*HEADER    ANTIMICROBIAL PROTEIN                   16-NOV-00   1G89              
*TITLE     STRUCTURE OF THE BOVINE ANTIMICROBIAL PEPTIDE INDOLICIDIN             
*TITLE    2 BOUND TO DODECYLPHOSPHOCHOLINE MICELLES                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INDOLICIDIN;                                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   4 SEQUENCE OCCURS NATURALLY IN BOS TAURUS (BOVINE)                     
*SOURCE   5 NEUTROPHILS. THE SEQUENCE IS NATURALLY AMIDATED AT THE C-            
*SOURCE   6 TERMINUS.                                                            
*KEYWDS    POLY-L-PROLINE II HELIX, HALF TURN                                    
*EXPDTA    NMR, 16 STRUCTURES                                                    
*AUTHOR    A.ROZEK, C.L.FRIEDRICH, R.E.W.HANCOCK                                 
*REVDAT   1   29-NOV-00 1G89    0                                                
assign ( resid   1 and name HB   ) (resid   1 and name HA   ) 2.4 0.6 0.5
assign ( resid   1 and name HD1* ) (resid   1 and name HA   ) 4.0 1.4 1.5
assign ( resid   1 and name HG2* ) (resid   1 and name HA   ) 2.7 0.8 0.8
assign ( resid   2 and name HN   ) (resid   1 and name HA   ) 2.5 0.6 0.5
assign ( resid   2 and name HN   ) (resid   1 and name HB   ) 3.1 0.6 0.6
assign ( resid   2 and name HN   ) (resid   1 and name HG2* ) 3.9 1.4 1.4
assign ( resid   2 and name HN   ) (resid   2 and name HA   ) 2.6 0.5 0.5
assign ( resid   2 and name HN   ) (resid   2 and name HG   ) 3.1 0.6 0.6
assign ( resid   2 and name HN   ) (resid   2 and name HB1  ) 3.3 1.1 1.1
assign ( resid   2 and name HN   ) (resid   2 and name HB2  ) 3.3 1.1 1.1
assign ( resid   2 and name HN   ) (resid   2 and name HD1* ) 4.2 1.6 1.5
assign ( resid   2 and name HG   ) (resid   1 and name HB   ) 2.4 0.6 0.5
assign ( resid   2 and name HB1  ) (resid   2 and name HB2  ) 1.8 0.1 0.1
assign ( resid   2 and name HB1  ) (resid   2 and name HD1* ) 2.8 0.9 1.0
assign ( resid   2 and name HB1  ) (resid   2 and name HD2* ) 2.8 0.9 1.0
assign ( resid   2 and name HB2  ) (resid   2 and name HA   ) 2.5 0.7 0.6
assign ( resid   2 and name HB2  ) (resid   3 and name HD2  ) 4.8 2.4 2.3
assign ( resid   2 and name HD1* ) (resid   2 and name HA   ) 3.5 1.4 1.5
assign ( resid   2 and name HD2* ) (resid   2 and name HA   ) 3.5 1.4 1.5
assign ( resid   2 and name HD2* ) (resid   3 and name HD1  ) 5.1 3.0 3.0
assign ( resid   2 and name HD2* ) (resid   3 and name HD2  ) 5.1 3.0 3.0
assign ( resid   3 and name HB1  ) (resid   3 and name HA   ) 2.5 0.5 0.5
assign ( resid   3 and name HB1  ) (resid   3 and name HB2  ) 1.8 0.1 0.1
assign ( resid   3 and name HB2  ) (resid   3 and name HA   ) 2.5 0.5 0.5
assign ( resid   3 and name HD1  ) (resid   2 and name HA   ) 2.3 0.6 0.6
assign ( resid   3 and name HD2  ) (resid   2 and name HA   ) 2.3 0.6 0.6
assign ( resid   3 and name HD2  ) (resid   3 and name HD1  ) 1.8 0.1 0.1
assign ( resid   3 and name HG1  ) (resid   3 and name HD1  ) 2.5 0.5 0.6
assign ( resid   3 and name HG1  ) (resid   3 and name HD2  ) 2.5 0.5 0.6
assign ( resid   3 and name HG1  ) (resid   3 and name HG2  ) 1.8 0.1 0.1
assign ( resid   3 and name HG2  ) (resid   3 and name HD1  ) 2.5 0.5 0.6
assign ( resid   3 and name HG2  ) (resid   3 and name HD2  ) 2.5 0.5 0.6
assign ( resid   4 and name HN   ) (resid   3 and name HA   ) 2.4 0.6 0.5
assign ( resid   4 and name HN   ) (resid   3 and name HB1  ) 3.0 0.9 0.8
assign ( resid   4 and name HN   ) (resid   3 and name HB2  ) 3.0 0.9 0.8
assign ( resid   4 and name HN   ) (resid   3 and name HD1  ) 4.0 1.5 1.5
assign ( resid   4 and name HN   ) (resid   4 and name HA   ) 2.5 0.5 0.6
assign ( resid   4 and name HN   ) (resid   4 and name HB*  ) 2.8 1.1 1.0
assign ( resid   4 and name HN   ) (resid   5 and name HN   ) 2.4 0.6 0.5
assign ( resid   4 and name HB*  ) (resid   4 and name HA   ) 2.2 0.6 0.5
assign ( resid   4 and name HD1  ) (resid   4 and name HA   ) 3.4 1.1 1.1
assign ( resid   4 and name HD1  ) (resid   4 and name HB*  ) 2.8 1.0 1.0
assign ( resid   4 and name HD1  ) (resid   5 and name HD*  ) 3.8 1.2 1.2
assign ( resid   4 and name HD1  ) (resid   5 and name HG*  ) 4.0 1.2 1.2
assign ( resid   4 and name HE1  ) (resid   2 and name HD1* ) 5.6 3.0 3.0
assign ( resid   4 and name HE3  ) (resid   2 and name HD1* ) 6.0 3.1 3.1
assign ( resid   4 and name HE3  ) (resid   4 and name HA   ) 2.9 0.8 0.8
assign ( resid   4 and name HE3  ) (resid   4 and name HB*  ) 2.7 1.0 1.0
assign ( resid   4 and name HH2  ) (resid   2 and name HD1* ) 6.3 3.3 3.3
assign ( resid   4 and name HZ2  ) (resid   2 and name HD1* ) 5.1 2.9 2.8
assign ( resid   5 and name HN   ) (resid   4 and name HA   ) 2.2 0.6 0.5
assign ( resid   5 and name HN   ) (resid   4 and name HB*  ) 3.0 1.1 1.2
assign ( resid   5 and name HN   ) (resid   5 and name HA   ) 2.5 0.6 0.5
assign ( resid   5 and name HN   ) (resid   5 and name HB1  ) 2.6 0.8 0.8
assign ( resid   5 and name HN   ) (resid   5 and name HB2  ) 2.6 0.8 0.8
assign ( resid   5 and name HN   ) (resid   5 and name HG*  ) 3.2 1.1 1.0
assign ( resid   5 and name HN   ) (resid   6 and name HN   ) 2.7 0.7 0.7
assign ( resid   5 and name HB1  ) (resid   5 and name HA   ) 2.5 0.7 0.6
assign ( resid   5 and name HB2  ) (resid   5 and name HB1  ) 1.8 0.1 0.1
assign ( resid   5 and name HD*  ) (resid   5 and name HG*  ) 2.5 0.7 0.6
assign ( resid   5 and name HG*  ) (resid   5 and name HA   ) 2.9 0.9 0.9
assign ( resid   6 and name HN   ) (resid   5 and name HA   ) 2.4 0.7 0.6
assign ( resid   6 and name HN   ) (resid   5 and name HB1  ) 3.1 0.8 0.8
assign ( resid   6 and name HN   ) (resid   5 and name HB2  ) 3.1 0.8 0.8
assign ( resid   6 and name HN   ) (resid   6 and name HA   ) 2.6 0.5 0.5
assign ( resid   6 and name HN   ) (resid   6 and name HB1  ) 2.6 0.6 0.6
assign ( resid   6 and name HN   ) (resid   6 and name HB2  ) 2.6 0.6 0.6
assign ( resid   6 and name HN   ) (resid   6 and name HD1  ) 3.4 1.0 1.0
assign ( resid   6 and name HD1  ) (resid   6 and name HA   ) 3.0 1.1 1.0
assign ( resid   6 and name HD1  ) (resid   6 and name HB1  ) 2.9 0.7 0.7
assign ( resid   6 and name HD1  ) (resid   6 and name HB2  ) 2.9 0.7 0.7
assign ( resid   6 and name HD1  ) (resid   7 and name HA   ) 3.0 0.8 0.8
assign ( resid   6 and name HD1  ) (resid   7 and name HD2  ) 3.6 1.4 1.4
assign ( resid   6 and name HD1  ) (resid   9 and name  HN  ) 7.5 2.5 2.5
assign ( resid   6 and name HE1  ) (resid   9 and name  HN  ) 7.5 2.5 2.5
assign ( resid   6 and name HE3  ) (resid   6 and name HA   ) 2.5 0.6 0.7
assign ( resid   6 and name HE3  ) (resid   6 and name HB1  ) 2.8 0.9 1.0
assign ( resid   6 and name HE3  ) (resid   6 and name HB2  ) 2.8 0.9 1.0
assign ( resid   6 and name HE3  ) (resid   6 and name  HN  ) 3.5 1.0 1.0
assign ( resid   6 and name HE3  ) (resid   7 and name HD1  ) 3.0 0.8 0.8
assign ( resid   6 and name HE3  ) (resid   7 and name HD2  ) 3.0 0.8 0.8
assign ( resid   7 and name HB1  ) (resid   7 and name HA   ) 2.5 0.5 0.6
assign ( resid   7 and name HB2  ) (resid   7 and name HB1  ) 1.8 0.1 0.1
assign ( resid   7 and name HD1  ) (resid   6 and name HA   ) 2.4 0.6 0.5
assign ( resid   7 and name HD2  ) (resid   6 and name HA   ) 2.4 0.6 0.5
assign ( resid   7 and name HD2  ) (resid   7 and name HD1  ) 1.8 0.1 0.1
assign ( resid   7 and name HG1  ) (resid   7 and name HB1  ) 2.7 0.4 0.4
assign ( resid   7 and name HG1  ) (resid   7 and name HD1  ) 2.5 0.5 0.6
assign ( resid   7 and name HG1  ) (resid   7 and name HD2  ) 2.5 0.5 0.6
assign ( resid   7 and name HG1  ) (resid   7 and name HG2  ) 1.8 0.1 0.1
assign ( resid   7 and name HG2  ) (resid   7 and name HD1  ) 2.5 0.5 0.6
assign ( resid   7 and name HG2  ) (resid   7 and name HD2  ) 2.5 0.5 0.6
assign ( resid   8 and name HN   ) (resid   7 and name HA   ) 2.5 0.6 0.7
assign ( resid   8 and name HN   ) (resid   7 and name HB1  ) 3.3 1.2 1.2
assign ( resid   8 and name HN   ) (resid   7 and name HB2  ) 3.3 1.2 1.2
assign ( resid   8 and name HN   ) (resid   7 and name HD2  ) 4.0 1.5 1.5
assign ( resid   8 and name HN   ) (resid   8 and name HB1  ) 2.6 0.8 0.9
assign ( resid   8 and name HN   ) (resid   8 and name HB2  ) 2.6 0.8 0.9
assign ( resid   8 and name HD1  ) (resid   7 and name HG1  ) 3.0 0.9 1.0
assign ( resid   8 and name HD1  ) (resid   7 and name HG2  ) 3.0 0.9 1.0
assign ( resid   8 and name HD1  ) (resid   8 and name HA   ) 3.3 1.1 1.1
assign ( resid   8 and name HD1  ) (resid   8 and name HN   ) 2.6 0.7 0.7
assign ( resid   8 and name HD1  ) (resid   8 and name HB1  ) 3.2 1.4 1.4
assign ( resid   8 and name HE3  ) (resid   8 and name HN   ) 2.8 0.9 0.9
assign ( resid   8 and name HE3  ) (resid   8 and name HB2  ) 3.3 1.4 1.4
assign ( resid   9 and name HN   ) (resid   8 and name HA   ) 2.3 0.5 0.5
assign ( resid   9 and name HN   ) (resid   8 and name HN   ) 2.9 0.7 0.7
assign ( resid   9 and name HN   ) (resid   8 and name HB1  ) 3.5 1.4 1.5
assign ( resid   9 and name HN   ) (resid   9 and name HA   ) 2.2 0.6 0.5
assign ( resid   9 and name HN   ) (resid   9 and name HB1  ) 2.6 1.0 1.0
assign ( resid   9 and name HN   ) (resid   9 and name HB2  ) 2.6 1.0 1.0
assign ( resid   9 and name HD1  ) (resid   9 and name HA   ) 3.1 0.9 0.9
assign ( resid   9 and name HD1  ) (resid   9 and name HB2  ) 3.4 1.4 1.4
assign ( resid   9 and name HD1  ) (resid  10 and name HD2  ) 4.5 1.7 1.7
assign ( resid   9 and name HE1  ) (resid  11 and name  HN  ) 3.4 0.8 0.8
assign ( resid   9 and name HE1  ) (resid  11 and name HE3  ) 3.3 0.7 0.7
assign ( resid   9 and name HE1  ) (resid  11 and name HB1  ) 3.3 0.7 0.7
assign ( resid   9 and name HE1  ) (resid  11 and name HB2  ) 3.3 0.7 0.7
assign ( resid   9 and name HE3  ) (resid   9 and name HA   ) 2.9 1.2 1.1
assign ( resid   9 and name HE3  ) (resid   9 and name HB1  ) 2.8 1.2 1.2
assign ( resid   9 and name HE3  ) (resid   9 and name HB2  ) 2.8 1.2 1.2
assign ( resid   9 and name HE3  ) (resid  10 and name HD1  ) 2.8 0.6 0.6
assign ( resid   9 and name HE3  ) (resid  10 and name HD2  ) 2.8 0.6 0.6
assign ( resid  10 and name HB1  ) (resid  10 and name HA   ) 2.4 0.8 0.8
assign ( resid  10 and name HB1  ) (resid  10 and name HB2  ) 1.8 0.1 0.1
assign ( resid  10 and name HB2  ) (resid  10 and name HA   ) 2.4 0.8 0.8
assign ( resid  10 and name HD1  ) (resid   9 and name HA   ) 2.3 0.6 0.6
assign ( resid  10 and name HD2  ) (resid   9 and name HA   ) 2.3 0.6 0.6
assign ( resid  10 and name HD2  ) (resid  10 and name HD1  ) 1.8 0.1 0.1
assign ( resid  10 and name HG1  ) (resid  10 and name HD1  ) 2.5 0.6 0.6
assign ( resid  10 and name HG1  ) (resid  10 and name HG2  ) 1.8 0.1 0.1
assign ( resid  10 and name HG2  ) (resid  10 and name HD1  ) 2.5 0.6 0.6
assign ( resid  11 and name HN   ) (resid  10 and name HA   ) 2.6 0.5 0.5
assign ( resid  11 and name HN   ) (resid  10 and name HB2  ) 4.0 1.5 1.5
assign ( resid  11 and name HN   ) (resid  11 and name HA   ) 2.6 0.6 0.6
assign ( resid  11 and name HN   ) (resid  11 and name HB1  ) 2.9 0.6 0.6
assign ( resid  11 and name HN   ) (resid  11 and name HB2  ) 2.9 0.6 0.6
assign ( resid  11 and name HB1  ) (resid  11 and name HA   ) 2.2 0.6 0.6
assign ( resid  11 and name HB2  ) (resid  11 and name HA   ) 2.2 0.6 0.6
assign ( resid  11 and name HB2  ) (resid  11 and name HB1  ) 1.8 0.1 0.1
assign ( resid  11 and name HD1  ) (resid  11 and name HA   ) 3.0 1.0 1.0
assign ( resid  11 and name HD1  ) (resid  11 and name HB1  ) 2.9 0.9 0.9
assign ( resid  11 and name HD1  ) (resid  11 and name HB2  ) 2.9 0.9 0.9
assign ( resid  11 and name HD1  ) (resid  12 and name HG*  ) 4.0 1.2 1.2
assign ( resid  11 and name HE3  ) (resid  10 and name HD2  ) 4.3 1.6 1.6
assign ( resid  11 and name HE3  ) (resid  11 and name HA   ) 3.2 1.0 1.0
assign ( resid  11 and name HE3  ) (resid  11 and name HN   ) 2.4 0.6 0.5
assign ( resid  11 and name HE3  ) (resid  11 and name HB1  ) 2.8 0.9 1.0
assign ( resid  11 and name HE3  ) (resid  11 and name HB2  ) 2.8 0.9 1.0
assign ( resid  12 and name HN   ) (resid  11 and name HA   ) 2.2 0.6 0.5
assign ( resid  12 and name HN   ) (resid  11 and name HN   ) 3.2 1.0 1.0
assign ( resid  12 and name HN   ) (resid  11 and name HB1  ) 2.9 0.7 0.7
assign ( resid  12 and name HN   ) (resid  11 and name HB2  ) 2.9 0.7 0.7
