94   1HH1  ARG   9          2HH2      ARG   9   5.608  -6.300  -3.282
   95   2HH1  ARG   9          1HH2      ARG   9   4.090  -6.891  -3.870
   96   1HH2  ARG   9          2HH1      ARG   9   4.961  -6.605  -7.271
   97   2HH2  ARG   9          1HH1      ARG   9   3.719  -7.066  -6.154
   98    H    ILE  10           H        ILE  10   9.522  -4.360  -2.362
   99    HA   ILE  10           HA       ILE  10   9.744  -5.665   0.252
  100    HB   ILE  10           HB       ILE  10  10.170  -2.899   0.611
  101   1HG1  ILE  10          2HG1      ILE  10  12.381  -2.696  -0.616
  102   2HG1  ILE  10          3HG1      ILE  10  11.896  -4.075  -1.581
  103   1HG2  ILE  10          1HG2      ILE  10  10.907  -4.905   1.979
  104   2HG2  ILE  10          2HG2      ILE  10  12.243  -5.089   0.817
  105   3HG2  ILE  10          3HG2      ILE  10  12.100  -3.598   1.779
  106   1HD1  ILE  10          1HD1      ILE  10  10.990  -1.281  -1.733
  107   2HD1  ILE  10          2HD1      ILE  10  10.860  -2.580  -2.943
  108   3HD1  ILE  10          3HD1      ILE  10   9.632  -2.430  -1.662
  109    H    ARG  11           H        ARG  11   8.027  -5.271   1.664
  110    HA   ARG  11           HA       ARG  11   5.952  -3.571   0.533
  111   1HB   ARG  11          1HB       ARG  11   5.664  -6.231   0.577
  112   2HB   ARG  11          2HB       ARG  11   5.269  -5.965   2.263
  113   1HG   ARG  11          1HG       ARG  11   3.424  -4.480   1.683
  114   2HG   ARG  11          2HG       ARG  11   3.910  -4.437  -0.001
  115   1HD   ARG  11          1HD       ARG  11   2.004  -5.979   0.285
  116   2HD   ARG  11          2HD       ARG  11   3.423  -6.876  -0.218
  117    HE   ARG  11           HE       ARG  11   3.485  -6.912   2.591
  118   1HH1  ARG  11          2HH2      ARG  11   1.274  -7.990   0.075
  119   2HH1  ARG  11          1HH2      ARG  11   0.634  -9.295   1.017
  120   1HH2  ARG  11          2HH1      ARG  11   2.642  -8.634   3.835
  121   2HH2  ARG  11          1HH1      ARG  11   1.418  -9.664   3.171
  122    H    ILE  12           H        ILE  12   4.850  -2.206   2.023
  123    HA   ILE  12           HA       ILE  12   5.077  -2.601   4.825
  124    HB   ILE  12           HB       ILE  12   7.364  -1.715   4.081
  125   1HG1  ILE  12          2HG1      ILE  12   6.271   0.119   6.144
  126   2HG1  ILE  12          3HG1      ILE  12   6.002  -1.590   6.421
  127   1HG2  ILE  12          1HG2      ILE  12   6.092   0.998   4.151
  128   2HG2  ILE  12          2HG2      ILE  12   7.651   0.482   3.465
  129   3HG2  ILE  12          3HG2      ILE  12   6.133   0.082   2.625
  130   1HD1  ILE  12          1HD1      ILE  12   8.602  -1.737   5.707
  131   2HD1  ILE  12          2HD1      ILE  12   8.585  -0.063   6.312
  132   3HD1  ILE  12          3HD1      ILE  12   8.100  -1.401   7.381
  133    HA   PRO  13           HA       PRO  13   1.654   0.003   5.149
  134   1HB   PRO  13          1HB       PRO  13   0.806  -1.892   6.194
  135   2HB   PRO  13          2HB       PRO  13  -0.424  -1.754   4.926
  136   1HG   PRO  13          1HG       PRO  13   0.884  -4.110   5.146
  137   2HG   PRO  13          2HG       PRO  13   0.711  -3.405   3.519
  138   1HD   PRO  13          1HD       PRO  13   3.188  -3.428   5.297
  139   2HD   PRO  13          2HD       PRO  13   3.076  -3.584   3.516
  140    HA   PRO  14           HA       PRO  14  -0.878   1.494   1.890
  141   1HB   PRO  14          1HB       PRO  14   0.238   4.026   1.619
  142   2HB   PRO  14          2HB       PRO  14  -0.712   3.489   3.011
  143   1HG   PRO  14          1HG       PRO  14   2.347   3.558   2.772
  144   2HG   PRO  14          2HG       PRO  14   1.347   4.200   4.094
  145   1HD   PRO  14          1HD       PRO  14   2.547   1.704   4.270
  146   2HD   PRO  14          2HD       PRO  14   0.933   1.982   4.986
  Start of MODEL   16
    1   1H    ARG   1          H         ARG   1   3.112   0.658   0.372
    2    HA   ARG   1           HA       ARG   1   2.103  -1.279   0.111
    3   1HB   ARG   1          1HB       ARG   1   0.088   0.015  -0.876
    4   2HB   ARG   1          2HB       ARG   1   0.765  -0.310  -2.459
    5   1HG   ARG   1          1HG       ARG   1  -0.325  -2.301  -2.416
    6   2HG   ARG   1          2HG       ARG   1   0.824  -2.823  -1.201
    7   1HD   ARG   1          1HD       ARG   1  -0.707  -2.659   0.502
    8   2HD   ARG   1          2HD       ARG   1  -1.353  -1.142  -0.091
    9    HE   ARG   1           HE       ARG   1  -2.999  -2.319  -1.277
   10   1HH1  ARG   1          2HH2      ARG   1  -0.458  -4.544  -0.286
   11   2HH1  ARG   1          1HH2      ARG   1  -1.330  -5.958  -0.774
   12   1HH2  ARG   1          2HH1      ARG   1  -4.150  -4.186  -1.920
   13   2HH2  ARG   1          1HH1      ARG   1  -3.444  -5.754  -1.710
   14    H    VAL   2           H        VAL   2   3.375  -2.975  -0.593
   15    HA   VAL   2           HA       VAL   2   5.088  -3.922  -1.681
   16    HB   VAL   2           HB       VAL   2   2.807  -3.567  -3.540
   17   1HG1  VAL   2          1HG1      VAL   2   4.251  -5.074  -5.183
   18   2HG1  VAL   2          2HG1      VAL   2   4.277  -3.297  -5.284
   19   3HG1  VAL   2          3HG1      VAL   2   5.595  -4.160  -4.457
   20   1HG2  VAL   2          1HG2      VAL   2   2.404  -5.501  -2.465
   21   2HG2  VAL   2          2HG2      VAL   2   3.597  -6.205  -3.582
   22   3HG2  VAL   2          3HG2      VAL   2   4.100  -5.683  -1.956
   23    H    ARG   3           H        ARG   3   6.792  -2.421  -1.367
   24    HA   ARG   3           HA       ARG   3   7.039  -0.321  -3.296
   25   1HB   ARG   3          1HB       ARG   3   7.786  -0.557  -0.649
   26   2HB   ARG   3          2HB       ARG   3   9.311  -0.902  -1.439
   27   1HG   ARG   3          1HG       ARG   3   8.350   1.304  -2.875
   28   2HG   ARG   3          2HG       ARG   3   7.842   1.654  -1.235
   29   1HD   ARG   3          1HD       ARG   3  10.252   1.115  -0.496
   30   2HD   ARG   3          2HD       ARG   3  10.682   1.076  -2.194
   31    HE   ARG   3           HE       ARG   3   9.239   3.509  -1.533
   32   1HH1  ARG   3          2HH2      ARG   3  12.403   1.980  -1.353
   33   2HH1  ARG   3          1HH2      ARG   3  13.268   3.480  -1.319
   34   1HH2  ARG   3          2HH1      ARG   3  10.380   5.489  -1.490
   35   2HH2  ARG   3          1HH1      ARG   3  12.109   5.490  -1.398
   36    H    THR   4           H        THR   4   9.901  -0.209  -3.546
   37    HA   THR   4           HA       THR   4  10.780  -2.771  -4.561
   38    HB   THR   4           HB       THR   4  10.689  -0.424  -6.496
   39    HG1  THR   4           1HG      THR   4   8.505  -0.774  -6.464
   40   1HG2  THR   4          1HG2      THR   4  11.939  -2.772  -6.819
   41   2HG2  THR   4          2HG2      THR   4  10.289  -3.356  -7.146
   42   3HG2  THR   4          3HG2      THR   4  10.995  -2.071  -8.156
   43    H    ARG   5           H        ARG   5  13.016  -2.949  -4.723
   44    HA   ARG   5           HA       ARG   5  14.713  -0.796  -4.771
   45   1HB   ARG   5          1HB       ARG   5  13.783  -0.371  -2.456