assign ( resid  12 and name HN   ) (resid  12 and name HA   ) 2.5 0.5 0.6
assign ( resid  12 and name HN   ) (resid  12 and name HB1  ) 2.6 0.6 0.6
assign ( resid  12 and name HN   ) (resid  12 and name HB2  ) 2.6 0.6 0.6
assign ( resid  12 and name HN   ) (resid  12 and name HG*  ) 3.3 1.1 1.1
assign ( resid  12 and name HB2  ) (resid  12 and name HB1  ) 1.8 0.1 0.1
assign ( resid  12 and name HG*  ) (resid  12 and name HD*  ) 2.0 0.5 0.5
assign ( resid  13 and name H1   ) (resid  13 and name HA   ) 3.3 0.9 1.0
assign ( resid  13 and name HN   ) (resid  12 and name HA   ) 2.3 0.5 0.5
assign ( resid  13 and name HN   ) (resid  12 and name HN   ) 2.9 0.6 0.6
assign ( resid  13 and name HN   ) (resid  13 and name HA   ) 2.6 0.5 0.5
assign ( resid  13 and name HN   ) (resid  13 and name HB1  ) 2.8 0.9 0.9
assign ( resid  13 and name HN   ) (resid  13 and name HB2  ) 2.8 0.9 0.9
assign ( resid  13 and name HN   ) (resid  13 and name HG*  ) 3.4 1.1 1.1
assign ( resid  13 and name HB2  ) (resid  13 and name HB1  ) 1.8 0.1 0.1
assign ( resid  13 and name HG*  ) (resid  13 and name HD*  ) 2.2 0.3 0.3

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ILE   1          1H        ILE   1 -18.474   2.497   2.107
    2   2H    ILE   1          2H        ILE   1 -18.512   2.690   3.795
    3   3H    ILE   1          3H        ILE   1 -17.750   1.335   3.109
    4    HA   ILE   1           HA       ILE   1 -16.813   4.077   2.500
    5    HB   ILE   1           HB       ILE   1 -15.175   3.534   4.423
    6   1HG1  ILE   1          2HG1      ILE   1 -17.448   1.667   5.175
    7   2HG1  ILE   1          1HG1      ILE   1 -15.884   1.128   4.563
    8   1HG2  ILE   1          1HG2      ILE   1 -17.872   3.835   5.622
    9   2HG2  ILE   1          2HG2      ILE   1 -17.473   4.982   4.343
   10   3HG2  ILE   1          3HG2      ILE   1 -16.450   4.867   5.775
   11   1HD1  ILE   1          1HD1      ILE   1 -16.497   1.564   7.229
   12   2HD1  ILE   1          2HD1      ILE   1 -15.640   3.036   6.772
   13   3HD1  ILE   1          3HD1      ILE   1 -14.870   1.464   6.556
   14    H    LEU   2           H        LEU   2 -14.383   3.866   2.081
   15    HA   LEU   2           HA       LEU   2 -13.702   2.226  -0.020
   16   1HB   LEU   2          2HB       LEU   2 -11.364   2.580   0.735
   17   2HB   LEU   2          1HB       LEU   2 -12.327   4.046   0.931
   18    HG   LEU   2           HG       LEU   2 -12.664   2.558   3.314
   19   1HD1  LEU   2          1HD1      LEU   2 -10.044   2.739   3.865
   20   2HD1  LEU   2          2HD1      LEU   2  -9.926   2.372   2.144
   21   3HD1  LEU   2          3HD1      LEU   2 -10.762   1.260   3.226
   22   1HD2  LEU   2          1HD2      LEU   2 -11.275   4.505   4.230
   23   2HD2  LEU   2          2HD2      LEU   2 -12.705   4.949   3.298
   24   3HD2  LEU   2          3HD2      LEU   2 -11.106   5.041   2.558
   25    HA   PRO   3           HA       PRO   3 -13.618  -1.883   1.569
   26   1HB   PRO   3          2HB       PRO   3 -12.037  -3.036  -0.343
   27   2HB   PRO   3          1HB       PRO   3 -13.727  -2.580  -0.634
   28   1HG   PRO   3          2HG       PRO   3 -11.226  -1.174  -1.416
   29   2HG   PRO   3          1HG       PRO   3 -12.748  -1.350  -2.302
   30   1HD   PRO   3          2HD       PRO   3 -12.026   0.918  -0.954
   31   2HD   PRO   3          1HD       PRO   3 -13.711   0.442  -1.262
   32    H    TRP   4           H        TRP   4 -11.592  -3.685   1.612
   33    HA   TRP   4           HA       TRP   4  -9.245  -2.256   2.816
   34   1HB   TRP   4          2HB       TRP   4  -9.789  -4.810   4.064
   35   2HB   TRP   4          1HB       TRP   4  -9.668  -3.223   4.811
   36    HD1  TRP   4           HD1      TRP   4 -12.234  -5.489   3.049
   37    HE1  TRP   4           1HE      TRP   4 -14.590  -4.845   3.876
   38    HE3  TRP   4           3HE      TRP   4 -11.079  -1.441   5.938
   39    HZ2  TRP   4           2HZ      TRP   4 -15.822  -2.872   5.543
   40    HZ3  TRP   4           3HZ      TRP   4 -12.859  -0.198   7.132
   41    HH2  TRP   4           HH2      TRP   4 -15.227  -0.907   6.939
   42    H    LYS   5           H        LYS   5  -9.164  -3.127   0.228
   43    HA   LYS   5           HA       LYS   5  -7.500  -5.610   0.385
   44   1HB   LYS   5          2HB       LYS   5  -9.809  -4.810  -1.244
   45   2HB   LYS   5          1HB       LYS   5  -8.465  -5.448  -2.188
   46   1HG   LYS   5          2HG       LYS   5  -8.733  -7.556  -1.371
   47   2HG   LYS   5          1HG       LYS   5  -9.065  -6.976   0.262
   48   1HD   LYS   5          2HD       LYS   5 -11.023  -6.938  -2.054
   49   2HD   LYS   5          1HD       LYS   5 -11.058  -8.065  -0.699
   50   1HE   LYS   5          2HE       LYS   5 -12.164  -6.559   0.580
   51   2HE   LYS   5          1HE       LYS   5 -10.923  -5.328   0.267
   52   1HZ   LYS   5          1HZ       LYS   5 -12.988  -6.099  -1.719
   53   2HZ   LYS   5          2HZ       LYS   5 -11.924  -4.776  -1.791
   54   3HZ   LYS   5          3HZ       LYS   5 -13.181  -4.798  -0.648
   55    H    TRP   6           H        TRP   6  -7.135  -2.490   0.194
   56    HA   TRP   6           HA       TRP   6  -5.801  -1.870  -2.226
   57   1HB   TRP   6          2HB       TRP   6  -6.652  -0.250  -0.649
   58   2HB   TRP   6          1HB       TRP   6  -5.603  -0.859   0.615
   59    HD1  TRP   6           HD1      TRP   6  -3.018  -0.508   0.289
   60    HE1  TRP   6           1HE      TRP   6  -1.713   1.374  -0.952
   61    HE3  TRP   6           3HE      TRP   6  -6.735   1.221  -2.569
   62    HZ2  TRP   6           2HZ      TRP   6  -2.274   3.380  -2.965
   63    HZ3  TRP   6           3HZ      TRP   6  -6.398   3.114  -4.167
   64    HH2  TRP   6           HH2      TRP   6  -4.165   4.190  -4.364
   65    HA   PRO   7           HA       PRO   7  -1.986  -3.956  -1.463
   66   1HB   PRO   7          2HB       PRO   7  -0.586  -2.925  -3.576
   67   2HB   PRO   7          1HB       PRO   7  -1.886  -4.117  -3.754
   68   1HG   PRO   7          2HG       PRO   7  -1.866  -1.280  -4.444
   69   2HG   PRO   7          1HG       PRO   7  -2.973  -2.552  -4.966
   70   1HD   PRO   7          2HD       PRO   7  -3.371  -0.548  -2.927
   71   2HD   PRO   7          1HD       PRO   7  -4.523  -1.753  -3.541
   72    H    TRP   8           H        TRP   8   0.578  -3.191  -1.892
   73    HA   TRP   8           HA       TRP   8   2.258  -2.274  -0.494
   74   1HB   TRP   8          2HB       TRP   8   1.172   0.220  -1.772
   75   2HB   TRP   8          1HB       TRP   8   2.844  -0.295  -1.580
   76    HD1  TRP   8           HD1      TRP   8  -0.035  -0.487  -3.903
   77    HE1  TRP   8           1HE      TRP   8   0.574  -1.910  -5.970
   78    HE3  TRP   8           3HE      TRP   8   4.312  -2.532  -2.267
   79    HZ2  TRP   8           2HZ      TRP   8   2.652  -3.700  -6.801
   80    HZ3  TRP   8           3HZ      TRP   8   5.598  -4.097  -3.700
   81    HH2  TRP   8           HH2      TRP   8   4.771  -4.686  -5.962
   82    H    TRP   9           H        TRP   9   1.291  -2.553   1.641
   83    HA   TRP   9           HA       TRP   9  -0.545  -1.029   2.995
   84   1HB   TRP   9          2HB       TRP   9   0.486  -2.789   4.141
   85   2HB   TRP   9          1HB       TRP   9   2.103  -2.212   3.753
   86    HD1  TRP   9           HD1      TRP   9   2.943  -0.012   5.044
   87    HE1  TRP   9           1HE      TRP   9   2.374   0.861   7.406
   88    HE3  TRP   9           3HE      TRP   9  -1.334  -2.601   5.883
   89    HZ2  TRP   9           2HZ      TRP   9   0.336   0.491   9.395
   90    HZ3  TRP   9           3HZ      TRP   9  -2.588  -2.339   8.011
   91    HH2  TRP   9           HH2      TRP   9  -1.759  -0.792   9.765
   92    HA   PRO  10           HA       PRO  10   1.196   3.027   3.081
   93   1HB   PRO  10          2HB       PRO  10  -0.698   4.154   4.702
   94   2HB   PRO  10          1HB       PRO  10  -1.014   3.698   3.017
   95   1HG   PRO  10          2HG       PRO  10  -2.008   2.487   5.466
   96   2HG   PRO  10          1HG       PRO  10  -2.555   2.259   3.801
   97   1HD   PRO  10          2HD       PRO  10  -0.819   0.570   5.401
   98   2HD   PRO  10          1HD       PRO  10  -1.561   0.225   3.826
   99    H    TRP  11           H        TRP  11   3.098   3.272   4.278
  100    HA   TRP  11           HA       TRP  11   2.963   2.990   7.229
  101   1HB   TRP  11          2HB       TRP  11   5.417   2.663   6.942
  102   2HB   TRP  11          1HB       TRP  11   4.474   1.510   6.018
  103    HD1  TRP  11           HD1      TRP  11   6.283   4.858   5.541
  104    HE1  TRP  11           1HE      TRP  11   7.064   4.989   3.072
  105    HE3  TRP  11           3HE      TRP  11   4.196   0.611   3.819
  106    HZ2  TRP  11           2HZ      TRP  11   6.801   3.430   0.658
  107    HZ3  TRP  11           3HZ      TRP  11   4.445  -0.086   1.437
  108    HH2  TRP  11           HH2      TRP  11   5.746   1.325  -0.142
  109    H    ARG  12           H        ARG  12   5.100   4.480   7.971
  110    HA   ARG  12           HA       ARG  12   4.152   7.218   7.695
  111   1HB   ARG  12          2HB       ARG  12   5.127   6.183   9.754
  112   2HB   ARG  12          1HB       ARG  12   6.683   6.085   8.929
  113   1HG   ARG  12          2HG       ARG  12   6.992   8.391   8.943
  114   2HG   ARG  12          1HG       ARG  12   5.263   8.723   9.043
  115   1HD   ARG  12          2HD       ARG  12   5.531   8.989  11.279
  116   2HD   ARG  12          1HD       ARG  12   5.897   7.255  11.378
  117    HE   ARG  12           HE       ARG  12   8.297   8.075  10.643
  118   1HH1  ARG  12          2HH1      ARG  12   7.794  10.954  10.943
  119   2HH1  ARG  12          1HH1      ARG  12   8.235  11.264  12.590
  120   1HH2  ARG  12          1HH2      ARG  12   8.119   7.926  13.526
  121   2HH2  ARG  12          2HH2      ARG  12   8.419   9.550  14.052
  122    H    ARG  13           H        ARG  13   4.711   6.498   5.125
  123    HA   ARG  13           HA       ARG  13   7.336   6.781   4.128
  124   1HB   ARG  13          2HB       ARG  13   6.191   7.361   2.045
  125   2HB   ARG  13          1HB       ARG  13   5.257   6.126   2.892
  126   1HG   ARG  13          2HG       ARG  13   3.900   8.019   3.914
  127   2HG   ARG  13          1HG       ARG  13   4.702   9.098   2.774
  128   1HD   ARG  13          2HD       ARG  13   3.819   6.885   1.244
  129   2HD   ARG  13          1HD       ARG  13   2.462   7.340   2.295
  130    HE   ARG  13           HE       ARG  13   3.561   9.751   1.340
  131   1HH1  ARG  13          1HH2      ARG  13   0.726   9.220   0.892
  132   2HH1  ARG  13          2HH2      ARG  13   0.620   8.994  -0.822
  133   1HH2  ARG  13          1HH1      ARG  13   4.023   8.460  -1.227
  134   2HH2  ARG  13          2HH1      ARG  13   2.487   8.563  -2.022
  135   1HN   NH2  14          1HT       ARG  13   5.207   9.247   5.477
  136   2HN   NH2  14          2HT       ARG  13   6.214  10.574   5.156
  Start of MODEL    2
    1   1H    ILE   1          1H        ILE   1 -20.054  -0.020   0.212
    2   2H    ILE   1          2H        ILE   1 -19.727  -0.148   1.875
    3   3H    ILE   1          3H        ILE   1 -18.740  -0.949   0.748
    4    HA   ILE   1           HA       ILE   1 -18.171   1.324  -0.174
    5    HB   ILE   1           HB       ILE   1 -19.252   2.168   2.506
    6   1HG1  ILE   1          2HG1      ILE   1 -21.107   1.215   1.151
    7   2HG1  ILE   1          1HG1      ILE   1 -21.271   2.959   1.353
    8   1HG2  ILE   1          1HG2      ILE   1 -19.390   4.349   1.008
    9   2HG2  ILE   1          2HG2      ILE   1 -18.181   3.497   0.048
   10   3HG2  ILE   1          3HG2      ILE   1 -17.863   3.862   1.743
   11   1HD1  ILE   1          1HD1      ILE   1 -19.767   1.937  -1.025
   12   2HD1  ILE   1          2HD1      ILE   1 -20.721   3.409  -0.856
   13   3HD1  ILE   1          3HD1      ILE   1 -21.528   1.852  -1.043
   14    H    LEU   2           H        LEU   2 -16.195   2.356   0.740
   15    HA   LEU   2           HA       LEU   2 -14.125   2.205   1.873
   16   1HB   LEU   2          2HB       LEU   2 -15.902   0.990   4.013
   17   2HB   LEU   2          1HB       LEU   2 -14.358   1.808   4.263
   18    HG   LEU   2           HG       LEU   2 -16.860   3.091   3.123
   19   1HD1  LEU   2          1HD1      LEU   2 -17.391   3.072   5.353
   20   2HD1  LEU   2          2HD1      LEU   2 -16.290   4.449   5.396
   21   3HD1  LEU   2          3HD1      LEU   2 -15.716   2.847   5.856
   22   1HD2  LEU   2          1HD2      LEU   2 -15.375   5.179   3.647
   23   2HD2  LEU   2          2HD2      LEU   2 -15.058   4.262   2.173
   24   3HD2  LEU   2          3HD2      LEU   2 -14.036   4.032   3.592
   25    HA   PRO   3           HA       PRO   3 -13.781  -2.247   0.786
   26   1HB   PRO   3          2HB       PRO   3 -11.583  -1.929  -0.815
   27   2HB   PRO   3          1HB       PRO   3 -13.246  -1.715  -1.402
   28   1HG   PRO   3          2HG       PRO   3 -11.235   0.334  -0.624
   29   2HG   PRO   3          1HG       PRO   3 -12.423   0.357  -1.937
   30   1HD   PRO   3          2HD       PRO   3 -12.742   1.694   0.428
   31   2HD   PRO   3          1HD       PRO   3 -14.092   1.136  -0.586
   32    H    TRP   4           H        TRP   4 -11.438  -3.486   0.775
   33    HA   TRP   4           HA       TRP   4  -9.535  -2.349   2.718
   34   1HB   TRP   4          2HB       TRP   4 -10.415  -4.964   3.649
   35   2HB   TRP   4          1HB       TRP   4 -10.270  -3.459   4.548
   36    HD1  TRP   4           HD1      TRP   4 -12.731  -5.299   2.224
   37    HE1  TRP   4           1HE      TRP   4 -15.122  -4.512   2.788
   38    HE3  TRP   4           3HE      TRP   4 -11.680  -1.682   5.671
   39    HZ2  TRP   4           2HZ      TRP   4 -16.417  -2.600   4.479
   40    HZ3  TRP   4           3HZ      TRP   4 -13.507  -0.394   6.742
   41    HH2  TRP   4           HH2      TRP   4 -15.872  -0.848   6.151
   42    H    LYS   5           H        LYS   5  -9.058  -3.061   0.124
   43    HA   LYS   5           HA       LYS   5  -7.418  -5.542   0.414
   44   1HB   LYS   5          2HB       LYS   5  -9.659  -4.898  -1.342
   45   2HB   LYS   5          1HB       LYS   5  -8.228  -5.394  -2.239
   46   1HG   LYS   5          2HG       LYS   5  -8.105  -7.481  -1.080
   47   2HG   LYS   5          1HG       LYS   5  -9.270  -6.949   0.133
   48   1HD   LYS   5          2HD       LYS   5 -11.041  -7.490  -1.170
   49   2HD   LYS   5          1HD       LYS   5 -10.304  -6.783  -2.608
   50   1HE   LYS   5          2HE       LYS   5  -9.138  -9.338  -1.562
   51   2HE   LYS   5          1HE       LYS   5 -10.676  -9.414  -2.446
   52   1HZ   LYS   5          1HZ       LYS   5  -9.234  -9.407  -4.197
   53   2HZ   LYS   5          2HZ       LYS   5  -8.043  -8.521  -3.371
   54   3HZ   LYS   5          3HZ       LYS   5  -9.411  -7.733  -3.997
   55    H    TRP   6           H        TRP   6  -7.086  -2.444   0.257
   56    HA   TRP   6           HA       TRP   6  -5.699  -1.705  -2.076
   57   1HB   TRP   6          2HB       TRP   6  -6.513  -0.172  -0.406
   58   2HB   TRP   6          1HB       TRP   6  -5.502  -0.894   0.826
   59    HD1  TRP   6           HD1      TRP   6  -2.895  -0.598   0.553
   60    HE1  TRP   6           1HE      TRP   6  -1.530   1.336  -0.530
   61    HE3  TRP   6           3HE      TRP   6  -6.529   1.432  -2.216
   62    HZ2  TRP   6           2HZ      TRP   6  -2.011   3.499  -2.396
   63    HZ3  TRP   6           3HZ      TRP   6  -6.123   3.428  -3.667
   64    HH2  TRP   6           HH2      TRP   6  -3.861   4.457  -3.756
   65    HA   PRO   7           HA       PRO   7  -1.927  -3.919  -1.429
   66   1HB   PRO   7          2HB       PRO   7  -0.548  -2.862  -3.544
   67   2HB   PRO   7          1HB       PRO   7  -1.874  -4.023  -3.728
   68   1HG   PRO   7          2HG       PRO   7  -1.810  -1.174  -4.356
   69   2HG   PRO   7          1HG       PRO   7  -2.961  -2.409  -4.874
   70   1HD   PRO   7          2HD       PRO   7  -3.243  -0.440  -2.772
   71   2HD   PRO   7          1HD       PRO   7  -4.452  -1.582  -3.399
   72    H    TRP   8           H        TRP   8   0.644  -3.173  -1.889
   73    HA   TRP   8           HA       TRP   8   2.360  -2.304  -0.512
   74   1HB   TRP   8          2HB       TRP   8   1.240   0.205  -1.738
   75   2HB   TRP   8          1HB       TRP   8   2.921  -0.278  -1.544
   76    HD1  TRP   8           HD1      TRP   8   0.087  -0.464  -3.908
   77    HE1  TRP   8           1HE      TRP   8   0.723  -1.880  -5.969
   78    HE3  TRP   8           3HE      TRP   8   4.391  -2.545  -2.204
   79    HZ2  TRP   8           2HZ      TRP   8   2.807  -3.678  -6.773
   80    HZ3  TRP   8           3HZ      TRP   8   5.693  -4.111  -3.620
   81    HH2  TRP   8           HH2      TRP   8   4.902  -4.684  -5.901
   82    H    TRP   9           H        TRP   9   1.535  -2.594   1.641
   83    HA   TRP   9           HA       TRP   9  -0.277  -1.200   3.134
   84   1HB   TRP   9          2HB       TRP   9   0.967  -2.871   4.197
   85   2HB   TRP   9          1HB       TRP   9   2.502  -2.175   3.692
   86    HD1  TRP   9           HD1      TRP   9   3.256   0.100   4.919
   87    HE1  TRP   9           1HE      TRP   9   2.806   0.925   7.322
   88    HE3  TRP   9           3HE      TRP   9  -0.710  -2.839   6.080
   89    HZ2  TRP   9           2HZ      TRP   9   0.972   0.385   9.466
   90    HZ3  TRP   9           3HZ      TRP   9  -1.806  -2.680   8.303
   91    HH2  TRP   9           HH2      TRP   9  -0.971  -1.068   9.994
   92    HA   PRO  10           HA       PRO  10   1.132   2.980   3.112
   93   1HB   PRO  10          2HB       PRO  10  -0.714   3.952   4.882
   94   2HB   PRO  10          1HB       PRO  10  -1.123   3.469   3.226
   95   1HG   PRO  10          2HG       PRO  10  -1.819   2.184   5.739
   96   2HG   PRO  10          1HG       PRO  10  -2.475   1.910   4.120
   97   1HD   PRO  10          2HD       PRO  10  -0.488   0.371   5.571
   98   2HD   PRO  10          1HD       PRO  10  -1.319  -0.035   4.057
   99    H    TRP  11           H        TRP  11   3.110   3.339   4.147
  100    HA   TRP  11           HA       TRP  11   3.228   3.101   7.103
  101   1HB   TRP  11          2HB       TRP  11   5.664   2.933   6.631
  102   2HB   TRP  11          1HB       TRP  11   4.740   1.715   5.776
  103    HD1  TRP  11           HD1      TRP  11   6.255   5.188   5.165
  104    HE1  TRP  11           1HE      TRP  11   6.854   5.351   2.647
  105    HE3  TRP  11           3HE      TRP  11   4.390   0.776   3.613
  106    HZ2  TRP  11           2HZ      TRP  11   6.548   3.750   0.265
  107    HZ3  TRP  11           3HZ      TRP  11   4.530   0.073   1.223
  108    HH2  TRP  11           HH2      TRP  11   5.606   1.562  -0.449
  109    H    ARG  12           H        ARG  12   5.323   4.751   7.637
  110    HA   ARG  12           HA       ARG  12   4.157   7.408   7.436
  111   1HB   ARG  12          2HB       ARG  12   5.542   6.289   9.319
  112   2HB   ARG  12          1HB       ARG  12   6.951   6.698   8.340
  113   1HG   ARG  12          2HG       ARG  12   6.557   9.016   8.526
  114   2HG   ARG  12          1HG       ARG  12   4.880   8.780   9.022
  115   1HD   ARG  12          2HD       ARG  12   5.741   9.140  11.126
  116   2HD   ARG  12          1HD       ARG  12   6.201   7.429  11.007
  117    HE   ARG  12           HE       ARG  12   8.013   9.735  10.532
  118   1HH1  ARG  12          2HH1      ARG  12   7.732   6.713  11.886
  119   2HH1  ARG  12          1HH1      ARG  12   9.245   6.100  11.305
  120   1HH2  ARG  12          1HH2      ARG  12   9.834   8.797   9.209
  121   2HH2  ARG  12          2HH2      ARG  12  10.434   7.280   9.789
  122    H    ARG  13           H        ARG  13   4.504   6.681   4.823
  123    HA   ARG  13           HA       ARG  13   7.017   7.198   3.600
  124   1HB   ARG  13          2HB       ARG  13   4.914   6.208   2.607
  125   2HB   ARG  13          1HB       ARG  13   4.243   7.839   2.547
  126   1HG   ARG  13          2HG       ARG  13   6.951   7.525   1.381
  127   2HG   ARG  13          1HG       ARG  13   5.644   6.732   0.502
  128   1HD   ARG  13          2HD       ARG  13   4.387   9.012   0.788
  129   2HD   ARG  13          1HD       ARG  13   6.012   9.665   1.084
  130    HE   ARG  13           HE       ARG  13   5.754   7.913  -1.275
  131   1HH1  ARG  13          1HH2      ARG  13   5.058  11.077  -0.222
  132   2HH1  ARG  13          2HH2      ARG  13   5.796  11.855  -1.583
  133   1HH2  ARG  13          1HH1      ARG  13   7.044   8.911  -2.928
  134   2HH2  ARG  13          2HH1      ARG  13   6.920  10.630  -3.115
  135   1HN   NH2  14          1HT       ARG  13   7.663   9.236   2.409
  136   2HN   NH2  14          2HT       ARG  13   7.198  10.747   3.026
  Start of MODEL    3
    1   1H    ILE   1          1H        ILE   1 -18.624   1.966   2.557
    2   2H    ILE   1          2H        ILE   1 -18.102   0.734   1.510
    3   3H    ILE   1          3H        ILE   1 -19.104   1.978   0.930
    4    HA   ILE   1           HA       ILE   1 -16.887   2.443   0.189
    5    HB   ILE   1           HB       ILE   1 -16.712   4.659   1.237
    6   1HG1  ILE   1          2HG1      ILE   1 -18.820   3.926   3.236
    7   2HG1  ILE   1          1HG1      ILE   1 -17.147   3.485   3.584
    8   1HG2  ILE   1          1HG2      ILE   1 -18.736   3.911  -0.234
    9   2HG2  ILE   1          2HG2      ILE   1 -18.851   5.433   0.650
   10   3HG2  ILE   1          3HG2      ILE   1 -19.648   3.989   1.274
   11   1HD1  ILE   1          1HD1      ILE   1 -17.782   6.272   2.662
   12   2HD1  ILE   1          2HD1      ILE   1 -16.434   5.707   3.649
   13   3HD1  ILE   1          3HD1      ILE   1 -18.047   5.832   4.349
   14    H    LEU   2           H        LEU   2 -14.671   3.235   1.043
   15    HA   LEU   2           HA       LEU   2 -12.698   2.782   2.263
   16   1HB   LEU   2          2HB       LEU   2 -14.637   1.992   4.453
   17   2HB   LEU   2          1HB       LEU   2 -13.013   2.654   4.642
   18    HG   LEU   2           HG       LEU   2 -15.276   4.153   3.299
   19   1HD1  LEU   2          1HD1      LEU   2 -14.874   3.593   6.078
   20   2HD1  LEU   2          2HD1      LEU   2 -16.092   4.633   5.339
   21   3HD1  LEU   2          3HD1      LEU   2 -14.524   5.299   5.801
   22   1HD2  LEU   2          1HD2      LEU   2 -13.678   5.664   2.806
   23   2HD2  LEU   2          2HD2      LEU   2 -12.467   4.546   3.435
   24   3HD2  LEU   2          3HD2      LEU   2 -13.196   5.745   4.500
   25    HA   PRO   3           HA       PRO   3 -13.430  -1.740   1.484
   26   1HB   PRO   3          2HB       PRO   3 -11.567  -1.981  -0.505
   27   2HB   PRO   3          1HB       PRO   3 -13.251  -1.513  -0.813
   28   1HG   PRO   3          2HG       PRO   3 -10.814   0.185  -0.652
   29   2HG   PRO   3          1HG       PRO   3 -12.212   0.313  -1.732
   30   1HD   PRO   3          2HD       PRO   3 -11.844   1.892   0.468
   31   2HD   PRO   3          1HD       PRO   3 -13.438   1.501  -0.213
   32    H    TRP   4           H        TRP   4 -11.372  -3.393   1.216
   33    HA   TRP   4           HA       TRP   4  -9.061  -2.416   2.820
   34   1HB   TRP   4          2HB       TRP   4 -10.086  -5.018   3.713
   35   2HB   TRP   4          1HB       TRP   4  -9.582  -3.632   4.670
   36    HD1  TRP   4           HD1      TRP   4 -12.616  -4.864   2.637
   37    HE1  TRP   4           1HE      TRP   4 -14.749  -3.827   3.656
   38    HE3  TRP   4           3HE      TRP   4 -10.520  -1.847   6.182
   39    HZ2  TRP   4           2HZ      TRP   4 -15.467  -1.962   5.706
   40    HZ3  TRP   4           3HZ      TRP   4 -11.948  -0.452   7.653
   41    HH2  TRP   4           HH2      TRP   4 -14.416  -0.507   7.419
   42    H    LYS   5           H        LYS   5  -9.023  -3.053   0.140
   43    HA   LYS   5           HA       LYS   5  -7.566  -5.662   0.118
   44   1HB   LYS   5          2HB       LYS   5  -9.854  -4.635  -1.410
   45   2HB   LYS   5          1HB       LYS   5  -8.579  -5.315  -2.417
   46   1HG   LYS   5          2HG       LYS   5  -8.677  -7.423  -1.267
   47   2HG   LYS   5          1HG       LYS   5  -9.714  -6.751  -0.007