   46   2HB   ARG   5          2HB       ARG   5  14.365  -1.945  -1.955
   47   1HG   ARG   5          1HG       ARG   5  16.691  -1.294  -2.376
   48   2HG   ARG   5          2HG       ARG   5  16.186   0.217  -3.106
   49   1HD   ARG   5          1HD       ARG   5  15.463   1.132  -1.018
   50   2HD   ARG   5          2HD       ARG   5  15.384  -0.441  -0.250
   51    HE   ARG   5           HE       ARG   5  18.075   0.275  -1.178
   52   1HH1  ARG   5          2HH2      ARG   5  15.781   0.478   1.483
   53   2HH1  ARG   5          1HH2      ARG   5  17.004   0.724   2.686
   54   1HH2  ARG   5          2HH1      ARG   5  19.688   0.600   0.408
   55   2HH2  ARG   5          1HH1      ARG   5  19.240   0.794   2.070
   56    H    LYS   6           H        LYS   6  17.055  -1.521  -4.313
   57    HA   LYS   6           HA       LYS   6  18.618  -2.985  -4.944
   58   1HB   LYS   6          1HB       LYS   6  19.192  -4.330  -3.197
   59   2HB   LYS   6          2HB       LYS   6  17.984  -3.342  -2.400
   60   1HG   LYS   6          1HG       LYS   6  16.411  -5.341  -3.501
   61   2HG   LYS   6          2HG       LYS   6  17.883  -6.222  -3.146
   62   1HD   LYS   6          1HD       LYS   6  16.727  -4.378  -1.039
   63   2HD   LYS   6          2HD       LYS   6  15.992  -5.949  -1.291
   64   1HE   LYS   6          1HE       LYS   6  19.000  -5.713  -0.932
   65   2HE   LYS   6          2HE       LYS   6  17.943  -5.713   0.466
   66   1HZ   LYS   6          1HZ       LYS   6  17.011  -7.801  -0.368
   67   2HZ   LYS   6          2HZ       LYS   6  18.103  -7.812  -1.583
   68   3HZ   LYS   6          3HZ       LYS   6  18.605  -7.921  -0.032
   69    H    GLY   7           H        GLY   7  16.299  -3.051  -6.653
   70   1HA   GLY   7          1HA       GLY   7  15.325  -4.318  -8.236
   71   2HA   GLY   7          2HA       GLY   7  16.807  -5.254  -8.211
   72    H    ARG   8           H        ARG   8  14.529  -4.890  -5.449
   73    HA   ARG   8           HA       ARG   8  13.702  -7.631  -5.914
   74   1HB   ARG   8          1HB       ARG   8  14.770  -6.462  -3.300
   75   2HB   ARG   8          2HB       ARG   8  13.872  -7.966  -3.362
   76   1HG   ARG   8          1HG       ARG   8  16.337  -7.519  -5.091
   77   2HG   ARG   8          2HG       ARG   8  16.469  -8.108  -3.447
   78   1HD   ARG   8          1HD       ARG   8  14.572  -9.476  -5.380
   79   2HD   ARG   8          2HD       ARG   8  16.285  -9.836  -5.448
   80    HE   ARG   8           HE       ARG   8  16.171 -10.825  -3.275
   81   1HH1  ARG   8          2HH2      ARG   8  13.074  -9.478  -4.265
   82   2HH1  ARG   8          1HH2      ARG   8  12.177 -10.308  -3.038
   83   1HH2  ARG   8          2HH1      ARG   8  14.986 -11.920  -1.657
   84   2HH2  ARG   8          1HH1      ARG   8  13.272 -11.707  -1.544
   85    H    ARG   9           H        ARG   9  11.702  -8.191  -4.506
   86    HA   ARG   9           HA       ARG   9  10.044  -5.820  -4.449
   87   1HB   ARG   9          1HB       ARG   9   9.100  -7.586  -5.803
   88   2HB   ARG   9          2HB       ARG   9   9.437  -8.805  -4.589
   89   1HG   ARG   9          1HG       ARG   9   7.674  -6.523  -3.746
   90   2HG   ARG   9          2HG       ARG   9   6.990  -7.659  -4.890
   91   1HD   ARG   9          1HD       ARG   9   8.374  -8.619  -2.353
   92   2HD   ARG   9          2HD       ARG   9   6.682  -8.161  -2.348
   93    HE   ARG   9           HE       ARG   9   6.177 -10.007  -3.808
   94   1HH1  ARG   9          2HH2      ARG   9   9.587  -9.837  -2.958
   95   2HH1  ARG   9          1HH2      ARG   9   9.923 -11.461  -3.456
   96   1HH2  ARG   9          2HH1      ARG   9   6.620 -12.151  -4.464
   97   2HH2  ARG   9          1HH1      ARG   9   8.224 -12.786  -4.318
   98    H    ILE  10           H        ILE  10   9.098  -5.072  -2.527
   99    HA   ILE  10           HA       ILE  10   9.211  -6.808  -0.196
  100    HB   ILE  10           HB       ILE  10  10.306  -4.010  -0.048
  101   1HG1  ILE  10          2HG1      ILE  10  11.658  -5.409  -1.638
  102   2HG1  ILE  10          3HG1      ILE  10  12.531  -4.809  -0.242
  103   1HG2  ILE  10          1HG2      ILE  10  11.416  -5.141   2.006
  104   2HG2  ILE  10          2HG2      ILE  10   9.700  -4.678   2.087
  105   3HG2  ILE  10          3HG2      ILE  10  10.150  -6.376   1.801
  106   1HD1  ILE  10          1HD1      ILE  10  11.227  -7.467   0.135
  107   2HD1  ILE  10          2HD1      ILE  10  12.565  -7.423  -1.038
  108   3HD1  ILE  10          3HD1      ILE  10  12.839  -6.907   0.644
  109    H    ARG  11           H        ARG  11   7.972  -5.711   1.686
  110    HA   ARG  11           HA       ARG  11   5.823  -4.144   0.499
  111   1HB   ARG  11          1HB       ARG  11   5.433  -6.674   1.290
  112   2HB   ARG  11          2HB       ARG  11   5.342  -5.951   2.883
  113   1HG   ARG  11          1HG       ARG  11   3.564  -4.378   2.048
  114   2HG   ARG  11          2HG       ARG  11   3.636  -5.151   0.477
  115   1HD   ARG  11          1HD       ARG  11   3.125  -6.815   2.968
  116   2HD   ARG  11          2HD       ARG  11   1.810  -5.940   2.209
  117    HE   ARG  11           HE       ARG  11   3.200  -8.291   1.134
  118   1HH1  ARG  11          2HH2      ARG  11   1.173  -5.521   0.361
  119   2HH1  ARG  11          1HH2      ARG  11   0.550  -6.221  -1.095
  120   1HH2  ARG  11          2HH1      ARG  11   2.378  -9.215  -0.788
  121   2HH2  ARG  11          1HH1      ARG  11   1.240  -8.337  -1.754
  122    H    ILE  12           H        ILE  12   5.088  -2.343   1.718
  123    HA   ILE  12           HA       ILE  12   5.528  -1.997   4.438
  124    HB   ILE  12           HB       ILE  12   7.927  -1.899   3.321
  125   1HG1  ILE  12          2HG1      ILE  12   7.909   0.237   5.230
  126   2HG1  ILE  12          3HG1      ILE  12   6.722  -0.952   5.729
  127   1HG2  ILE  12          1HG2      ILE  12   7.141  -0.048   1.766
  128   2HG2  ILE  12          2HG2      ILE  12   7.140   1.015   3.194
  129   3HG2  ILE  12          3HG2      ILE  12   8.653   0.244   2.658
  130   1HD1  ILE  12          1HD1      ILE  12   9.694  -1.220   5.478
  131   2HD1  ILE  12          2HD1      ILE  12   8.582  -1.946   6.663
  132   3HD1  ILE  12          3HD1      ILE  12   8.727  -2.646   5.033
  133    HA   PRO  13           HA       PRO  13   3.194   1.660   4.182
  134   1HB   PRO  13          1HB       PRO  13   2.102   0.620   5.951
  135   2HB   PRO  13          2HB       PRO  13   0.725   0.695   4.838
  136   1HG   PRO  13          1HG       PRO  13   1.383  -1.725   5.847
  137   2HG   PRO  13          2HG       PRO  13   1.081  -1.609   4.096
  138   1HD   PRO  13          1HD       PRO  13   3.768  -1.806   5.524
  139   2HD   PRO  13          2HD       PRO  13   3.266  -2.523   3.962
  140    HA   PRO  14           HA       PRO  14   0.594   2.663   0.801
  141   1HB   PRO  14          1HB       PRO  14   2.292   4.407  -0.541
  142   2HB   PRO  14          2HB       PRO  14   1.538   4.742   1.023
  143   1HG   PRO  14          1HG       PRO  14   4.377   3.688   0.524