   48   1HD   LYS   5          2HD       LYS   5 -11.389  -7.657  -1.264
   49   2HD   LYS   5          1HD       LYS   5 -11.197  -6.182  -2.215
   50   1HE   LYS   5          2HE       LYS   5 -10.686  -7.483  -4.000
   51   2HE   LYS   5          1HE       LYS   5  -9.216  -7.992  -3.147
   52   1HZ   LYS   5          1HZ       LYS   5 -10.562  -9.919  -3.598
   53   2HZ   LYS   5          2HZ       LYS   5 -11.922  -9.193  -2.883
   54   3HZ   LYS   5          3HZ       LYS   5 -10.582  -9.619  -1.929
   55    H    TRP   6           H        TRP   6  -7.061  -2.535   0.026
   56    HA   TRP   6           HA       TRP   6  -5.668  -1.987  -2.402
   57   1HB   TRP   6          2HB       TRP   6  -6.568  -0.312  -0.904
   58   2HB   TRP   6          1HB       TRP   6  -5.561  -0.881   0.408
   59    HD1  TRP   6           HD1      TRP   6  -2.967  -0.538   0.159
   60    HE1  TRP   6           1HE      TRP   6  -1.620   1.291  -1.115
   61    HE3  TRP   6           3HE      TRP   6  -6.587   1.075  -2.887
   62    HZ2  TRP   6           2HZ      TRP   6  -2.111   3.216  -3.224
   63    HZ3  TRP   6           3HZ      TRP   6  -6.196   2.902  -4.549
   64    HH2  TRP   6           HH2      TRP   6  -3.956   3.968  -4.717
   65    HA   PRO   7           HA       PRO   7  -1.904  -4.070  -1.420
   66   1HB   PRO   7          2HB       PRO   7  -0.411  -3.112  -3.505
   67   2HB   PRO   7          1HB       PRO   7  -1.709  -4.303  -3.700
   68   1HG   PRO   7          2HG       PRO   7  -1.644  -1.486  -4.473
   69   2HG   PRO   7          1HG       PRO   7  -2.734  -2.769  -5.005
   70   1HD   PRO   7          2HD       PRO   7  -3.211  -0.703  -3.048
   71   2HD   PRO   7          1HD       PRO   7  -4.339  -1.927  -3.669
   72    H    TRP   8           H        TRP   8   0.681  -3.334  -1.767
   73    HA   TRP   8           HA       TRP   8   2.308  -2.380  -0.329
   74   1HB   TRP   8          2HB       TRP   8   1.291   0.078  -1.728
   75   2HB   TRP   8          1HB       TRP   8   2.950  -0.436  -1.448
   76    HD1  TRP   8           HD1      TRP   8   0.172  -0.692  -3.887
   77    HE1  TRP   8           1HE      TRP   8   0.861  -2.181  -5.879
   78    HE3  TRP   8           3HE      TRP   8   4.435  -2.699  -2.002
   79    HZ2  TRP   8           2HZ      TRP   8   2.967  -4.002  -6.565
   80    HZ3  TRP   8           3HZ      TRP   8   5.774  -4.313  -3.326
   81    HH2  TRP   8           HH2      TRP   8   5.042  -4.970  -5.604
   82    H    TRP   9           H        TRP   9   1.248  -2.590   1.771
   83    HA   TRP   9           HA       TRP   9  -0.636  -1.018   3.000
   84   1HB   TRP   9          2HB       TRP   9   0.344  -2.751   4.235
   85   2HB   TRP   9          1HB       TRP   9   1.977  -2.181   3.907
   86    HD1  TRP   9           HD1      TRP   9   2.755   0.048   5.183
   87    HE1  TRP   9           1HE      TRP   9   2.075   0.983   7.486
   88    HE3  TRP   9           3HE      TRP   9  -1.562  -2.514   5.878
   89    HZ2  TRP   9           2HZ      TRP   9  -0.060   0.667   9.385
   90    HZ3  TRP   9           3HZ      TRP   9  -2.919  -2.196   7.933
   91    HH2  TRP   9           HH2      TRP   9  -2.173  -0.604   9.685
   92    HA   PRO  10           HA       PRO  10   1.117   3.031   3.027
   93   1HB   PRO  10          2HB       PRO  10  -0.831   4.217   4.538
   94   2HB   PRO  10          1HB       PRO  10  -1.085   3.707   2.859
   95   1HG   PRO  10          2HG       PRO  10  -2.175   2.578   5.308
   96   2HG   PRO  10          1HG       PRO  10  -2.660   2.302   3.632
   97   1HD   PRO  10          2HD       PRO  10  -0.998   0.653   5.343
   98   2HD   PRO  10          1HD       PRO  10  -1.678   0.267   3.750
   99    H    TRP  11           H        TRP  11   2.992   3.232   4.278
  100    HA   TRP  11           HA       TRP  11   2.748   3.109   7.234
  101   1HB   TRP  11          2HB       TRP  11   5.204   2.726   7.046
  102   2HB   TRP  11          1HB       TRP  11   4.270   1.548   6.144
  103    HD1  TRP  11           HD1      TRP  11   6.140   4.850   5.565
  104    HE1  TRP  11           1HE      TRP  11   7.014   4.840   3.123
  105    HE3  TRP  11           3HE      TRP  11   4.073   0.535   3.996
  106    HZ2  TRP  11           2HZ      TRP  11   6.823   3.156   0.787
  107    HZ3  TRP  11           3HZ      TRP  11   4.402  -0.292   1.665
  108    HH2  TRP  11           HH2      TRP  11   5.775   1.020   0.063
  109    H    ARG  12           H        ARG  12   4.916   4.597   7.950
  110    HA   ARG  12           HA       ARG  12   4.013   7.329   7.583
  111   1HB   ARG  12          2HB       ARG  12   5.053   6.309   9.640
  112   2HB   ARG  12          1HB       ARG  12   6.589   6.255   8.772
  113   1HG   ARG  12          2HG       ARG  12   6.260   8.768   8.361
  114   2HG   ARG  12          1HG       ARG  12   4.997   8.689   9.589
  115   1HD   ARG  12          2HD       ARG  12   7.434   7.336  10.468
  116   2HD   ARG  12          1HD       ARG  12   7.713   9.049  10.098
  117    HE   ARG  12           HE       ARG  12   5.493   8.137  11.891
  118   1HH1  ARG  12          1HH2      ARG  12   8.422   9.201  12.576
  119   2HH1  ARG  12          2HH2      ARG  12   7.995  10.768  13.176
  120   1HH2  ARG  12          2HH1      ARG  12   4.747  10.637  11.969
  121   2HH2  ARG  12          1HH1      ARG  12   5.914  11.581  12.832
  122    H    ARG  13           H        ARG  13   4.485   6.531   5.026
  123    HA   ARG  13           HA       ARG  13   7.126   6.812   3.995
  124   1HB   ARG  13          2HB       ARG  13   5.321   5.885   2.691
  125   2HB   ARG  13          1HB       ARG  13   4.359   7.353   2.881
  126   1HG   ARG  13          2HG       ARG  13   6.969   7.959   1.759
  127   2HG   ARG  13          1HG       ARG  13   6.117   6.768   0.774
  128   1HD   ARG  13          2HD       ARG  13   4.459   9.043   1.724
  129   2HD   ARG  13          1HD       ARG  13   5.702   9.440   0.521
  130    HE   ARG  13           HE       ARG  13   4.632   7.959  -1.034
  131   1HH1  ARG  13          1HH2      ARG  13   3.944   5.657   0.634
  132   2HH1  ARG  13          2HH2      ARG  13   2.223   5.774   0.794
  133   1HH2  ARG  13          1HH1      ARG  13   2.091   9.094  -0.196
  134   2HH2  ARG  13          2HH1      ARG  13   1.175   7.720   0.323
  135   1HN   NH2  14          1HT       ARG  13   8.046   8.714   5.183
  136   2HN   NH2  14          2HT       ARG  13   7.625  10.293   4.723
  Start of MODEL    4
    1   1H    ILE   1          1H        ILE   1 -18.975  -1.278   1.903
    2   2H    ILE   1          2H        ILE   1 -19.768   0.050   1.200
    3   3H    ILE   1          3H        ILE   1 -20.319  -0.592   2.674
    4    HA   ILE   1           HA       ILE   1 -18.969   1.544   2.812
    5    HB   ILE   1           HB       ILE   1 -17.738   0.468   4.813
    6   1HG1  ILE   1          2HG1      ILE   1 -19.295  -1.951   3.849
    7   2HG1  ILE   1          1HG1      ILE   1 -17.548  -1.772   3.679
    8   1HG2  ILE   1          1HG2      ILE   1 -20.207   1.363   4.616
    9   2HG2  ILE   1          2HG2      ILE   1 -19.726   0.435   6.037
   10   3HG2  ILE   1          3HG2      ILE   1 -20.629  -0.345   4.737
   11   1HD1  ILE   1          1HD1      ILE   1 -17.348  -2.641   5.749
   12   2HD1  ILE   1          2HD1      ILE   1 -19.090  -2.555   6.014
   13   3HD1  ILE   1          3HD1      ILE   1 -18.073  -1.156   6.364
   14    H    LEU   2           H        LEU   2 -16.605   2.091   3.287
   15    HA   LEU   2           HA       LEU   2 -14.909   1.899   1.129
   16   1HB   LEU   2          2HB       LEU   2 -13.132   2.414   2.727
   17   2HB   LEU   2          1HB       LEU   2 -14.615   3.222   3.238
   18    HG   LEU   2           HG       LEU   2 -14.859   0.791   4.485
   19   1HD1  LEU   2          1HD1      LEU   2 -12.253   1.151   5.516
   20   2HD1  LEU   2          2HD1      LEU   2 -12.081   1.120   3.760
   21   3HD1  LEU   2          3HD1      LEU   2 -12.854  -0.228   4.593
   22   1HD2  LEU   2          1HD2      LEU   2 -13.788   2.159   6.477
   23   2HD2  LEU   2          2HD2      LEU   2 -15.310   2.690   5.762
   24   3HD2  LEU   2          3HD2      LEU   2 -13.799   3.479   5.307
   25    HA   PRO   3           HA       PRO   3 -13.797  -2.370   0.897
   26   1HB   PRO   3          2HB       PRO   3 -11.660  -2.108  -0.793
   27   2HB   PRO   3          1HB       PRO   3 -13.343  -1.976  -1.338
   28   1HG   PRO   3          2HG       PRO   3 -11.365   0.171  -0.767
   29   2HG   PRO   3          1HG       PRO   3 -12.595   0.075  -2.037
   30   1HD   PRO   3          2HD       PRO   3 -12.874   1.561   0.241
   31   2HD   PRO   3          1HD       PRO   3 -14.240   0.903  -0.686
   32    H    TRP   4           H        TRP   4 -11.310  -3.458   0.780
   33    HA   TRP   4           HA       TRP   4  -9.429  -2.176   2.618
   34   1HB   TRP   4          2HB       TRP   4 -11.300  -2.983   4.067
   35   2HB   TRP   4          1HB       TRP   4 -11.006  -4.619   3.478
   36    HD1  TRP   4           HD1      TRP   4  -8.963  -5.925   4.424
   37    HE1  TRP   4           1HE      TRP   4  -7.282  -5.459   6.323
   38    HE3  TRP   4           3HE      TRP   4  -9.982  -1.001   5.317
   39    HZ2  TRP   4           2HZ      TRP   4  -6.476  -3.286   7.998
   40    HZ3  TRP   4           3HZ      TRP   4  -8.745   0.242   7.068
   41    HH2  TRP   4           HH2      TRP   4  -6.995  -0.893   8.409
   42    H    LYS   5           H        LYS   5  -9.161  -3.199   0.027
   43    HA   LYS   5           HA       LYS   5  -7.421  -5.587   0.484
   44   1HB   LYS   5          2HB       LYS   5  -9.657  -5.029  -1.328
   45   2HB   LYS   5          1HB       LYS   5  -8.230  -5.658  -2.150
   46   1HG   LYS   5          2HG       LYS   5  -8.673  -7.722  -1.381
   47   2HG   LYS   5          1HG       LYS   5  -8.606  -7.126   0.278
   48   1HD   LYS   5          2HD       LYS   5 -10.800  -7.818   0.258
   49   2HD   LYS   5          1HD       LYS   5 -11.030  -6.191  -0.385
   50   1HE   LYS   5          2HE       LYS   5 -10.331  -8.070  -2.505
   51   2HE   LYS   5          1HE       LYS   5 -11.804  -8.565  -1.647
   52   1HZ   LYS   5          1HZ       LYS   5 -11.402  -5.729  -2.312
   53   2HZ   LYS   5          2HZ       LYS   5 -12.852  -6.589  -2.100
   54   3HZ   LYS   5          3HZ       LYS   5 -11.945  -6.784  -3.524
   55    H    TRP   6           H        TRP   6  -7.143  -2.489   0.094
   56    HA   TRP   6           HA       TRP   6  -5.736  -1.931  -2.283
   57   1HB   TRP   6          2HB       TRP   6  -6.617  -0.273  -0.767
   58   2HB   TRP   6          1HB       TRP   6  -5.603  -0.854   0.536
   59    HD1  TRP   6           HD1      TRP   6  -3.006  -0.521   0.265
   60    HE1  TRP   6           1HE      TRP   6  -1.667   1.334  -0.980
   61    HE3  TRP   6           3HE      TRP   6  -6.649   1.164  -2.714
   62    HZ2  TRP   6           2HZ      TRP   6  -2.173   3.306  -3.043
   63    HZ3  TRP   6           3HZ      TRP   6  -6.269   3.027  -4.339
   64    HH2  TRP   6           HH2      TRP   6  -4.029   4.093  -4.501
   65    HA   PRO   7           HA       PRO   7  -1.933  -3.993  -1.395
   66   1HB   PRO   7          2HB       PRO   7  -0.500  -3.025  -3.514
   67   2HB   PRO   7          1HB       PRO   7  -1.798  -4.220  -3.678
   68   1HG   PRO   7          2HG       PRO   7  -1.763  -1.403  -4.449
   69   2HG   PRO   7          1HG       PRO   7  -2.862  -2.688  -4.954
   70   1HD   PRO   7          2HD       PRO   7  -3.288  -0.626  -2.978
   71   2HD   PRO   7          1HD       PRO   7  -4.433  -1.845  -3.577
   72    H    TRP   8           H        TRP   8   0.635  -3.244  -1.804
   73    HA   TRP   8           HA       TRP   8   2.295  -2.282  -0.416
   74   1HB   TRP   8          2HB       TRP   8   1.213   0.148  -1.821
   75   2HB   TRP   8          1HB       TRP   8   2.887  -0.323  -1.550
   76    HD1  TRP   8           HD1      TRP   8   0.115  -0.654  -3.975
   77    HE1  TRP   8           1HE      TRP   8   0.811  -2.177  -5.938
   78    HE3  TRP   8           3HE      TRP   8   4.384  -2.610  -2.050
   79    HZ2  TRP   8           2HZ      TRP   8   2.922  -4.005  -6.587
   80    HZ3  TRP   8           3HZ      TRP   8   5.729  -4.245  -3.343
   81    HH2  TRP   8           HH2      TRP   8   5.000  -4.948  -5.608
   82    H    TRP   9           H        TRP   9   1.306  -2.479   1.717
   83    HA   TRP   9           HA       TRP   9  -0.538  -0.835   2.956
   84   1HB   TRP   9          2HB       TRP   9   0.325  -2.637   4.171
   85   2HB   TRP   9          1HB       TRP   9   1.991  -2.175   3.843
   86    HD1  TRP   9           HD1      TRP   9   2.921  -0.011   5.137
   87    HE1  TRP   9           1HE      TRP   9   2.314   0.939   7.458
   88    HE3  TRP   9           3HE      TRP   9  -1.549  -2.300   5.832
   89    HZ2  TRP   9           2HZ      TRP   9   0.176   0.740   9.364
   90    HZ3  TRP   9           3HZ      TRP   9  -2.869  -1.918   7.901
   91    HH2  TRP   9           HH2      TRP   9  -2.012  -0.397   9.665
   92    HA   PRO  10           HA       PRO  10   1.467   3.099   3.058
   93   1HB   PRO  10          2HB       PRO  10  -0.417   4.378   4.575
   94   2HB   PRO  10          1HB       PRO  10  -0.689   3.914   2.886
   95   1HG   PRO  10          2HG       PRO  10  -1.868   2.815   5.305
   96   2HG   PRO  10          1HG       PRO  10  -2.355   2.594   3.621
   97   1HD   PRO  10          2HD       PRO  10  -0.807   0.824   5.324
   98   2HD   PRO  10          1HD       PRO  10  -1.502   0.499   3.724
   99    H    TRP  11           H        TRP  11   3.335   3.200   4.337
  100    HA   TRP  11           HA       TRP  11   3.052   2.981   7.281
  101   1HB   TRP  11          2HB       TRP  11   5.505   2.538   7.097
  102   2HB   TRP  11          1HB       TRP  11   4.536   1.411   6.169
  103    HD1  TRP  11           HD1      TRP  11   6.514   4.657   5.669
  104    HE1  TRP  11           1HE      TRP  11   7.388   4.682   3.227
  105    HE3  TRP  11           3HE      TRP  11   4.298   0.460   3.986
  106    HZ2  TRP  11           2HZ      TRP  11   7.139   3.068   0.849
  107    HZ3  TRP  11           3HZ      TRP  11   4.600  -0.314   1.634
  108    HH2  TRP  11           HH2      TRP  11   6.017   0.991   0.067
  109    H    ARG  12           H        ARG  12   5.208   4.366   8.123
  110    HA   ARG  12           HA       ARG  12   5.680   6.587   8.809
  111   1HB   ARG  12          2HB       ARG  12   7.235   6.007   7.013
  112   2HB   ARG  12          1HB       ARG  12   6.058   6.523   5.807
  113   1HG   ARG  12          2HG       ARG  12   6.150   8.753   7.318
  114   2HG   ARG  12          1HG       ARG  12   7.786   8.152   7.585
  115   1HD   ARG  12          2HD       ARG  12   7.850   9.598   5.631
  116   2HD   ARG  12          1HD       ARG  12   7.995   7.928   5.050
  117    HE   ARG  12           HE       ARG  12   5.438   8.045   4.758
  118   1HH1  ARG  12          2HH1      ARG  12   6.929   9.444   2.559
  119   2HH1  ARG  12          1HH1      ARG  12   6.129  10.979   2.501
  120   1HH2  ARG  12          1HH2      ARG  12   4.637  10.616   5.610
  121   2HH2  ARG  12          2HH2      ARG  12   4.831  11.642   4.229
  122    H    ARG  13           H        ARG  13   3.238   6.938   9.239
  123    HA   ARG  13           HA       ARG  13   2.306   9.206   7.528
  124   1HB   ARG  13          2HB       ARG  13   1.207   6.547   7.776
  125   2HB   ARG  13          1HB       ARG  13   0.046   7.724   8.388
  126   1HG   ARG  13          2HG       ARG  13  -0.368   8.547   6.322
  127   2HG   ARG  13          1HG       ARG  13   1.348   8.601   5.915
  128   1HD   ARG  13          2HD       ARG  13   1.341   6.464   5.009
  129   2HD   ARG  13          1HD       ARG  13   0.018   5.915   6.057
  130    HE   ARG  13           HE       ARG  13  -1.514   6.768   4.469
  131   1HH1  ARG  13          1HH1      ARG  13  -0.384   9.567   4.512
  132   2HH1  ARG  13          2HH1      ARG  13   0.100   9.775   2.862
  133   1HH2  ARG  13          1HH2      ARG  13  -0.021   6.389   2.124
  134   2HH2  ARG  13          2HH2      ARG  13   0.305   7.975   1.510
  135   1HN   NH2  14          1HT       ARG  13   0.560  10.507   8.753
  136   2HN   NH2  14          2HT       ARG  13   0.660  10.579  10.447
  Start of MODEL    5
    1   1H    ILE   1          1H        ILE   1 -18.410  -0.755   0.724
    2   2H    ILE   1          2H        ILE   1 -18.925   0.720   0.055
    3   3H    ILE   1          3H        ILE   1 -19.918  -0.110   1.156
    4    HA   ILE   1           HA       ILE   1 -18.627   1.886   2.052
    5    HB   ILE   1           HB       ILE   1 -18.139   0.432   4.134
    6   1HG1  ILE   1          2HG1      ILE   1 -19.370  -1.676   2.329
    7   2HG1  ILE   1          1HG1      ILE   1 -17.668  -1.633   2.793
    8   1HG2  ILE   1          1HG2      ILE   1 -20.286   0.918   4.603
    9   2HG2  ILE   1          2HG2      ILE   1 -20.845  -0.352   3.515
   10   3HG2  ILE   1          3HG2      ILE   1 -20.545   1.270   2.894
   11   1HD1  ILE   1          1HD1      ILE   1 -18.585  -1.542   5.233
   12   2HD1  ILE   1          2HD1      ILE   1 -18.594  -3.089   4.385
   13   3HD1  ILE   1          3HD1      ILE   1 -20.079  -2.146   4.519
   14    H    LEU   2           H        LEU   2 -16.538   2.278   3.212
   15    HA   LEU   2           HA       LEU   2 -14.240   2.150   1.702
   16   1HB   LEU   2          2HB       LEU   2 -13.058   2.431   3.839
   17   2HB   LEU   2          1HB       LEU   2 -14.579   3.321   3.877
   18    HG   LEU   2           HG       LEU   2 -15.311   0.804   4.779
   19   1HD1  LEU   2          1HD1      LEU   2 -12.534   0.881   4.992
   20   2HD1  LEU   2          2HD1      LEU   2 -13.611  -0.200   5.877
   21   3HD1  LEU   2          3HD1      LEU   2 -13.092   1.318   6.608
   22   1HD2  LEU   2          1HD2      LEU   2 -14.444   3.220   6.403
   23   2HD2  LEU   2          2HD2      LEU   2 -15.501   1.926   6.969
   24   3HD2  LEU   2          3HD2      LEU   2 -16.033   2.997   5.672
   25    HA   PRO   3           HA       PRO   3 -13.814  -2.357   1.669
   26   1HB   PRO   3          2HB       PRO   3 -12.173  -2.406  -0.522
   27   2HB   PRO   3          1HB       PRO   3 -13.940  -2.288  -0.641
   28   1HG   PRO   3          2HG       PRO   3 -11.880  -0.153  -0.876
   29   2HG   PRO   3          1HG       PRO   3 -13.381  -0.381  -1.790
   30   1HD   PRO   3          2HD       PRO   3 -13.117   1.416   0.245
   31   2HD   PRO   3          1HD       PRO   3 -14.659   0.655  -0.199
   32    H    TRP   4           H        TRP   4 -11.567  -3.649   1.338
   33    HA   TRP   4           HA       TRP   4  -9.273  -2.135   2.447
   34   1HB   TRP   4          2HB       TRP   4  -9.125  -4.082   4.173
   35   2HB   TRP   4          1HB       TRP   4 -10.243  -2.753   4.469
   36    HD1  TRP   4           HD1      TRP   4 -10.115  -6.439   3.731
   37    HE1  TRP   4           1HE      TRP   4 -12.510  -7.407   3.793
   38    HE3  TRP   4           3HE      TRP   4 -12.775  -2.113   3.957
   39    HZ2  TRP   4           2HZ      TRP   4 -15.213  -6.447   3.918
   40    HZ3  TRP   4           3HZ      TRP   4 -15.257  -2.151   4.046
   41    HH2  TRP   4           HH2      TRP   4 -16.476  -4.311   4.024
   42    H    LYS   5           H        LYS   5  -9.063  -2.986   0.001
   43    HA   LYS   5           HA       LYS   5  -7.561  -5.568   0.149
   44   1HB   LYS   5          2HB       LYS   5  -9.830  -4.696  -1.471
   45   2HB   LYS   5          1HB       LYS   5  -8.491  -5.283  -2.457
   46   1HG   LYS   5          2HG       LYS   5  -9.895  -6.761  -0.216
   47   2HG   LYS   5          1HG       LYS   5  -9.897  -7.179  -1.929
   48   1HD   LYS   5          2HD       LYS   5  -7.178  -6.948  -1.051
   49   2HD   LYS   5          1HD       LYS   5  -8.041  -8.005   0.067
   50   1HE   LYS   5          2HE       LYS   5  -9.003  -8.941  -2.303
   51   2HE   LYS   5          1HE       LYS   5  -7.372  -8.438  -2.791
   52   1HZ   LYS   5          1HZ       LYS   5  -8.082 -10.193  -0.502
   53   2HZ   LYS   5          2HZ       LYS   5  -6.520  -9.591  -0.794
   54   3HZ   LYS   5          3HZ       LYS   5  -7.247 -10.649  -1.907
   55    H    TRP   6           H        TRP   6  -7.054  -2.463  -0.015
   56    HA   TRP   6           HA       TRP   6  -5.607  -1.958  -2.418
   57   1HB   TRP   6          2HB       TRP   6  -6.521  -0.256  -0.958
   58   2HB   TRP   6          1HB       TRP   6  -5.537  -0.813   0.378
   59    HD1  TRP   6           HD1      TRP   6  -2.939  -0.495   0.163
   60    HE1  TRP   6           1HE      TRP   6  -1.556   1.304  -1.116
   61    HE3  TRP   6           3HE      TRP   6  -6.494   1.100  -2.964
   62    HZ2  TRP   6           2HZ      TRP   6  -1.996   3.198  -3.264
   63    HZ3  TRP   6           3HZ      TRP   6  -6.062   2.897  -4.649
   64    HH2  TRP   6           HH2      TRP   6  -3.810   3.941  -4.797
   65    HA   PRO   7           HA       PRO   7  -1.882  -4.062  -1.334
   66   1HB   PRO   7          2HB       PRO   7  -0.349  -3.165  -3.417
   67   2HB   PRO   7          1HB       PRO   7  -1.659  -4.344  -3.605
   68   1HG   PRO   7          2HG       PRO   7  -1.548  -1.545  -4.435
   69   2HG   PRO   7          1HG       PRO   7  -2.644  -2.827  -4.958
   70   1HD   PRO   7          2HD       PRO   7  -3.128  -0.715  -3.051
   71   2HD   PRO   7          1HD       PRO   7  -4.261  -1.938  -3.665
   72    H    TRP   8           H        TRP   8   0.710  -3.367  -1.656
   73    HA   TRP   8           HA       TRP   8   2.330  -2.406  -0.221
   74   1HB   TRP   8          2HB       TRP   8   1.368   0.029  -1.699
   75   2HB   TRP   8          1HB       TRP   8   3.016  -0.496  -1.373
   76    HD1  TRP   8           HD1      TRP   8   0.290  -0.780  -3.862
   77    HE1  TRP   8           1HE      TRP   8   0.996  -2.338  -5.794
   78    HE3  TRP   8           3HE      TRP   8   4.474  -2.805  -1.825
   79    HZ2  TRP   8           2HZ      TRP   8   3.082  -4.213  -6.380
   80    HZ3  TRP   8           3HZ      TRP   8   5.812  -4.479  -3.073
   81    HH2  TRP   8           HH2      TRP   8   5.119  -5.189  -5.347
   82    H    TRP   9           H        TRP   9   1.238  -2.543   1.872
   83    HA   TRP   9           HA       TRP   9  -0.618  -0.862   3.020
   84   1HB   TRP   9          2HB       TRP   9   0.213  -2.603   4.331
   85   2HB   TRP   9          1HB       TRP   9   1.888  -2.183   3.990
   86    HD1  TRP   9           HD1      TRP   9   2.830   0.049   5.177
   87    HE1  TRP   9           1HE      TRP   9   2.246   1.082   7.469
   88    HE3  TRP   9           3HE      TRP   9  -1.631  -2.216   6.003
   89    HZ2  TRP   9           2HZ      TRP   9   0.127   0.952   9.403
   90    HZ3  TRP   9           3HZ      TRP   9  -2.930  -1.759   8.070
   91    HH2  TRP   9           HH2      TRP   9  -2.057  -0.172   9.767
   92    HA   PRO  10           HA       PRO  10   1.350   3.086   3.025
   93   1HB   PRO  10          2HB       PRO  10  -0.535   4.395   4.514
   94   2HB   PRO  10          1HB       PRO  10  -0.809   3.883   2.840
   95   1HG   PRO  10          2HG       PRO  10  -1.973   2.841   5.293
   96   2HG   PRO  10          1HG       PRO  10  -2.468   2.577   3.618
   97   1HD   PRO  10          2HD       PRO  10  -0.911   0.854   5.353
   98   2HD   PRO  10          1HD       PRO  10  -1.600   0.490   3.758
   99    H    TRP  11           H        TRP  11   3.234   3.153   4.288
  100    HA   TRP  11           HA       TRP  11   2.979   3.061   7.240
  101   1HB   TRP  11          2HB       TRP  11   5.425   2.595   7.048
  102   2HB   TRP  11          1HB       TRP  11   4.447   1.451   6.147
  103    HD1  TRP  11           HD1      TRP  11   6.388   4.712   5.552
  104    HE1  TRP  11           1HE      TRP  11   7.255   4.671   3.107
  105    HE3  TRP  11           3HE      TRP  11   4.237   0.426   4.015
  106    HZ2  TRP  11           2HZ      TRP  11   7.025   2.977   0.782
  107    HZ3  TRP  11           3HZ      TRP  11   4.544  -0.421   1.686
  108    HH2  TRP  11           HH2      TRP  11   5.935   0.857   0.073
  109    H    ARG  12           H        ARG  12   5.170   4.457   7.997
  110    HA   ARG  12           HA       ARG  12   5.050   7.130   6.687
  111   1HB   ARG  12          2HB       ARG  12   3.658   6.388   8.995