  144   2HG   PRO  14          2HG       PRO  14   3.891   5.047   1.562
  145   1HD   PRO  14          1HD       PRO  14   4.354   2.520   2.612
  146   2HD   PRO  14          2HD       PRO  14   3.066   3.557   3.290
  Start of MODEL   17
    1   1H    ARG   1          H         ARG   1   2.697   0.725   1.307
    2    HA   ARG   1           HA       ARG   1   3.413   1.744  -1.325
    3   1HB   ARG   1          1HB       ARG   1   4.561   2.198   1.341
    4   2HB   ARG   1          2HB       ARG   1   5.774   1.568   0.246
    5   1HG   ARG   1          1HG       ARG   1   3.959   3.912  -0.473
    6   2HG   ARG   1          2HG       ARG   1   5.524   4.122   0.286
    7   1HD   ARG   1          1HD       ARG   1   6.704   3.299  -1.606
    8   2HD   ARG   1          2HD       ARG   1   5.306   2.453  -2.236
    9    HE   ARG   1           HE       ARG   1   4.688   5.242  -2.147
   10   1HH1  ARG   1          2HH2      ARG   1   6.776   3.008  -3.888
   11   2HH1  ARG   1          1HH2      ARG   1   6.828   3.976  -5.325
   12   1HH2  ARG   1          2HH1      ARG   1   4.754   6.518  -4.042
   13   2HH2  ARG   1          1HH1      ARG   1   5.670   5.985  -5.413
   14    H    VAL   2           H        VAL   2   3.642  -0.033  -2.666
   15    HA   VAL   2           HA       VAL   2   5.340  -2.199  -1.664
   16    HB   VAL   2           HB       VAL   2   2.862  -2.675  -3.315
   17   1HG1  VAL   2          1HG1      VAL   2   3.174  -5.002  -2.329
   18   2HG1  VAL   2          2HG1      VAL   2   4.399  -4.475  -3.508
   19   3HG1  VAL   2          3HG1      VAL   2   4.770  -4.448  -1.768
   20   1HG2  VAL   2          1HG2      VAL   2   2.177  -3.669  -0.888
   21   2HG2  VAL   2          2HG2      VAL   2   3.120  -2.244  -0.390
   22   3HG2  VAL   2          3HG2      VAL   2   1.713  -2.050  -1.463
   23    H    ARG   3           H        ARG   3   7.152  -1.974  -2.887
   24    HA   ARG   3           HA       ARG   3   6.749  -2.019  -5.734
   25   1HB   ARG   3          1HB       ARG   3   7.202   0.428  -4.608
   26   2HB   ARG   3          2HB       ARG   3   8.862  -0.103  -4.781
   27   1HG   ARG   3          1HG       ARG   3   8.827   0.218  -7.033
   28   2HG   ARG   3          2HG       ARG   3   7.347  -0.704  -7.211
   29   1HD   ARG   3          1HD       ARG   3   7.027   2.005  -5.976
   30   2HD   ARG   3          2HD       ARG   3   7.520   1.999  -7.658
   31    HE   ARG   3           HE       ARG   3   5.411   0.139  -7.477
   32   1HH1  ARG   3          2HH2      ARG   3   5.860   3.583  -6.908
   33   2HH1  ARG   3          1HH2      ARG   3   4.219   3.989  -7.286
   34   1HH2  ARG   3          2HH1      ARG   3   3.246   0.674  -7.976
   35   2HH2  ARG   3          1HH1      ARG   3   2.723   2.323  -7.897
   36    H    THR   4           H        THR   4   9.535  -1.588  -6.420
   37    HA   THR   4           HA       THR   4  10.885  -3.696  -4.873
   38    HB   THR   4           HB       THR   4  11.200  -3.487  -7.877
   39    HG1  THR   4           1HG      THR   4   9.242  -4.749  -8.026
   40   1HG2  THR   4          1HG2      THR   4  11.407  -5.946  -7.667
   41   2HG2  THR   4          2HG2      THR   4  12.536  -5.160  -6.538
   42   3HG2  THR   4          3HG2      THR   4  11.011  -5.848  -5.934
   43    H    ARG   5           H        ARG   5  13.006  -3.355  -4.388
   44    HA   ARG   5           HA       ARG   5  14.300  -1.173  -5.759
   45   1HB   ARG   5          1HB       ARG   5  13.668  -1.278  -2.799
   46   2HB   ARG   5          2HB       ARG   5  15.163  -0.519  -3.305
   47   1HG   ARG   5          1HG       ARG   5  13.536   0.716  -5.060
   48   2HG   ARG   5          2HG       ARG   5  12.321   0.328  -3.857
   49   1HD   ARG   5          1HD       ARG   5  13.029   2.380  -3.019
   50   2HD   ARG   5          2HD       ARG   5  14.141   1.332  -2.161
   51    HE   ARG   5           HE       ARG   5  15.389   1.924  -4.619
   52   1HH1  ARG   5          2HH2      ARG   5  14.260   3.707  -1.804
   53   2HH1  ARG   5          1HH2      ARG   5  15.434   4.969  -1.974
   54   1HH2  ARG   5          2HH1      ARG   5  16.939   3.588  -4.843
   55   2HH2  ARG   5          1HH1      ARG   5  16.968   4.901  -3.714
   56    H    LYS   6           H        LYS   6  16.709  -1.198  -5.409
   57    HA   LYS   6           HA       LYS   6  18.614  -2.324  -5.477
   58   1HB   LYS   6          1HB       LYS   6  17.498  -3.363  -2.860
   59   2HB   LYS   6          2HB       LYS   6  19.145  -3.646  -3.390
   60   1HG   LYS   6          1HG       LYS   6  19.639  -1.266  -3.418
   61   2HG   LYS   6          2HG       LYS   6  17.951  -0.846  -3.216
   62   1HD   LYS   6          1HD       LYS   6  18.631  -0.630  -1.012
   63   2HD   LYS   6          2HD       LYS   6  18.196  -2.327  -0.988
   64   1HE   LYS   6          1HE       LYS   6  20.365  -3.006  -0.716
   65   2HE   LYS   6          2HE       LYS   6  20.968  -1.885  -1.920
   66   1HZ   LYS   6          1HZ       LYS   6  21.812  -1.026  -0.014
   67   2HZ   LYS   6          2HZ       LYS   6  20.428  -0.164  -0.092
   68   3HZ   LYS   6          3HZ       LYS   6  20.537  -1.443   0.917
   69    H    GLY   7           H        GLY   7  16.209  -3.490  -6.842
   70   1HA   GLY   7          1HA       GLY   7  15.890  -5.288  -8.169
   71   2HA   GLY   7          2HA       GLY   7  17.409  -5.959  -7.610
   72    H    ARG   8           H        ARG   8  15.039  -4.976  -5.185
   73    HA   ARG   8           HA       ARG   8  14.196  -7.743  -4.956
   74   1HB   ARG   8          1HB       ARG   8  15.033  -5.979  -2.600
   75   2HB   ARG   8          2HB       ARG   8  14.472  -7.635  -2.489
   76   1HG   ARG   8          1HG       ARG   8  16.803  -7.118  -4.315
   77   2HG   ARG   8          2HG       ARG   8  17.105  -6.982  -2.594
   78   1HD   ARG   8          1HD       ARG   8  15.535  -9.358  -2.969
   79   2HD   ARG   8          2HD       ARG   8  16.793  -9.387  -4.188
   80    HE   ARG   8           HE       ARG   8  18.423  -9.603  -2.500
   81   1HH1  ARG   8          2HH2      ARG   8  15.318  -8.768  -1.071
   82   2HH1  ARG   8          1HH2      ARG   8  15.843  -9.062   0.554
   83   1HH2  ARG   8          2HH1      ARG   8  19.116  -9.991  -0.357
   84   2HH2  ARG   8          1HH1      ARG   8  18.017  -9.763   0.962
   85    H    ARG   9           H        ARG   9  12.115  -7.990  -3.730
   86    HA   ARG   9           HA       ARG   9  10.559  -5.559  -4.015
   87   1HB   ARG   9          1HB       ARG   9   9.674  -7.418  -5.318
   88   2HB   ARG   9          2HB       ARG   9   9.787  -8.512  -3.953
   89   1HG   ARG   9          1HG       ARG   9   8.111  -6.032  -3.607
   90   2HG   ARG   9          2HG       ARG   9   7.471  -7.299  -4.633
   91   1HD   ARG   9          1HD       ARG   9   8.518  -8.576  -2.277
   92   2HD   ARG   9          2HD       ARG   9   7.570  -7.204  -1.738
   93    HE   ARG   9           HE       ARG   9   6.195  -8.718  -3.811
   94   1HH1  ARG   9          2HH2      ARG   9   6.900  -8.627  -0.365
   95   2HH1  ARG   9          1HH2      ARG   9   5.499  -9.546   0.076