  112   2HB   ARG  12          1HB       ARG  12   5.073   7.249   9.601
  113   1HG   ARG  12          2HG       ARG  12   4.507   9.003   7.766
  114   2HG   ARG  12          1HG       ARG  12   2.916   8.240   7.750
  115   1HD   ARG  12          2HD       ARG  12   2.424   8.909   9.939
  116   2HD   ARG  12          1HD       ARG  12   4.137   9.058  10.380
  117    HE   ARG  12           HE       ARG  12   2.573  11.044   8.841
  118   1HH1  ARG  12          2HH1      ARG  12   4.238  11.803  11.191
  119   2HH1  ARG  12          1HH1      ARG  12   5.659  12.458  10.446
  120   1HH2  ARG  12          1HH2      ARG  12   5.002  11.055   7.343
  121   2HH2  ARG  12          2HH2      ARG  12   6.092  12.034   8.269
  122    H    ARG  13           H        ARG  13   7.261   6.316   6.014
  123    HA   ARG  13           HA       ARG  13   9.379   5.602   7.694
  124   1HB   ARG  13          2HB       ARG  13   8.969   6.347   5.046
  125   2HB   ARG  13          1HB       ARG  13  10.101   7.564   5.639
  126   1HG   ARG  13          2HG       ARG  13  10.637   4.722   6.375
  127   2HG   ARG  13          1HG       ARG  13  10.942   5.200   4.703
  128   1HD   ARG  13          2HD       ARG  13  12.111   7.287   5.970
  129   2HD   ARG  13          1HD       ARG  13  12.365   6.018   7.184
  130    HE   ARG  13           HE       ARG  13  13.485   6.042   4.458
  131   1HH1  ARG  13          1HH2      ARG  13  12.011   3.455   5.591
  132   2HH1  ARG  13          2HH2      ARG  13  13.408   2.528   6.026
  133   1HH2  ARG  13          1HH1      ARG  13  15.597   5.206   5.757
  134   2HH2  ARG  13          2HH1      ARG  13  15.439   3.518   6.121
  135   1HN   NH2  14          1HT       ARG  13  11.333   7.246   8.178
  136   2HN   NH2  14          2HT       ARG  13  10.889   8.698   8.937
  Start of MODEL    6
    1   1H    ILE   1          1H        ILE   1 -18.987  -3.127  -0.647
    2   2H    ILE   1          2H        ILE   1 -20.512  -3.204   0.097
    3   3H    ILE   1          3H        ILE   1 -19.125  -3.693   0.946
    4    HA   ILE   1           HA       ILE   1 -19.981  -0.951   0.245
    5    HB   ILE   1           HB       ILE   1 -18.815  -1.927   2.822
    6   1HG1  ILE   1          2HG1      ILE   1 -21.585  -2.585   1.781
    7   2HG1  ILE   1          1HG1      ILE   1 -20.366  -3.714   2.372
    8   1HG2  ILE   1          1HG2      ILE   1 -21.290  -0.334   2.749
    9   2HG2  ILE   1          2HG2      ILE   1 -19.910   0.442   1.974
   10   3HG2  ILE   1          3HG2      ILE   1 -19.804  -0.064   3.661
   11   1HD1  ILE   1          1HD1      ILE   1 -20.551  -2.811   4.625
   12   2HD1  ILE   1          2HD1      ILE   1 -22.161  -3.251   4.053
   13   3HD1  ILE   1          3HD1      ILE   1 -21.660  -1.560   4.067
   14    H    LEU   2           H        LEU   2 -18.048   0.269   1.918
   15    HA   LEU   2           HA       LEU   2 -15.918   0.907   0.295
   16   1HB   LEU   2          2HB       LEU   2 -14.737   1.420   2.448
   17   2HB   LEU   2          1HB       LEU   2 -16.411   1.969   2.441
   18    HG   LEU   2           HG       LEU   2 -16.271  -0.768   3.355
   19   1HD1  LEU   2          1HD1      LEU   2 -15.096   0.730   5.521
   20   2HD1  LEU   2          2HD1      LEU   2 -14.031   0.786   4.116
   21   3HD1  LEU   2          3HD1      LEU   2 -14.531  -0.768   4.783
   22   1HD2  LEU   2          1HD2      LEU   2 -18.134   0.782   3.771
   23   2HD2  LEU   2          2HD2      LEU   2 -17.063   1.841   4.690
   24   3HD2  LEU   2          3HD2      LEU   2 -17.449   0.231   5.300
   25    HA   PRO   3           HA       PRO   3 -13.649  -2.867  -0.111
   26   1HB   PRO   3          2HB       PRO   3 -11.367  -1.792  -1.178
   27   2HB   PRO   3          1HB       PRO   3 -12.862  -2.008  -2.110
   28   1HG   PRO   3          2HG       PRO   3 -11.776   0.448  -0.820
   29   2HG   PRO   3          1HG       PRO   3 -12.579   0.258  -2.386
   30   1HD   PRO   3          2HD       PRO   3 -13.844   1.225  -0.186
   31   2HD   PRO   3          1HD       PRO   3 -14.678   0.321  -1.467
   32    H    TRP   4           H        TRP   4 -11.301  -3.597   0.501
   33    HA   TRP   4           HA       TRP   4  -9.958  -2.092   2.617
   34   1HB   TRP   4          2HB       TRP   4 -12.034  -3.036   3.678
   35   2HB   TRP   4          1HB       TRP   4 -11.445  -4.649   3.280
   36    HD1  TRP   4           HD1      TRP   4  -9.480  -5.639   4.696
   37    HE1  TRP   4           1HE      TRP   4  -8.337  -4.895   6.885
   38    HE3  TRP   4           3HE      TRP   4 -11.310  -0.887   5.075
   39    HZ2  TRP   4           2HZ      TRP   4  -8.214  -2.588   8.571
   40    HZ3  TRP   4           3HZ      TRP   4 -10.665   0.560   6.980
   41    HH2  TRP   4           HH2      TRP   4  -9.121  -0.284   8.727
   42    H    LYS   5           H        LYS   5  -9.148  -3.231   0.162
   43    HA   LYS   5           HA       LYS   5  -7.247  -5.338   1.103
   44   1HB   LYS   5          2HB       LYS   5  -9.276  -5.279  -1.007
   45   2HB   LYS   5          1HB       LYS   5  -7.687  -5.771  -1.587
   46   1HG   LYS   5          2HG       LYS   5  -7.894  -7.784  -0.604
   47   2HG   LYS   5          1HG       LYS   5  -8.238  -7.026   0.950
   48   1HD   LYS   5          2HD       LYS   5 -10.277  -8.017   0.681
   49   2HD   LYS   5          1HD       LYS   5 -10.597  -6.600  -0.320
   50   1HE   LYS   5          2HE       LYS   5 -10.851  -7.929  -2.134
   51   2HE   LYS   5          1HE       LYS   5  -9.213  -8.572  -1.904
   52   1HZ   LYS   5          1HZ       LYS   5 -11.568  -9.440  -0.319
   53   2HZ   LYS   5          2HZ       LYS   5 -10.014 -10.129  -0.309
   54   3HZ   LYS   5          3HZ       LYS   5 -11.001 -10.271  -1.684
   55    H    TRP   6           H        TRP   6  -7.225  -2.307   0.478
   56    HA   TRP   6           HA       TRP   6  -5.830  -1.517  -1.732
   57   1HB   TRP   6          2HB       TRP   6  -6.529  -0.023  -0.015
   58   2HB   TRP   6          1HB       TRP   6  -5.559  -0.841   1.192
   59    HD1  TRP   6           HD1      TRP   6  -2.941  -0.654   0.937
   60    HE1  TRP   6           1HE      TRP   6  -1.487   1.274  -0.036
   61    HE3  TRP   6           3HE      TRP   6  -6.472   1.685  -1.724
   62    HZ2  TRP   6           2HZ      TRP   6  -1.864   3.553  -1.783
   63    HZ3  TRP   6           3HZ      TRP   6  -5.970   3.735  -3.064
   64    HH2  TRP   6           HH2      TRP   6  -3.664   4.664  -3.092
   65    HA   PRO   7           HA       PRO   7  -2.034  -3.763  -1.375
   66   1HB   PRO   7          2HB       PRO   7  -0.849  -2.726  -3.627
   67   2HB   PRO   7          1HB       PRO   7  -2.167  -3.909  -3.667
   68   1HG   PRO   7          2HG       PRO   7  -2.198  -1.090  -4.387
   69   2HG   PRO   7          1HG       PRO   7  -3.397  -2.343  -4.721
   70   1HD   PRO   7          2HD       PRO   7  -3.421  -0.306  -2.653
   71   2HD   PRO   7          1HD       PRO   7  -4.715  -1.420  -3.145
   72    H    TRP   8           H        TRP   8   0.501  -2.908  -2.147
   73    HA   TRP   8           HA       TRP   8   2.327  -2.006  -0.936
   74   1HB   TRP   8          2HB       TRP   8   1.049   0.576  -1.730
   75   2HB   TRP   8          1HB       TRP   8   2.701   0.021  -1.971
   76    HD1  TRP   8           HD1      TRP   8  -0.692   0.018  -3.530
   77    HE1  TRP   8           1HE      TRP   8  -0.588  -1.076  -5.866
   78    HE3  TRP   8           3HE      TRP   8   3.993  -1.922  -3.344
   79    HZ2  TRP   8           2HZ      TRP   8   1.264  -2.595  -7.439
   80    HZ3  TRP   8           3HZ      TRP   8   4.919  -3.196  -5.262
   81    HH2  TRP   8           HH2      TRP   8   3.557  -3.538  -7.308
   82    H    TRP   9           H        TRP   9   1.669  -2.533   1.270
   83    HA   TRP   9           HA       TRP   9  -0.015  -1.336   3.034
   84   1HB   TRP   9          2HB       TRP   9   1.378  -3.003   3.870
   85   2HB   TRP   9          1HB       TRP   9   2.832  -2.239   3.234
   86    HD1  TRP   9           HD1      TRP   9   3.671  -0.016   4.499
   87    HE1  TRP   9           1HE      TRP   9   3.494   0.653   6.988
   88    HE3  TRP   9           3HE      TRP   9  -0.068  -3.125   5.934
   89    HZ2  TRP   9           2HZ      TRP   9   1.936  -0.059   9.293
   90    HZ3  TRP   9           3HZ      TRP   9  -0.898  -3.125   8.276
   91    HH2  TRP   9           HH2      TRP   9   0.098  -1.592   9.953
   92    HA   PRO  10           HA       PRO  10   1.191   2.897   3.208
   93   1HB   PRO  10          2HB       PRO  10  -0.511   3.638   5.216
   94   2HB   PRO  10          1HB       PRO  10  -1.061   3.263   3.573
   95   1HG   PRO  10          2HG       PRO  10  -1.444   1.753   6.031
   96   2HG   PRO  10          1HG       PRO  10  -2.256   1.583   4.471
   97   1HD   PRO  10          2HD       PRO  10  -0.086   0.012   5.573
   98   2HD   PRO  10          1HD       PRO  10  -1.039  -0.289   4.108
   99    H    TRP  11           H        TRP  11   3.122   3.538   4.125
  100    HA   TRP  11           HA       TRP  11   3.641   2.892   6.979
  101   1HB   TRP  11          2HB       TRP  11   6.010   3.105   6.206
  102   2HB   TRP  11          1HB       TRP  11   5.118   1.869   5.343
  103    HD1  TRP  11           HD1      TRP  11   6.188   5.525   4.958
  104    HE1  TRP  11           1HE      TRP  11   6.372   6.035   2.422
  105    HE3  TRP  11           3HE      TRP  11   4.488   1.146   3.134
  106    HZ2  TRP  11           2HZ      TRP  11   5.833   4.697  -0.076
  107    HZ3  TRP  11           3HZ      TRP  11   4.311   0.745   0.680
  108    HH2  TRP  11           HH2      TRP  11   4.982   2.520  -0.923
  109    H    ARG  12           H        ARG  12   5.590   4.691   7.532
  110    HA   ARG  12           HA       ARG  12   4.148   7.186   7.863
  111   1HB   ARG  12          2HB       ARG  12   5.725   6.197   9.504
  112   2HB   ARG  12          1HB       ARG  12   7.043   6.422   8.353
  113   1HG   ARG  12          2HG       ARG  12   6.929   8.776   8.496
  114   2HG   ARG  12          1HG       ARG  12   5.318   8.739   9.218
  115   1HD   ARG  12          2HD       ARG  12   6.438   7.479  11.189
  116   2HD   ARG  12          1HD       ARG  12   7.968   8.071  10.512
  117    HE   ARG  12           HE       ARG  12   5.752   9.804  11.501
  118   1HH1  ARG  12          1HH2      ARG  12   8.965   9.300  11.897
  119   2HH1  ARG  12          2HH2      ARG  12   9.482  10.914  11.542
  120   1HH2  ARG  12          2HH1      ARG  12   6.391  11.921  10.334
  121   2HH2  ARG  12          1HH1      ARG  12   8.025  12.399  10.658
  122    H    ARG  13           H        ARG  13   4.217   6.886   5.140
  123    HA   ARG  13           HA       ARG  13   6.486   7.893   3.750
  124   1HB   ARG  13          2HB       ARG  13   4.547   6.804   2.706
  125   2HB   ARG  13          1HB       ARG  13   3.511   8.145   3.196
  126   1HG   ARG  13          2HG       ARG  13   4.219   8.360   0.829
  127   2HG   ARG  13          1HG       ARG  13   4.826   9.692   1.815
  128   1HD   ARG  13          2HD       ARG  13   7.003   8.464   2.054
  129   2HD   ARG  13          1HD       ARG  13   6.388   7.242   0.924
  130    HE   ARG  13           HE       ARG  13   5.968   9.333  -0.609
  131   1HH1  ARG  13          1HH1      ARG  13   7.587  10.820   1.661
  132   2HH1  ARG  13          2HH1      ARG  13   9.096  11.023   0.837
  133   1HH2  ARG  13          1HH2      ARG  13   8.324   8.772  -1.686
  134   2HH2  ARG  13          2HH2      ARG  13   9.514   9.863  -1.057
  135   1HN   NH2  14          1HT       ARG  13   7.282   9.727   5.115
  136   2HN   NH2  14          2HT       ARG  13   6.504  11.234   5.061
  Start of MODEL    7
    1   1H    ILE   1          1H        ILE   1 -19.790   0.091   0.383
    2   2H    ILE   1          2H        ILE   1 -20.426  -1.272   1.175
    3   3H    ILE   1          3H        ILE   1 -18.886  -1.341   0.459
    4    HA   ILE   1           HA       ILE   1 -19.420   0.624   2.597
    5    HB   ILE   1           HB       ILE   1 -18.534  -1.297   4.095
    6   1HG1  ILE   1          2HG1      ILE   1 -19.759  -3.036   1.954
    7   2HG1  ILE   1          1HG1      ILE   1 -18.033  -2.675   1.945
    8   1HG2  ILE   1          1HG2      ILE   1 -20.694  -1.661   4.756
    9   2HG2  ILE   1          2HG2      ILE   1 -21.235  -2.057   3.125
   10   3HG2  ILE   1          3HG2      ILE   1 -21.031  -0.371   3.601
   11   1HD1  ILE   1          1HD1      ILE   1 -17.863  -4.470   3.328
   12   2HD1  ILE   1          2HD1      ILE   1 -19.576  -4.423   3.750
   13   3HD1  ILE   1          3HD1      ILE   1 -18.437  -3.359   4.571
   14    H    LEU   2           H        LEU   2 -17.310   0.941   3.781
   15    HA   LEU   2           HA       LEU   2 -15.164   1.715   2.244
   16   1HB   LEU   2          2HB       LEU   2 -13.834   1.394   4.312
   17   2HB   LEU   2          1HB       LEU   2 -15.431   2.047   4.679
   18    HG   LEU   2           HG       LEU   2 -15.736  -0.759   4.663
   19   1HD1  LEU   2          1HD1      LEU   2 -13.178  -0.705   4.866
   20   2HD1  LEU   2          2HD1      LEU   2 -14.046  -1.599   6.113
   21   3HD1  LEU   2          3HD1      LEU   2 -13.428   0.017   6.456
   22   1HD2  LEU   2          1HD2      LEU   2 -16.201   1.505   6.337
   23   2HD2  LEU   2          2HD2      LEU   2 -15.445   0.256   7.328
   24   3HD2  LEU   2          3HD2      LEU   2 -16.935  -0.095   6.450
   25    HA   PRO   3           HA       PRO   3 -13.620  -2.073   0.528
   26   1HB   PRO   3          2HB       PRO   3 -11.324  -1.043  -0.544
   27   2HB   PRO   3          1HB       PRO   3 -12.923  -0.795  -1.272
   28   1HG   PRO   3          2HG       PRO   3 -11.300   1.052   0.400
   29   2HG   PRO   3          1HG       PRO   3 -12.337   1.403  -0.991
   30   1HD   PRO   3          2HD       PRO   3 -13.072   1.836   1.609
   31   2HD   PRO   3          1HD       PRO   3 -14.221   1.543   0.287
   32    H    TRP   4           H        TRP   4 -11.141  -3.026   0.486
   33    HA   TRP   4           HA       TRP   4  -9.424  -2.397   2.703
   34   1HB   TRP   4          2HB       TRP   4 -11.513  -3.187   3.858
   35   2HB   TRP   4          1HB       TRP   4 -11.294  -4.753   3.074
   36    HD1  TRP   4           HD1      TRP   4  -9.426  -6.338   3.973
   37    HE1  TRP   4           1HE      TRP   4  -7.908  -6.278   6.058
   38    HE3  TRP   4           3HE      TRP   4 -10.212  -1.528   5.499
   39    HZ2  TRP   4           2HZ      TRP   4  -7.130  -4.431   8.103
   40    HZ3  TRP   4           3HZ      TRP   4  -9.072  -0.645   7.515
   41    HH2  TRP   4           HH2      TRP   4  -7.535  -2.090   8.817
   42    H    LYS   5           H        LYS   5  -9.019  -3.063   0.018
   43    HA   LYS   5           HA       LYS   5  -7.493  -5.610   0.279
   44   1HB   LYS   5          2HB       LYS   5  -9.732  -4.861  -1.448
   45   2HB   LYS   5          1HB       LYS   5  -8.344  -5.473  -2.346
   46   1HG   LYS   5          2HG       LYS   5  -8.643  -7.579  -1.573
   47   2HG   LYS   5          1HG       LYS   5  -8.909  -7.014   0.075
   48   1HD   LYS   5          2HD       LYS   5 -11.062  -7.645  -0.262
   49   2HD   LYS   5          1HD       LYS   5 -11.191  -6.151  -1.191
   50   1HE   LYS   5          2HE       LYS   5 -11.158  -7.251  -3.221
   51   2HE   LYS   5          1HE       LYS   5 -10.107  -8.547  -2.616
   52   1HZ   LYS   5          1HZ       LYS   5 -12.208  -8.894  -1.053
   53   2HZ   LYS   5          2HZ       LYS   5 -12.060  -9.667  -2.558
   54   3HZ   LYS   5          3HZ       LYS   5 -13.004  -8.263  -2.412
   55    H    TRP   6           H        TRP   6  -7.050  -2.517   0.072
   56    HA   TRP   6           HA       TRP   6  -5.619  -1.974  -2.324
   57   1HB   TRP   6          2HB       TRP   6  -6.542  -0.304  -0.829
   58   2HB   TRP   6          1HB       TRP   6  -5.522  -0.858   0.482
   59    HD1  TRP   6           HD1      TRP   6  -2.935  -0.502   0.220
   60    HE1  TRP   6           1HE      TRP   6  -1.600   1.328  -1.067
   61    HE3  TRP   6           3HE      TRP   6  -6.567   1.076  -2.827
   62    HZ2  TRP   6           2HZ      TRP   6  -2.105   3.237  -3.187
   63    HZ3  TRP   6           3HZ      TRP   6  -6.190   2.895  -4.501
   64    HH2  TRP   6           HH2      TRP   6  -3.956   3.972  -4.680
   65    HA   PRO   7           HA       PRO   7  -1.846  -4.035  -1.315
   66   1HB   PRO   7          2HB       PRO   7  -0.369  -3.105  -3.423
   67   2HB   PRO   7          1HB       PRO   7  -1.668  -4.297  -3.595
   68   1HG   PRO   7          2HG       PRO   7  -1.607  -1.492  -4.405
   69   2HG   PRO   7          1HG       PRO   7  -2.700  -2.783  -4.914
   70   1HD   PRO   7          2HD       PRO   7  -3.163  -0.690  -2.978
   71   2HD   PRO   7          1HD       PRO   7  -4.297  -1.917  -3.584
   72    H    TRP   8           H        TRP   8   0.739  -3.264  -1.717
   73    HA   TRP   8           HA       TRP   8   2.376  -2.274  -0.322
   74   1HB   TRP   8          2HB       TRP   8   1.230   0.114  -1.752
   75   2HB   TRP   8          1HB       TRP   8   2.916  -0.271  -1.425
   76    HD1  TRP   8           HD1      TRP   8   0.271  -0.720  -3.957
   77    HE1  TRP   8           1HE      TRP   8   1.103  -2.241  -5.869
   78    HE3  TRP   8           3HE      TRP   8   4.491  -2.536  -1.810
   79    HZ2  TRP   8           2HZ      TRP   8   3.295  -4.016  -6.397
   80    HZ3  TRP   8           3HZ      TRP   8   5.945  -4.143  -3.017
   81    HH2  TRP   8           HH2      TRP   8   5.349  -4.889  -5.306
   82    H    TRP   9           H        TRP   9   1.329  -2.498   1.808
   83    HA   TRP   9           HA       TRP   9  -0.524  -0.868   3.035
   84   1HB   TRP   9          2HB       TRP   9   0.351  -2.606   4.312
   85   2HB   TRP   9          1HB       TRP   9   2.012  -2.192   3.906
   86    HD1  TRP   9           HD1      TRP   9   3.019   0.017   5.076
   87    HE1  TRP   9           1HE      TRP   9   2.539   1.030   7.403
   88    HE3  TRP   9           3HE      TRP   9  -1.421  -2.226   6.066
   89    HZ2  TRP   9           2HZ      TRP   9   0.503   0.891   9.424
   90    HZ3  TRP   9           3HZ      TRP   9  -2.628  -1.784   8.191
   91    HH2  TRP   9           HH2      TRP   9  -1.672  -0.224   9.868
   92    HA   PRO  10           HA       PRO  10   1.383   3.102   3.035
   93   1HB   PRO  10          2HB       PRO  10  -0.472   4.370   4.597
   94   2HB   PRO  10          1HB       PRO  10  -0.792   3.873   2.924
   95   1HG   PRO  10          2HG       PRO  10  -1.861   2.786   5.402
   96   2HG   PRO  10          1HG       PRO  10  -2.406   2.537   3.739
   97   1HD   PRO  10          2HD       PRO  10  -0.776   0.808   5.399
   98   2HD   PRO  10          1HD       PRO  10  -1.505   0.462   3.820
   99    H    TRP  11           H        TRP  11   3.301   3.193   4.234
  100    HA   TRP  11           HA       TRP  11   3.157   3.021   7.184
  101   1HB   TRP  11          2HB       TRP  11   5.628   2.738   6.885
  102   2HB   TRP  11          1HB       TRP  11   4.683   1.534   6.027
  103    HD1  TRP  11           HD1      TRP  11   6.379   4.914   5.357
  104    HE1  TRP  11           1HE      TRP  11   7.135   4.937   2.875
  105    HE3  TRP  11           3HE      TRP  11   4.441   0.503   3.895
  106    HZ2  TRP  11           2HZ      TRP  11   6.908   3.234   0.552
  107    HZ3  TRP  11           3HZ      TRP  11   4.695  -0.318   1.551
  108    HH2  TRP  11           HH2      TRP  11   5.925   1.051  -0.117
  109    H    ARG  12           H        ARG  12   5.179   4.507   8.007
  110    HA   ARG  12           HA       ARG  12   5.113   7.182   6.738
  111   1HB   ARG  12          2HB       ARG  12   3.360   6.394   8.764
  112   2HB   ARG  12          1HB       ARG  12   4.618   7.295   9.610
  113   1HG   ARG  12          2HG       ARG  12   4.156   8.816   7.337
  114   2HG   ARG  12          1HG       ARG  12   2.545   8.260   7.791
  115   1HD   ARG  12          2HD       ARG  12   3.057  10.382   8.944
  116   2HD   ARG  12          1HD       ARG  12   2.975   9.064  10.131
  117    HE   ARG  12           HE       ARG  12   5.411   9.033  10.203
  118   1HH1  ARG  12          1HH2      ARG  12   4.030  11.980   9.574
  119   2HH1  ARG  12          2HH2      ARG  12   5.442  12.719   8.897
  120   1HH2  ARG  12          2HH1      ARG  12   7.243   9.759   8.745
  121   2HH2  ARG  12          1HH1      ARG  12   7.262  11.463   8.428
  122    H    ARG  13           H        ARG  13   7.437   6.274   6.509
  123    HA   ARG  13           HA       ARG  13   8.988   6.875   9.010
  124   1HB   ARG  13          2HB       ARG  13   9.325   4.773   6.856
  125   2HB   ARG  13          1HB       ARG  13  10.614   5.172   7.992
  126   1HG   ARG  13          2HG       ARG  13   8.768   4.813   9.814
  127   2HG   ARG  13          1HG       ARG  13   7.937   3.917   8.542
  128   1HD   ARG  13          2HD       ARG  13   9.872   2.437   8.267
  129   2HD   ARG  13          1HD       ARG  13  10.778   3.367   9.476
  130    HE   ARG  13           HE       ARG  13   8.300   2.641  10.648
  131   1HH1  ARG  13          1HH2      ARG  13   9.847   0.390   8.851
  132   2HH1  ARG  13          2HH2      ARG  13  10.367  -0.616  10.161
  133   1HH2  ARG  13          1HH1      ARG  13   9.550   1.697  12.612
  134   2HH2  ARG  13          2HH1      ARG  13  10.200   0.125  12.291
  135   1HN   NH2  14          1HT       ARG  13   8.228   8.541   6.468
  136   2HN   NH2  14          2HT       ARG  13   9.724   9.114   5.910
  Start of MODEL    8
    1   1H    ILE   1          1H        ILE   1 -18.545  -0.579   3.583
    2   2H    ILE   1          2H        ILE   1 -19.595   0.612   2.979
    3   3H    ILE   1          3H        ILE   1 -19.573   0.255   4.641
    4    HA   ILE   1           HA       ILE   1 -18.323   2.353   3.756
    5    HB   ILE   1           HB       ILE   1 -16.664   1.820   5.657
    6   1HG1  ILE   1          2HG1      ILE   1 -18.364  -0.553   6.257
    7   2HG1  ILE   1          1HG1      ILE   1 -17.122  -0.757   5.022
    8   1HG2  ILE   1          1HG2      ILE   1 -19.268   1.147   6.804
    9   2HG2  ILE   1          2HG2      ILE   1 -19.366   2.479   5.651
   10   3HG2  ILE   1          3HG2      ILE   1 -18.280   2.591   7.036
   11   1HD1  ILE   1          1HD1      ILE   1 -15.420   0.104   6.599
   12   2HD1  ILE   1          2HD1      ILE   1 -16.226  -1.328   7.243
   13   3HD1  ILE   1          3HD1      ILE   1 -16.665   0.273   7.838
   14    H    LEU   2           H        LEU   2 -15.903   2.830   3.509
   15    HA   LEU   2           HA       LEU   2 -14.771   1.931   1.175
   16   1HB   LEU   2          2HB       LEU   2 -12.679   2.747   2.085
   17   2HB   LEU   2          1HB       LEU   2 -13.977   3.726   2.769
   18    HG   LEU   2           HG       LEU   2 -13.929   1.870   4.665
   19   1HD1  LEU   2          1HD1      LEU   2 -11.104   1.723   4.644
   20   2HD1  LEU   2          2HD1      LEU   2 -11.632   1.242   3.031
   21   3HD1  LEU   2          3HD1      LEU   2 -12.244   0.392   4.450
   22   1HD2  LEU   2          1HD2      LEU   2 -13.512   4.214   5.107
   23   2HD2  LEU   2          2HD2      LEU   2 -11.929   4.127   4.335
   24   3HD2  LEU   2          3HD2      LEU   2 -12.214   3.287   5.859
   25    HA   PRO   3           HA       PRO   3 -13.858  -2.338   1.916
   26   1HB   PRO   3          2HB       PRO   3 -12.311  -2.751  -0.304
   27   2HB   PRO   3          1HB       PRO   3 -14.080  -2.623  -0.371
   28   1HG   PRO   3          2HG       PRO   3 -12.007  -0.592  -1.026
   29   2HG   PRO   3          1HG       PRO   3 -13.554  -0.926  -1.822
   30   1HD   PRO   3          2HD       PRO   3 -13.153   1.157  -0.097
   31   2HD   PRO   3          1HD       PRO   3 -14.732   0.387  -0.369
   32    H    TRP   4           H        TRP   4 -11.508  -3.627   1.418
   33    HA   TRP   4           HA       TRP   4  -9.250  -1.980   2.384
   34   1HB   TRP   4          2HB       TRP   4  -8.986  -3.898   4.185
   35   2HB   TRP   4          1HB       TRP   4 -10.012  -2.500   4.495
   36    HD1  TRP   4           HD1      TRP   4 -10.132  -6.220   3.831
   37    HE1  TRP   4           1HE      TRP   4 -12.552  -7.058   4.176