   96   1HH2  ARG   9          2HH1      ARG   9   4.347  -9.930  -3.231
   97   2HH2  ARG   9          1HH1      ARG   9   4.036 -10.292  -1.565
   98    H    ILE  10           H        ILE  10   9.311  -4.745  -2.255
   99    HA   ILE  10           HA       ILE  10   9.387  -6.271   0.225
  100    HB   ILE  10           HB       ILE  10  10.002  -3.395   0.497
  101   1HG1  ILE  10          2HG1      ILE  10  12.489  -3.957   0.221
  102   2HG1  ILE  10          3HG1      ILE  10  11.969  -5.363  -0.686
  103   1HG2  ILE  10          1HG2      ILE  10  10.645  -4.020   2.541
  104   2HG2  ILE  10          2HG2      ILE  10   9.871  -5.580   2.171
  105   3HG2  ILE  10          3HG2      ILE  10  11.621  -5.374   1.922
  106   1HD1  ILE  10          1HD1      ILE  10  12.173  -2.634  -1.586
  107   2HD1  ILE  10          2HD1      ILE  10  11.708  -4.074  -2.524
  108   3HD1  ILE  10          3HD1      ILE  10  10.464  -3.124  -1.675
  109    H    ARG  11           H        ARG  11   7.731  -5.584   1.765
  110    HA   ARG  11           HA       ARG  11   5.749  -3.857   0.534
  111   1HB   ARG  11          1HB       ARG  11   5.310  -6.472   0.413
  112   2HB   ARG  11          2HB       ARG  11   4.908  -6.313   2.112
  113   1HG   ARG  11          1HG       ARG  11   3.343  -4.351   1.349
  114   2HG   ARG  11          2HG       ARG  11   3.544  -5.000  -0.266
  115   1HD   ARG  11          1HD       ARG  11   2.970  -7.289   1.239
  116   2HD   ARG  11          2HD       ARG  11   1.972  -6.069   2.004
  117    HE   ARG  11           HE       ARG  11   1.671  -5.770  -0.812
  118   1HH1  ARG  11          2HH2      ARG  11   0.909  -8.107   1.705
  119   2HH1  ARG  11          1HH2      ARG  11  -0.470  -8.745   0.874
  120   1HH2  ARG  11          2HH1      ARG  11  -0.148  -6.611  -1.910
  121   2HH2  ARG  11          1HH1      ARG  11  -1.075  -7.887  -1.196
  122    H    ILE  12           H        ILE  12   4.651  -2.486   2.016
  123    HA   ILE  12           HA       ILE  12   4.545  -2.973   4.771
  124    HB   ILE  12           HB       ILE  12   7.053  -2.434   4.263
  125   1HG1  ILE  12          2HG1      ILE  12   6.018  -2.786   6.486
  126   2HG1  ILE  12          3HG1      ILE  12   7.304  -1.595   6.501
  127   1HG2  ILE  12          1HG2      ILE  12   6.414  -0.331   2.997
  128   2HG2  ILE  12          2HG2      ILE  12   6.011   0.385   4.576
  129   3HG2  ILE  12          3HG2      ILE  12   7.674  -0.155   4.241
  130   1HD1  ILE  12          1HD1      ILE  12   5.223  -0.923   7.796
  131   2HD1  ILE  12          2HD1      ILE  12   5.721   0.246   6.549
  132   3HD1  ILE  12          3HD1      ILE  12   4.356  -0.855   6.243
  133    HA   PRO  13           HA       PRO  13   1.793   0.358   5.107
  134   1HB   PRO  13          1HB       PRO  13   0.508  -1.297   6.111
  135   2HB   PRO  13          2HB       PRO  13  -0.596  -0.920   4.777
  136   1HG   PRO  13          1HG       PRO  13   0.165  -3.497   5.074
  137   2HG   PRO  13          2HG       PRO  13   0.231  -2.794   3.439
  138   1HD   PRO  13          1HD       PRO  13   2.552  -3.318   5.348
  139   2HD   PRO  13          2HD       PRO  13   2.501  -3.472   3.565
  140    HA   PRO  14           HA       PRO  14  -0.114   2.329   1.694
  141   1HB   PRO  14          1HB       PRO  14   1.583   4.517   1.456
  142   2HB   PRO  14          2HB       PRO  14   0.472   4.247   2.806
  143   1HG   PRO  14          1HG       PRO  14   3.468   3.584   2.711
  144   2HG   PRO  14          2HG       PRO  14   2.592   4.470   3.980
  145   1HD   PRO  14          1HD       PRO  14   3.154   1.764   4.232
  146   2HD   PRO  14          2HD       PRO  14   1.623   2.431   4.869
  Start of MODEL   18
    1   1H    ARG   1          H         ARG   1   2.778   0.944   1.421
    2    HA   ARG   1           HA       ARG   1   3.045   1.976  -1.227
    3   1HB   ARG   1          1HB       ARG   1   4.627   3.172   0.711
    4   2HB   ARG   1          2HB       ARG   1   5.678   1.876   0.176
    5   1HG   ARG   1          1HG       ARG   1   6.185   3.023  -1.711
    6   2HG   ARG   1          2HG       ARG   1   4.495   3.059  -2.173
    7   1HD   ARG   1          1HD       ARG   1   6.022   5.100  -0.510
    8   2HD   ARG   1          2HD       ARG   1   5.167   5.361  -2.017
    9    HE   ARG   1           HE       ARG   1   3.179   4.460  -0.304
   10   1HH1  ARG   1          2HH2      ARG   1   5.538   7.069  -0.169
   11   2HH1  ARG   1          1HH2      ARG   1   4.540   8.091   0.810
   12   1HH2  ARG   1          2HH1      ARG   1   1.862   5.810   0.987
   13   2HH2  ARG   1          1HH1      ARG   1   2.435   7.370   1.472
   14    H    VAL   2           H        VAL   2   3.993   0.410  -2.637
   15    HA   VAL   2           HA       VAL   2   5.359  -1.850  -1.493
   16    HB   VAL   2           HB       VAL   2   2.637  -2.110  -2.780
   17   1HG1  VAL   2          1HG1      VAL   2   3.006  -4.585  -2.491
   18   2HG1  VAL   2          2HG1      VAL   2   4.007  -3.822  -3.750
   19   3HG1  VAL   2          3HG1      VAL   2   4.720  -4.229  -2.170
   20   1HG2  VAL   2          1HG2      VAL   2   3.728  -2.662  -0.019
   21   2HG2  VAL   2          2HG2      VAL   2   2.303  -1.707  -0.494
   22   3HG2  VAL   2          3HG2      VAL   2   2.267  -3.482  -0.622
   23    H    ARG   3           H        ARG   3   7.120  -1.887  -2.791
   24    HA   ARG   3           HA       ARG   3   6.660  -2.159  -5.590
   25   1HB   ARG   3          1HB       ARG   3   7.078   0.428  -4.730
   26   2HB   ARG   3          2HB       ARG   3   8.732  -0.078  -5.005
   27   1HG   ARG   3          1HG       ARG   3   8.357   0.456  -7.189
   28   2HG   ARG   3          2HG       ARG   3   7.480  -1.059  -7.275
   29   1HD   ARG   3          1HD       ARG   3   6.107   1.506  -6.376
   30   2HD   ARG   3          2HD       ARG   3   6.257   1.105  -8.075
   31    HE   ARG   3           HE       ARG   3   5.199  -1.134  -6.555
   32   1HH1  ARG   3          2HH2      ARG   3   4.313   1.937  -8.027
   33   2HH1  ARG   3          1HH2      ARG   3   2.647   1.508  -8.226
   34   1HH2  ARG   3          2HH1      ARG   3   3.002  -1.702  -6.819
   35   2HH2  ARG   3          1HH1      ARG   3   1.896  -0.577  -7.535
   36    H    THR   4           H        THR   4   9.396  -1.715  -6.421
   37    HA   THR   4           HA       THR   4  10.748  -3.793  -4.830
   38    HB   THR   4           HB       THR   4   9.997  -3.765  -7.536
   39    HG1  THR   4           1HG      THR   4  12.316  -5.061  -6.301
   40   1HG2  THR   4          1HG2      THR   4  13.033  -3.532  -7.380
   41   2HG2  THR   4          2HG2      THR   4  12.008  -3.602  -8.834
   42   3HG2  THR   4          3HG2      THR   4  12.026  -2.134  -7.828
   43    H    ARG   5           H        ARG   5  13.291  -3.647  -5.385
   44    HA   ARG   5           HA       ARG   5  14.423  -1.221  -5.828
   45   1HB   ARG   5          1HB       ARG   5  13.338  -0.326  -3.832
   46   2HB   ARG   5          2HB       ARG   5  13.821  -1.712  -2.874
   47   1HG   ARG   5          1HG       ARG   5  16.130  -1.057  -2.875
   48   2HG   ARG   5          2HG       ARG   5  15.903   0.061  -4.204
   49   1HD   ARG   5          1HD       ARG   5  15.827   1.626  -2.515
   50   2HD   ARG   5          2HD       ARG   5  14.142   1.152  -2.430
   51    HE   ARG   5           HE       ARG   5  15.502  -0.680  -0.793
   52   1HH1  ARG   5          2HH2      ARG   5  15.071   2.811  -0.895
   53   2HH1  ARG   5          1HH2      ARG   5  15.230   3.010   0.818
   54   1HH2  ARG   5          2HH1      ARG   5  15.712  -0.418   1.468
   55   2HH2  ARG   5          1HH1      ARG   5  15.598   1.160   2.171
   56    H    LYS   6           H        LYS   6  16.784  -1.309  -5.499
   57    HA   LYS   6           HA       LYS   6  18.667  -2.484  -5.682
   58   1HB   LYS   6          1HB       LYS   6  19.510  -3.251  -3.617
   59   2HB   LYS   6          2HB       LYS   6  18.385  -1.969  -3.220
   60   1HG   LYS   6          1HG       LYS   6  17.137  -4.666  -3.367
   61   2HG   LYS   6          2HG       LYS   6  18.351  -4.512  -2.113
   62   1HD   LYS   6          1HD       LYS   6  17.081  -2.229  -1.575
   63   2HD   LYS   6          2HD       LYS   6  15.757  -2.988  -2.436
   64   1HE   LYS   6          1HE       LYS   6  15.292  -3.778  -0.304
   65   2HE   LYS   6          2HE       LYS   6  16.352  -5.067  -0.841
   66   1HZ   LYS   6          1HZ       LYS   6  17.286  -4.456   1.124
   67   2HZ   LYS   6          2HZ       LYS   6  18.163  -3.524   0.109
   68   3HZ   LYS   6          3HZ       LYS   6  16.938  -2.868   0.967
   69    H    GLY   7           H        GLY   7  16.481  -3.673  -7.102
   70   1HA   GLY   7          1HA       GLY   7  16.008  -5.575  -8.202
   71   2HA   GLY   7          2HA       GLY   7  17.553  -6.201  -7.662
   72    H    ARG   8           H        ARG   8  14.938  -5.103  -5.460
   73    HA   ARG   8           HA       ARG   8  14.264  -7.861  -4.954
   74   1HB   ARG   8          1HB       ARG   8  15.276  -5.911  -2.826
   75   2HB   ARG   8          2HB       ARG   8  14.443  -7.402  -2.434
   76   1HG   ARG   8          1HG       ARG   8  16.213  -8.644  -3.810
   77   2HG   ARG   8          2HG       ARG   8  17.086  -7.129  -3.937
   78   1HD   ARG   8          1HD       ARG   8  17.560  -7.051  -1.611
   79   2HD   ARG   8          2HD       ARG   8  16.241  -8.128  -1.200
   80    HE   ARG   8           HE       ARG   8  18.248  -9.400  -2.908
   81   1HH1  ARG   8          2HH2      ARG   8  17.397  -8.606   0.413
   82   2HH1  ARG   8          1HH2      ARG   8  18.360  -9.873   1.098
   83   1HH2  ARG   8          2HH1      ARG   8  19.517 -11.072  -2.006
   84   2HH2  ARG   8          1HH1      ARG   8  19.575 -11.285  -0.288
   85    H    ARG   9           H        ARG   9  12.262  -7.992  -3.462
   86    HA   ARG   9           HA       ARG   9  10.623  -5.657  -4.014
   87   1HB   ARG   9          1HB       ARG   9   9.789  -7.712  -5.077
   88   2HB   ARG   9          2HB       ARG   9   9.879  -8.589  -3.563
   89   1HG   ARG   9          1HG       ARG   9   8.226  -6.080  -3.564
   90   2HG   ARG   9          2HG       ARG   9   7.587  -7.438  -4.469
   91   1HD   ARG   9          1HD       ARG   9   8.578  -7.776  -1.609
   92   2HD   ARG   9          2HD       ARG   9   6.941  -7.250  -1.948
   93    HE   ARG   9           HE       ARG   9   6.462  -9.384  -2.952
   94   1HH1  ARG   9          2HH2      ARG   9   9.753  -9.167  -1.724
   95   2HH1  ARG   9          1HH2      ARG   9  10.011 -10.880  -1.749
   96   1HH2  ARG   9          2HH1      ARG   9   6.803 -11.643  -2.986
   97   2HH2  ARG   9          1HH1      ARG   9   8.322 -12.298  -2.473
   98    H    ILE  10           H        ILE  10   9.403  -4.692  -2.310
   99    HA   ILE  10           HA       ILE  10   9.593  -5.944   0.313
  100    HB   ILE  10           HB       ILE  10  10.056  -3.123   0.568
  101   1HG1  ILE  10          2HG1      ILE  10  12.421  -3.154  -0.314
  102   2HG1  ILE  10          3HG1      ILE  10  12.022  -4.624  -1.180
  103   1HG2  ILE  10          1HG2      ILE  10  11.989  -5.310   1.300
  104   2HG2  ILE  10          2HG2      ILE  10  11.626  -3.787   2.148
  105   3HG2  ILE  10          3HG2      ILE  10  10.444  -5.119   2.164
  106   1HD1  ILE  10          1HD1      ILE  10   9.900  -2.814  -1.749
  107   2HD1  ILE  10          2HD1      ILE  10  11.405  -1.872  -1.882
  108   3HD1  ILE  10          3HD1      ILE  10  11.190  -3.348  -2.854
  109    H    ARG  11           H        ARG  11   7.850  -5.429   1.694
  110    HA   ARG  11           HA       ARG  11   5.873  -3.679   0.481
  111   1HB   ARG  11          1HB       ARG  11   5.484  -6.307   0.303
  112   2HB   ARG  11          2HB       ARG  11   5.028  -6.175   1.990
  113   1HG   ARG  11          1HG       ARG  11   3.452  -4.237   1.221
  114   2HG   ARG  11          2HG       ARG  11   3.729  -4.824  -0.407
  115   1HD   ARG  11          1HD       ARG  11   2.699  -6.932   0.040
  116   2HD   ARG  11          2HD       ARG  11   2.864  -6.753   1.774
  117    HE   ARG  11           HE       ARG  11   1.249  -4.602   0.965
  118   1HH1  ARG  11          2HH2      ARG  11   1.080  -8.114   0.810
  119   2HH1  ARG  11          1HH2      ARG  11  -0.650  -8.160   0.856
  120   1HH2  ARG  11          2HH1      ARG  11  -1.034  -4.663   1.025
  121   2HH2  ARG  11          1HH1      ARG  11  -1.861  -6.184   0.979
  122    H    ILE  12           H        ILE  12   4.730  -2.362   1.977
  123    HA   ILE  12           HA       ILE  12   4.694  -2.940   4.746
  124    HB   ILE  12           HB       ILE  12   7.099  -2.183   4.267
  125   1HG1  ILE  12          2HG1      ILE  12   6.721  -0.481   6.373
  126   2HG1  ILE  12          3HG1      ILE  12   5.243  -1.419   6.437
  127   1HG2  ILE  12          1HG2      ILE  12   6.054   0.611   4.465
  128   2HG2  ILE  12          2HG2      ILE  12   7.593   0.005   3.812
  129   3HG2  ILE  12          3HG2      ILE  12   6.093  -0.182   2.872
  130   1HD1  ILE  12          1HD1      ILE  12   6.743  -3.522   6.218
  131   2HD1  ILE  12          2HD1      ILE  12   8.107  -2.433   6.570
  132   3HD1  ILE  12          3HD1      ILE  12   6.804  -2.642   7.765
  133    HA   PRO  13           HA       PRO  13   1.396  -0.190   5.012
  134   1HB   PRO  13          1HB       PRO  13   0.266  -2.140   5.581
  135   2HB   PRO  13          2HB       PRO  13  -0.734  -1.687   4.191
  136   1HG   PRO  13          1HG       PRO  13   0.359  -4.160   4.189
  137   2HG   PRO  13          2HG       PRO  13   0.495  -3.191   2.701
  138   1HD   PRO  13          1HD       PRO  13   2.651  -3.728   4.789
  139   2HD   PRO  13          2HD       PRO  13   2.813  -3.587   3.011
  140    HA   PRO  14           HA       PRO  14  -0.391   2.053   1.704
  141   1HB   PRO  14          1HB       PRO  14   0.945   4.466   2.057
  142   2HB   PRO  14          2HB       PRO  14  -0.258   3.809   3.175
  143   1HG   PRO  14          1HG       PRO  14   2.797   3.599   3.405
  144   2HG   PRO  14          2HG       PRO  14   1.647   4.116   4.659
  145   1HD   PRO  14          1HD       PRO  14   2.606   1.514   4.563
  146   2HD   PRO  14          2HD       PRO  14   0.924   1.837   5.071
  Start of MODEL   19
    1   1H    ARG   1          H         ARG   1   2.453   0.274   0.456
    2    HA   ARG   1           HA       ARG   1   1.252  -1.628   0.102
    3   1HB   ARG   1          1HB       ARG   1  -0.281   0.178  -1.675
    4   2HB   ARG   1          2HB       ARG   1  -0.059  -1.414  -2.372
    5   1HG   ARG   1          1HG       ARG   1  -0.718  -1.907   0.340
    6   2HG   ARG   1          2HG       ARG   1  -1.774  -0.593  -0.139
    7   1HD   ARG   1          1HD       ARG   1  -2.669  -1.874  -2.006
    8   2HD   ARG   1          2HD       ARG   1  -1.440  -3.112  -1.830
    9    HE   ARG   1           HE       ARG   1  -2.843  -2.912   0.649
   10   1HH1  ARG   1          2HH2      ARG   1  -3.409  -3.937  -2.669
   11   2HH1  ARG   1          1HH2      ARG   1  -4.632  -5.086  -2.240
   12   1HH2  ARG   1          2HH1      ARG   1  -4.456  -4.428   1.216
   13   2HH2  ARG   1          1HH1      ARG   1  -5.231  -5.367  -0.016
   14    H    VAL   2           H        VAL   2   3.003  -2.898  -0.468
   15    HA   VAL   2           HA       VAL   2   4.573  -3.862  -1.686
   16    HB   VAL   2           HB       VAL   2   2.359  -3.606  -3.349
   17   1HG1  VAL   2          1HG1      VAL   2   3.362  -1.837  -4.646
   18   2HG1  VAL   2          2HG1      VAL   2   4.877  -2.758  -4.818
   19   3HG1  VAL   2          3HG1      VAL   2   3.390  -3.330  -5.614
   20   1HG2  VAL   2          1HG2      VAL   2   4.842  -5.272  -3.278
   21   2HG2  VAL   2          2HG2      VAL   2   3.136  -5.748  -3.106
   22   3HG2  VAL   2          3HG2      VAL   2   3.799  -5.380  -4.716
   23    H    ARG   3           H        ARG   3   6.667  -3.260  -2.009
   24    HA   ARG   3           HA       ARG   3   7.049  -0.610  -3.145
   25   1HB   ARG   3          1HB       ARG   3   7.582  -1.349  -0.467
   26   2HB   ARG   3          2HB       ARG   3   9.156  -1.389  -1.236
   27   1HG   ARG   3          1HG       ARG   3   9.007   0.862  -0.582
   28   2HG   ARG   3          2HG       ARG   3   8.471   0.944  -2.248
   29   1HD   ARG   3          1HD       ARG   3   6.159   0.343  -0.634
   30   2HD   ARG   3          2HD       ARG   3   7.009   1.662   0.143
   31    HE   ARG   3           HE       ARG   3   5.661   1.743  -2.458
   32   1HH1  ARG   3          2HH2      ARG   3   8.107   3.256  -0.431
   33   2HH1  ARG   3          1HH2      ARG   3   8.023   4.781  -1.247
   34   1HH2  ARG   3          2HH1      ARG   3   5.549   3.756  -3.534
   35   2HH2  ARG   3          1HH1      ARG   3   6.557   5.068  -3.024
   36    H    THR   4           H        THR   4   9.866  -0.572  -3.214
   37    HA   THR   4           HA       THR   4  10.848  -3.070  -4.247
   38    HB   THR   4           HB       THR   4  10.654  -0.707  -6.171
   39    HG1  THR   4           1HG      THR   4   8.630  -1.539  -6.689
   40   1HG2  THR   4          1HG2      THR   4  10.719  -3.681  -6.810
   41   2HG2  THR   4          2HG2      THR   4  11.173  -2.312  -7.853
   42   3HG2  THR   4          3HG2      THR   4  12.235  -2.798  -6.510
   43    H    ARG   5           H        ARG   5  13.115  -3.124  -4.439
   44    HA   ARG   5           HA       ARG   5  14.685  -0.872  -4.345
   45   1HB   ARG   5          1HB       ARG   5  13.810  -0.541  -2.051
   46   2HB   ARG   5          2HB       ARG   5  14.236  -2.185  -1.617
   47   1HG   ARG   5          1HG       ARG   5  16.582  -1.733  -1.698
   48   2HG   ARG   5          2HG       ARG   5  16.362  -0.269  -2.635
   49   1HD   ARG   5          1HD       ARG   5  15.197   0.786  -0.658
   50   2HD   ARG   5          2HD       ARG   5  15.506  -0.665   0.274
   51    HE   ARG   5           HE       ARG   5  18.012   0.084  -0.729
   52   1HH1  ARG   5          2HH2      ARG   5  15.544   1.589   1.277
   53   2HH1  ARG   5          1HH2      ARG   5  16.672   2.566   2.156
   54   1HH2  ARG   5          2HH1      ARG   5  19.502   1.373   0.431
   55   2HH2  ARG   5          1HH1      ARG   5  18.939   2.442   1.671
   56    H    LYS   6           H        LYS   6  17.026  -1.461  -4.163
   57    HA   LYS   6           HA       LYS   6  18.674  -2.799  -4.822
   58   1HB   LYS   6          1HB       LYS   6  17.459  -4.120  -2.431
   59   2HB   LYS   6          2HB       LYS   6  18.700  -4.997  -3.305
   60   1HG   LYS   6          1HG       LYS   6  20.199  -2.968  -3.138
   61   2HG   LYS   6          2HG       LYS   6  18.968  -2.168  -2.183
   62   1HD   LYS   6          1HD       LYS   6  19.681  -3.215  -0.303
   63   2HD   LYS   6          2HD       LYS   6  19.426  -4.785  -1.041
   64   1HE   LYS   6          1HE       LYS   6  21.850  -3.371  -2.030
   65   2HE   LYS   6          2HE       LYS   6  21.899  -3.753  -0.321
   66   1HZ   LYS   6          1HZ       LYS   6  20.895  -5.956  -1.677
   67   2HZ   LYS   6          2HZ       LYS   6  22.249  -5.476  -2.455
   68   3HZ   LYS   6          3HZ       LYS   6  22.305  -5.831  -0.861
   69    H    GLY   7           H        GLY   7  16.490  -2.901  -6.585
   70   1HA   GLY   7          1HA       GLY   7  15.573  -4.143  -8.220
   71   2HA   GLY   7          2HA       GLY   7  17.054  -5.078  -8.157
   72    H    ARG   8           H        ARG   8  14.693  -4.769  -5.460
   73    HA   ARG   8           HA       ARG   8  13.903  -7.511  -5.998
   74   1HB   ARG   8          1HB       ARG   8  14.816  -6.335  -3.329
   75   2HB   ARG   8          2HB       ARG   8  13.933  -7.845  -3.437
   76   1HG   ARG   8          1HG       ARG   8  15.897  -8.300  -5.306
   77   2HG   ARG   8          2HG       ARG   8  16.757  -7.237  -4.210
   78   1HD   ARG   8          1HD       ARG   8  15.399  -9.033  -2.500
   79   2HD   ARG   8          2HD       ARG   8  15.948 -10.039  -3.826
   80    HE   ARG   8           HE       ARG   8  18.125  -8.365  -3.119
   81   1HH1  ARG   8          2HH2      ARG   8  16.207 -10.928  -1.657
   82   2HH1  ARG   8          1HH2      ARG   8  17.491 -11.480  -0.633
   83   1HH2  ARG   8          2HH1      ARG   8  19.819  -9.093  -1.769
   84   2HH2  ARG   8          1HH1      ARG   8  19.559 -10.429  -0.698
   85    H    ARG   9           H        ARG   9  11.844  -8.100  -4.671
   86    HA   ARG   9           HA       ARG   9  10.175  -5.725  -4.637
   87   1HB   ARG   9          1HB       ARG   9   9.350  -7.401  -6.190
   88   2HB   ARG   9          2HB       ARG   9   9.549  -8.688  -5.017
   89   1HG   ARG   9          1HG       ARG   9   7.197  -8.175  -5.058
   90   2HG   ARG   9          2HG       ARG   9   7.814  -7.520  -3.554
   91   1HD   ARG   9          1HD       ARG   9   6.457  -5.772  -4.460
   92   2HD   ARG   9          2HD       ARG   9   8.102  -5.272  -4.800
   93    HE   ARG   9           HE       ARG   9   7.237  -6.811  -7.022
   94   1HH1  ARG   9          2HH2      ARG   9   6.419  -3.769  -5.453
   95   2HH1  ARG   9          1HH2      ARG   9   5.842  -3.027  -6.907
   96   1HH2  ARG   9          2HH1      ARG   9   6.477  -5.831  -8.942
   97   2HH2  ARG   9          1HH1      ARG   9   5.876  -4.207  -8.905
   98    H    ILE  10           H        ILE  10   9.189  -5.072  -2.716
   99    HA   ILE  10           HA       ILE  10   9.010  -6.991  -0.543
  100    HB   ILE  10           HB       ILE  10  10.234  -4.331   0.063
  101   1HG1  ILE  10          2HG1      ILE  10  12.485  -5.584  -0.036
  102   2HG1  ILE  10          3HG1      ILE  10  11.672  -6.723  -1.090
  103   1HG2  ILE  10          1HG2      ILE  10   9.926  -5.226   2.089
  104   2HG2  ILE  10          2HG2      ILE  10   9.701  -6.868   1.440
  105   3HG2  ILE  10          3HG2      ILE  10  11.343  -6.232   1.701
  106   1HD1  ILE  10          1HD1      ILE  10  11.750  -5.292  -2.850
  107   2HD1  ILE  10          2HD1      ILE  10  11.101  -3.951  -1.875
  108   3HD1  ILE  10          3HD1      ILE  10  12.847  -4.295  -1.864
  109    H    ARG  11           H        ARG  11   7.719  -5.971   1.336
  110    HA   ARG  11           HA       ARG  11   5.774  -4.167   0.137
  111   1HB   ARG  11          1HB       ARG  11   5.004  -6.571   0.642
  112   2HB   ARG  11          2HB       ARG  11   5.230  -6.214   2.342
  113   1HG   ARG  11          1HG       ARG  11   3.156  -5.305   2.396
  114   2HG   ARG  11          2HG       ARG  11   3.710  -4.037   1.319
  115   1HD   ARG  11          1HD       ARG  11   2.006  -4.902  -0.001
  116   2HD   ARG  11          2HD       ARG  11   3.314  -5.928  -0.555
  117    HE   ARG  11           HE       ARG  11   2.347  -7.339   1.601
  118   1HH1  ARG  11          2HH2      ARG  11   0.789  -5.916  -1.215
  119   2HH1  ARG  11          1HH2      ARG  11  -0.489  -7.084  -1.258
  120   1HH2  ARG  11          2HH1      ARG  11   0.662  -8.881   1.546
  121   2HH2  ARG  11          1HH1      ARG  11  -0.562  -8.783   0.324
  122    H    ILE  12           H        ILE  12   5.118  -2.354   1.379
  123    HA   ILE  12           HA       ILE  12   5.414  -2.109   4.117
  124    HB   ILE  12           HB       ILE  12   7.896  -2.182   3.081
  125   1HG1  ILE  12          2HG1      ILE  12   7.451  -0.282   5.347
  126   2HG1  ILE  12          3HG1      ILE  12   6.855  -1.922   5.522
  127   1HG2  ILE  12          1HG2      ILE  12   8.772   0.148   3.047
  128   2HG2  ILE  12          2HG2      ILE  12   7.681  -0.232   1.693
  129   3HG2  ILE  12          3HG2      ILE  12   7.094   0.739   3.065
  130   1HD1  ILE  12          1HD1      ILE  12   9.407  -1.198   6.124
  131   2HD1  ILE  12          2HD1      ILE  12   8.967  -2.837   5.592
  132   3HD1  ILE  12          3HD1      ILE  12   9.625  -1.669   4.422
  133    HA   PRO  13           HA       PRO  13   4.530   2.342   3.404
  134   1HB   PRO  13          1HB       PRO  13   4.452   2.405   5.726
  135   2HB   PRO  13          2HB       PRO  13   2.717   2.611   5.426
  136   1HG   PRO  13          1HG       PRO  13   3.471   0.587   7.052
  137   2HG   PRO  13          2HG       PRO  13   2.280   0.228   5.777
  138   1HD   PRO  13          1HD       PRO  13   5.252  -0.457   5.811
  139   2HD   PRO  13          2HD       PRO  13   3.883  -1.408   5.158
  140    HA   PRO  14           HA       PRO  14   0.706   3.014   1.396
  141   1HB   PRO  14          1HB       PRO  14   1.642   3.460  -1.184
  142   2HB   PRO  14          2HB       PRO  14   1.915   4.543   0.187
  143   1HG   PRO  14          1HG       PRO  14   3.837   2.411  -0.901
  144   2HG   PRO  14          2HG       PRO  14   4.199   4.113  -0.534
  145   1HD   PRO  14          1HD       PRO  14   4.777   2.090   1.275
  146   2HD   PRO  14          2HD       PRO  14   4.233   3.691   1.855
  Start of MODEL   20
    1   1H    ARG   1          H         ARG   1   2.014   0.125   0.141
    2    HA   ARG   1           HA       ARG   1   1.715  -2.074   0.914
    3   1HB   ARG   1          1HB       ARG   1  -0.830  -1.760  -0.636
    4   2HB   ARG   1          2HB       ARG   1  -0.091  -3.347  -0.732
    5   1HG   ARG   1          1HG       ARG   1  -0.336  -3.763   1.566
    6   2HG   ARG   1          2HG       ARG   1  -0.320  -2.063   1.989
    7   1HD   ARG   1          1HD       ARG   1  -2.595  -2.756   2.288
    8   2HD   ARG   1          2HD       ARG   1  -2.590  -1.858   0.783
    9    HE   ARG   1           HE       ARG   1  -2.098  -4.502   0.018
   10   1HH1  ARG   1          2HH2      ARG   1  -4.642  -2.830   1.783
   11   2HH1  ARG   1          1HH2      ARG   1  -5.882  -3.937   1.298
   12   1HH2  ARG   1          2HH1      ARG   1  -3.734  -5.963  -0.623
   13   2HH2  ARG   1          1HH1      ARG   1  -5.362  -5.732  -0.080
   14    H    VAL   2           H        VAL   2   3.665  -1.085  -0.593
   15    HA   VAL   2           HA       VAL   2   4.407  -3.132  -2.299
   16    HB   VAL   2           HB       VAL   2   2.784  -1.016  -3.536
   17   1HG1  VAL   2          1HG1      VAL   2   4.899  -0.175  -4.313
   18   2HG1  VAL   2          2HG1      VAL   2   5.451  -1.810  -4.746
   19   3HG1  VAL   2          3HG1      VAL   2   4.126  -1.048  -5.658
   20   1HG2  VAL   2          1HG2      VAL   2   3.123  -3.862  -3.645
   21   2HG2  VAL   2          2HG2      VAL   2   1.840  -2.858  -4.363
   22   3HG2  VAL   2          3HG2      VAL   2   3.325  -3.195  -5.284
   23    H    ARG   3           H        ARG   3   6.613  -3.041  -2.468
   24    HA   ARG   3           HA       ARG   3   7.835  -0.437  -2.342
   25   1HB   ARG   3          1HB       ARG   3   7.601  -1.440   0.042
   26   2HB   ARG   3          2HB       ARG   3   8.755  -2.659  -0.461
   27   1HG   ARG   3          1HG       ARG   3  10.327  -0.735  -1.133
   28   2HG   ARG   3          2HG       ARG   3   9.206   0.355  -0.343
   29   1HD   ARG   3          1HD       ARG   3   9.948  -0.224   1.738
   30   2HD   ARG   3          2HD       ARG   3   9.855  -1.938   1.383
   31    HE   ARG   3           HE       ARG   3  12.077  -1.071  -0.061
   32   1HH1  ARG   3          2HH2      ARG   3  11.103  -0.950   3.319
   33   2HH1  ARG   3          1HH2      ARG   3  12.726  -0.985   3.921
   34   1HH2  ARG   3          2HH1      ARG   3  14.220  -1.117   0.733
   35   2HH2  ARG   3          1HH1      ARG   3  14.511  -1.081   2.440
   36    H    THR   4           H        THR   4  10.137  -0.495  -3.057
   37    HA   THR   4           HA       THR   4  11.010  -3.045  -4.185
   38    HB   THR   4           HB       THR   4  11.058  -0.517  -5.872
   39    HG1  THR   4           1HG      THR   4   8.894  -0.900  -6.304
   40   1HG2  THR   4          1HG2      THR   4  12.271  -2.681  -6.568
   41   2HG2  THR   4          2HG2      THR   4  10.668  -3.453  -6.629
   42   3HG2  THR   4          3HG2      THR   4  11.046  -2.099  -7.720
   43    H    ARG   5           H        ARG   5  13.231  -3.312  -4.296
   44    HA   ARG   5           HA       ARG   5  14.983  -1.175  -4.038
   45   1HB   ARG   5          1HB       ARG   5  14.052  -1.209  -1.674
   46   2HB   ARG   5          2HB       ARG   5  14.655  -2.845  -1.494
   47   1HG   ARG   5          1HG       ARG   5  16.689  -0.911  -2.483
   48   2HG   ARG   5          2HG       ARG   5  16.084  -0.548  -0.880
   49   1HD   ARG   5          1HD       ARG   5  16.796  -2.658   0.003
   50   2HD   ARG   5          2HD       ARG   5  16.952  -3.375  -1.589
   51    HE   ARG   5           HE       ARG   5  18.741  -1.211  -1.585
   52   1HH1  ARG   5          2HH2      ARG   5  18.303  -4.153   0.296
   53   2HH1  ARG   5          1HH2      ARG   5  19.986  -4.315   0.672
   54   1HH2  ARG   5          2HH1      ARG   5  20.961  -1.424  -1.089
   55   2HH2  ARG   5          1HH1      ARG   5  21.509  -2.752  -0.121
   56    H    LYS   6           H        LYS   6  17.274  -1.947  -4.011
   57    HA   LYS   6           HA       LYS   6  18.777  -3.306  -4.939
   58   1HB   LYS   6          1HB       LYS   6  18.648  -3.926  -2.488
   59   2HB   LYS   6          2HB       LYS   6  17.683  -5.312  -2.952
   60   1HG   LYS   6          1HG       LYS   6  19.607  -5.893  -4.606
   61   2HG   LYS   6          2HG       LYS   6  20.560  -4.704  -3.741
   62   1HD   LYS   6          1HD       LYS   6  20.065  -5.952  -1.586
   63   2HD   LYS   6          2HD       LYS   6  19.244  -7.181  -2.529
   64   1HE   LYS   6          1HE       LYS   6  21.389  -8.107  -2.373
   65   2HE   LYS   6          2HE       LYS   6  21.506  -7.269  -3.908
   66   1HZ   LYS   6          1HZ       LYS   6  23.342  -6.557  -2.774
   67   2HZ   LYS   6          2HZ       LYS   6  22.303  -5.337  -2.459
   68   3HZ   LYS   6          3HZ       LYS   6  22.593  -6.474  -1.325
   69    H    GLY   7           H        GLY   7  16.728  -3.118  -6.695
   70   1HA   GLY   7          1HA       GLY   7  15.564  -4.171  -8.320
   71   2HA   GLY   7          2HA       GLY   7  16.980  -5.200  -8.401
   72    H    ARG   8           H        ARG   8  14.655  -4.915  -5.654
   73    HA   ARG   8           HA       ARG   8  13.718  -7.574  -6.332
   74   1HB   ARG   8          1HB       ARG   8  14.768  -6.646  -3.616
   75   2HB   ARG   8          2HB       ARG   8  13.787  -8.086  -3.801
   76   1HG   ARG   8          1HG       ARG   8  16.046  -7.964  -5.718
   77   2HG   ARG   8          2HG       ARG   8  16.565  -7.972  -4.044
   78   1HD   ARG   8          1HD       ARG   8  14.985  -9.982  -3.687
   79   2HD   ARG   8          2HD       ARG   8  14.793 -10.035  -5.428
   80    HE   ARG   8           HE       ARG   8  16.925 -10.975  -5.600
   81   1HH1  ARG   8          2HH2      ARG   8  16.639  -9.373  -2.480
   82   2HH1  ARG   8          1HH2      ARG   8  18.172  -9.939  -1.906
   83   1HH2  ARG   8          2HH1      ARG   8  18.948 -11.722  -4.843
   84   2HH2  ARG   8          1HH1      ARG   8  19.494 -11.284  -3.259
   85    H    ARG   9           H        ARG   9  11.659  -8.131  -4.989
   86    HA   ARG   9           HA       ARG   9  10.078  -5.721  -4.909
   87   1HB   ARG   9          1HB       ARG   9   9.064  -7.456  -6.228
   88   2HB   ARG   9          2HB       ARG   9   9.423  -8.691  -5.038
   89   1HG   ARG   9          1HG       ARG   9   7.654  -6.382  -4.216
   90   2HG   ARG   9          2HG       ARG   9   6.971  -7.630  -5.240
   91   1HD   ARG   9          1HD       ARG   9   8.374  -9.066  -3.248
   92   2HD   ARG   9          2HD       ARG   9   7.636  -7.735  -2.377
   93    HE   ARG   9           HE       ARG   9   5.587  -8.668  -4.012
   94   1HH1  ARG   9          2HH2      ARG   9   7.694 -10.137  -1.607
   95   2HH1  ARG   9          1HH2      ARG   9   6.535 -11.334  -1.136
   96   1HH2  ARG   9          2HH1      ARG   9   4.057 -10.247  -3.390
   97   2HH2  ARG   9          1HH1      ARG   9   4.452 -11.397  -2.157
   98    H    ILE  10           H        ILE  10   9.202  -4.891  -2.996
   99    HA   ILE  10           HA       ILE  10   9.259  -6.596  -0.634
  100    HB   ILE  10           HB       ILE  10  10.380  -3.810  -0.515
  101   1HG1  ILE  10          2HG1      ILE  10  12.622  -5.236  -0.333
  102   2HG1  ILE  10          3HG1      ILE  10  11.742  -6.328  -1.384
  103   1HG2  ILE  10          1HG2      ILE  10  10.023  -6.094   1.343
  104   2HG2  ILE  10          2HG2      ILE  10  11.555  -5.197   1.472
  105   3HG2  ILE  10          3HG2      ILE  10  10.004  -4.341   1.649
  106   1HD1  ILE  10          1HD1      ILE  10  13.148  -4.518  -2.550
  107   2HD1  ILE  10          2HD1      ILE  10  11.453  -4.650  -3.079
  108   3HD1  ILE  10          3HD1      ILE  10  11.941  -3.346  -1.969
  109    H    ARG  11           H        ARG  11   8.107  -5.319   1.252
  110    HA   ARG  11           HA       ARG  11   5.908  -3.875   0.003
  111   1HB   ARG  11          1HB       ARG  11   5.587  -6.307   1.096
  112   2HB   ARG  11          2HB       ARG  11   5.539  -5.399   2.593
  113   1HG   ARG  11          1HG       ARG  11   3.732  -3.929   1.571
  114   2HG   ARG  11          2HG       ARG  11   3.723  -4.985   0.173
  115   1HD   ARG  11          1HD       ARG  11   3.504  -6.785   2.313
  116   2HD   ARG  11          2HD       ARG  11   2.550  -5.417   2.853
  117    HE   ARG  11           HE       ARG  11   1.765  -5.816   0.197
  118   1HH1  ARG  11          2HH2      ARG  11   1.813  -7.763   3.127
  119   2HH1  ARG  11          1HH2      ARG  11   0.448  -8.723   2.664
  120   1HH2  ARG  11          2HH1      ARG  11  -0.036  -7.082  -0.415
  121   2HH2  ARG  11          1HH1      ARG  11  -0.611  -8.333   0.636
  122    H    ILE  12           H        ILE  12   5.158  -1.983   1.094
  123    HA   ILE  12           HA       ILE  12   5.950  -1.372   3.737
  124    HB   ILE  12           HB       ILE  12   8.047  -1.056   2.161
  125   1HG1  ILE  12          2HG1      ILE  12   8.840   0.709   3.720
  126   2HG1  ILE  12          3HG1      ILE  12   7.205   0.900   4.321
  127   1HG2  ILE  12          1HG2      ILE  12   6.541   1.551   1.816
  128   2HG2  ILE  12          2HG2      ILE  12   8.254   1.287   1.414
  129   3HG2  ILE  12          3HG2      ILE  12   6.987   0.396   0.538
  130   1HD1  ILE  12          1HD1      ILE  12   8.241  -1.906   4.280
  131   2HD1  ILE  12          2HD1      ILE  12   9.012  -0.800   5.441
  132   3HD1  ILE  12          3HD1      ILE  12   7.255  -1.075   5.506
  133    HA   PRO  13           HA       PRO  13   3.793   2.621   3.108
  134   1HB   PRO  13          1HB       PRO  13   4.080   2.786   5.408
  135   2HB   PRO  13          2HB       PRO  13   2.329   2.519   5.410
  136   1HG   PRO  13          1HG       PRO  13   3.848   0.850   6.898
  137   2HG   PRO  13          2HG       PRO  13   2.602   0.127   5.850
  138   1HD   PRO  13          1HD       PRO  13   5.613   0.238   5.379
  139   2HD   PRO  13          2HD       PRO  13   4.455  -1.069   4.978
  140    HA   PRO  14           HA       PRO  14  -0.295   2.086   1.693
  141   1HB   PRO  14          1HB       PRO  14   0.099   2.601  -1.010
  142   2HB   PRO  14          2HB       PRO  14   0.279   3.799   0.279
  143   1HG   PRO  14          1HG       PRO  14   2.509   2.167  -1.058
  144   2HG   PRO  14          2HG       PRO  14   2.464   3.923  -0.786
  145   1HD   PRO  14          1HD       PRO  14   3.811   2.227   0.948
  146   2HD   PRO  14          2HD       PRO  14   2.959   3.666   1.575