   38    HE3  TRP   4           3HE      TRP   4 -12.525  -1.757   4.301
   39    HZ2  TRP   4           2HZ      TRP   4 -15.168  -5.957   4.595
   40    HZ3  TRP   4           3HZ      TRP   4 -14.981  -1.666   4.672
   41    HH2  TRP   4           HH2      TRP   4 -16.302  -3.760   4.817
   42    H    LYS   5           H        LYS   5  -9.051  -2.930   0.000
   43    HA   LYS   5           HA       LYS   5  -7.520  -5.492   0.215
   44   1HB   LYS   5          2HB       LYS   5  -9.774  -4.646  -1.448
   45   2HB   LYS   5          1HB       LYS   5  -8.430  -5.274  -2.398
   46   1HG   LYS   5          2HG       LYS   5  -9.893  -6.671  -0.142
   47   2HG   LYS   5          1HG       LYS   5  -9.855  -7.144  -1.840
   48   1HD   LYS   5          2HD       LYS   5  -7.155  -6.917  -0.930
   49   2HD   LYS   5          1HD       LYS   5  -8.045  -7.896   0.238
   50   1HE   LYS   5          2HE       LYS   5  -8.585  -8.500  -2.627
   51   2HE   LYS   5          1HE       LYS   5  -6.983  -8.958  -2.012
   52   1HZ   LYS   5          1HZ       LYS   5  -7.981 -10.108  -0.193
   53   2HZ   LYS   5          2HZ       LYS   5  -8.727 -10.665  -1.615
   54   3HZ   LYS   5          3HZ       LYS   5  -9.530  -9.556  -0.608
   55    H    TRP   6           H        TRP   6  -7.016  -2.397   0.005
   56    HA   TRP   6           HA       TRP   6  -5.582  -1.882  -2.393
   57   1HB   TRP   6          2HB       TRP   6  -6.450  -0.194  -0.895
   58   2HB   TRP   6          1HB       TRP   6  -5.463  -0.790   0.422
   59    HD1  TRP   6           HD1      TRP   6  -2.860  -0.511   0.186
   60    HE1  TRP   6           1HE      TRP   6  -1.465   1.297  -1.066
   61    HE3  TRP   6           3HE      TRP   6  -6.426   1.213  -2.865
   62    HZ2  TRP   6           2HZ      TRP   6  -1.900   3.249  -3.163
   63    HZ3  TRP   6           3HZ      TRP   6  -5.983   3.044  -4.509
   64    HH2  TRP   6           HH2      TRP   6  -3.719   4.058  -4.656
   65    HA   PRO   7           HA       PRO   7  -1.860  -4.047  -1.410
   66   1HB   PRO   7          2HB       PRO   7  -0.344  -3.110  -3.486
   67   2HB   PRO   7          1HB       PRO   7  -1.667  -4.272  -3.691
   68   1HG   PRO   7          2HG       PRO   7  -1.539  -1.454  -4.449
   69   2HG   PRO   7          1HG       PRO   7  -2.655  -2.711  -4.990
   70   1HD   PRO   7          2HD       PRO   7  -3.091  -0.643  -3.024
   71   2HD   PRO   7          1HD       PRO   7  -4.245  -1.838  -3.655
   72    H    TRP   8           H        TRP   8   0.738  -3.367  -1.741
   73    HA   TRP   8           HA       TRP   8   2.380  -2.450  -0.299
   74   1HB   TRP   8          2HB       TRP   8   1.408   0.021  -1.711
   75   2HB   TRP   8          1HB       TRP   8   3.059  -0.506  -1.406
   76    HD1  TRP   8           HD1      TRP   8   0.324  -0.735  -3.891
   77    HE1  TRP   8           1HE      TRP   8   1.025  -2.249  -5.860
   78    HE3  TRP   8           3HE      TRP   8   4.510  -2.808  -1.909
   79    HZ2  TRP   8           2HZ      TRP   8   3.110  -4.112  -6.494
   80    HZ3  TRP   8           3HZ      TRP   8   5.846  -4.454  -3.199
   81    HH2  TRP   8           HH2      TRP   8   5.147  -5.111  -5.486
   82    H    TRP   9           H        TRP   9   1.336  -2.631   1.802
   83    HA   TRP   9           HA       TRP   9  -0.521  -1.046   3.044
   84   1HB   TRP   9          2HB       TRP   9   0.462  -2.759   4.294
   85   2HB   TRP   9          1HB       TRP   9   2.095  -2.216   3.922
   86    HD1  TRP   9           HD1      TRP   9   2.917   0.042   5.134
   87    HE1  TRP   9           1HE      TRP   9   2.306   1.015   7.444
   88    HE3  TRP   9           3HE      TRP   9  -1.385  -2.498   5.996
   89    HZ2  TRP   9           2HZ      TRP   9   0.229   0.735   9.406
   90    HZ3  TRP   9           3HZ      TRP   9  -2.678  -2.143   8.087
   91    HH2  TRP   9           HH2      TRP   9  -1.877  -0.525   9.788
   92    HA   PRO  10           HA       PRO  10   1.228   3.004   3.020
   93   1HB   PRO  10          2HB       PRO  10  -0.706   4.197   4.545
   94   2HB   PRO  10          1HB       PRO  10  -0.979   3.676   2.872
   95   1HG   PRO  10          2HG       PRO  10  -2.040   2.563   5.340
   96   2HG   PRO  10          1HG       PRO  10  -2.541   2.269   3.670
   97   1HD   PRO  10          2HD       PRO  10  -0.852   0.645   5.383
   98   2HD   PRO  10          1HD       PRO  10  -1.553   0.237   3.805
   99    H    TRP  11           H        TRP  11   3.125   3.171   4.257
  100    HA   TRP  11           HA       TRP  11   2.913   3.046   7.209
  101   1HB   TRP  11          2HB       TRP  11   5.392   2.777   6.980
  102   2HB   TRP  11          1HB       TRP  11   4.485   1.554   6.112
  103    HD1  TRP  11           HD1      TRP  11   6.196   4.923   5.457
  104    HE1  TRP  11           1HE      TRP  11   7.014   4.930   2.997
  105    HE3  TRP  11           3HE      TRP  11   4.288   0.507   3.974
  106    HZ2  TRP  11           2HZ      TRP  11   6.845   3.217   0.682
  107    HZ3  TRP  11           3HZ      TRP  11   4.601  -0.326   1.644
  108    HH2  TRP  11           HH2      TRP  11   5.878   1.030  -0.001
  109    H    ARG  12           H        ARG  12   4.984   4.601   7.969
  110    HA   ARG  12           HA       ARG  12   5.307   6.870   8.586
  111   1HB   ARG  12          2HB       ARG  12   6.868   6.361   6.778
  112   2HB   ARG  12          1HB       ARG  12   5.632   6.741   5.579
  113   1HG   ARG  12          2HG       ARG  12   5.625   9.001   7.135
  114   2HG   ARG  12          1HG       ARG  12   7.330   8.547   7.161
  115   1HD   ARG  12          2HD       ARG  12   7.590   9.304   5.040
  116   2HD   ARG  12          1HD       ARG  12   6.277   8.249   4.477
  117    HE   ARG  12           HE       ARG  12   4.735  10.047   4.790
  118   1HH1  ARG  12          1HH2      ARG  12   6.629  10.712   7.331
  119   2HH1  ARG  12          2HH2      ARG  12   6.871  12.397   7.009
  120   1HH2  ARG  12          2HH1      ARG  12   5.581  12.239   3.794
  121   2HH2  ARG  12          1HH1      ARG  12   6.279  13.262   5.006
  122    H    ARG  13           H        ARG  13   2.664   6.703   8.787
  123    HA   ARG  13           HA       ARG  13   0.625   7.853   8.535
  124   1HB   ARG  13          2HB       ARG  13   1.069  10.020   9.054
  125   2HB   ARG  13          1HB       ARG  13   2.767   9.587   8.899
  126   1HG   ARG  13          2HG       ARG  13   2.822  10.337   6.602
  127   2HG   ARG  13          1HG       ARG  13   1.071  10.553   6.578
  128   1HD   ARG  13          2HD       ARG  13   2.466  12.024   8.739
  129   2HD   ARG  13          1HD       ARG  13   2.820  12.585   7.092
  130    HE   ARG  13           HE       ARG  13   0.314  12.694   6.751
  131   1HH1  ARG  13          1HH1      ARG  13  -0.468  11.313   9.292
  132   2HH1  ARG  13          2HH1      ARG  13  -0.883  12.646  10.317
  133   1HH2  ARG  13          1HH2      ARG  13   0.706  15.006   8.338
  134   2HH2  ARG  13          2HH2      ARG  13  -0.218  14.737   9.777
  135   1HN   NH2  14          1HT       ARG  13  -0.732   9.143   6.786
  136   2HN   NH2  14          2HT       ARG  13  -0.452   8.722   5.166
  Start of MODEL    9
    1   1H    ILE   1          1H        ILE   1 -17.365  -0.222  -2.472
    2   2H    ILE   1          2H        ILE   1 -18.825  -0.621  -1.704
    3   3H    ILE   1          3H        ILE   1 -17.349  -1.175  -1.070
    4    HA   ILE   1           HA       ILE   1 -17.714   1.725  -1.343
    5    HB   ILE   1           HB       ILE   1 -18.840   1.534   0.975
    6   1HG1  ILE   1          2HG1      ILE   1 -20.034  -1.028   0.214
    7   2HG1  ILE   1          1HG1      ILE   1 -18.311  -1.165   0.562
    8   1HG2  ILE   1          1HG2      ILE   1 -20.818   1.906  -0.090
    9   2HG2  ILE   1          2HG2      ILE   1 -20.742   0.374  -0.963
   10   3HG2  ILE   1          3HG2      ILE   1 -19.851   1.775  -1.560
   11   1HD1  ILE   1          1HD1      ILE   1 -20.518  -0.190   2.368
   12   2HD1  ILE   1          2HD1      ILE   1 -18.838   0.252   2.670
   13   3HD1  ILE   1          3HD1      ILE   1 -19.317  -1.445   2.676
   14    H    LEU   2           H        LEU   2 -15.679   2.354  -0.798
   15    HA   LEU   2           HA       LEU   2 -13.456   2.098   0.086
   16   1HB   LEU   2          2HB       LEU   2 -13.831   2.524   2.658
   17   2HB   LEU   2          1HB       LEU   2 -14.345   3.736   1.487
   18    HG   LEU   2           HG       LEU   2 -16.262   1.577   2.331
   19   1HD1  LEU   2          1HD1      LEU   2 -15.676   4.150   3.826
   20   2HD1  LEU   2          2HD1      LEU   2 -15.417   2.514   4.431
   21   3HD1  LEU   2          3HD1      LEU   2 -17.056   3.095   4.133
   22   1HD2  LEU   2          1HD2      LEU   2 -17.536   4.038   2.083
   23   2HD2  LEU   2          2HD2      LEU   2 -17.465   2.791   0.839
   24   3HD2  LEU   2          3HD2      LEU   2 -16.284   4.099   0.843
   25    HA   PRO   3           HA       PRO   3 -13.865  -2.337   1.373
   26   1HB   PRO   3          2HB       PRO   3 -12.116  -3.321  -0.489
   27   2HB   PRO   3          1HB       PRO   3 -13.850  -3.109  -0.807
   28   1HG   PRO   3          2HG       PRO   3 -11.554  -1.397  -1.612
   29   2HG   PRO   3          1HG       PRO   3 -13.025  -1.808  -2.507
   30   1HD   PRO   3          2HD       PRO   3 -12.641   0.576  -1.227
   31   2HD   PRO   3          1HD       PRO   3 -14.240  -0.137  -1.530
   32    H    TRP   4           H        TRP   4 -11.664  -3.849   1.574
   33    HA   TRP   4           HA       TRP   4  -9.476  -2.095   2.636
   34   1HB   TRP   4          2HB       TRP   4  -9.811  -4.524   4.172
   35   2HB   TRP   4          1HB       TRP   4  -9.831  -2.857   4.729
   36    HD1  TRP   4           HD1      TRP   4 -12.179  -5.525   3.250
   37    HE1  TRP   4           1HE      TRP   4 -14.589  -4.995   4.003
   38    HE3  TRP   4           3HE      TRP   4 -11.399  -1.084   5.644
   39    HZ2  TRP   4           2HZ      TRP   4 -15.999  -2.955   5.431
   40    HZ3  TRP   4           3HZ      TRP   4 -13.288   0.131   6.690
   41    HH2  TRP   4           HH2      TRP   4 -15.585  -0.797   6.588
   42    H    LYS   5           H        LYS   5  -9.214  -3.191   0.179
   43    HA   LYS   5           HA       LYS   5  -7.422  -5.549   0.625
   44   1HB   LYS   5          2HB       LYS   5  -9.732  -5.093  -1.097
   45   2HB   LYS   5          1HB       LYS   5  -8.316  -5.610  -2.011
   46   1HG   LYS   5          2HG       LYS   5  -8.114  -7.625  -0.783
   47   2HG   LYS   5          1HG       LYS   5  -9.157  -7.034   0.513
   48   1HD   LYS   5          2HD       LYS   5 -10.856  -8.096  -0.523
   49   2HD   LYS   5          1HD       LYS   5 -10.749  -6.855  -1.772
   50   1HE   LYS   5          2HE       LYS   5  -9.731  -8.268  -3.263
   51   2HE   LYS   5          1HE       LYS   5  -8.779  -9.071  -1.998
   52   1HZ   LYS   5          1HZ       LYS   5 -11.558  -9.562  -2.821
   53   2HZ   LYS   5          2HZ       LYS   5 -11.122  -9.839  -1.204
   54   3HZ   LYS   5          3HZ       LYS   5 -10.335 -10.678  -2.453
   55    H    TRP   6           H        TRP   6  -7.175  -2.462   0.216
   56    HA   TRP   6           HA       TRP   6  -5.840  -1.899  -2.204
   57   1HB   TRP   6          2HB       TRP   6  -6.696  -0.246  -0.669
   58   2HB   TRP   6          1HB       TRP   6  -5.641  -0.813   0.609
   59    HD1  TRP   6           HD1      TRP   6  -3.057  -0.456   0.264
   60    HE1  TRP   6           1HE      TRP   6  -1.771   1.409  -1.021
   61    HE3  TRP   6           3HE      TRP   6  -6.798   1.188  -2.615
   62    HZ2  TRP   6           2HZ      TRP   6  -2.353   3.372  -3.072
   63    HZ3  TRP   6           3HZ      TRP   6  -6.481   3.052  -4.251
   64    HH2  TRP   6           HH2      TRP   6  -4.255   4.139  -4.479
   65    HA   PRO   7           HA       PRO   7  -1.999  -3.926  -1.421
   66   1HB   PRO   7          2HB       PRO   7  -0.618  -2.924  -3.559
   67   2HB   PRO   7          1HB       PRO   7  -1.909  -4.128  -3.709
   68   1HG   PRO   7          2HG       PRO   7  -1.915  -1.302  -4.449
   69   2HG   PRO   7          1HG       PRO   7  -3.011  -2.593  -4.947
   70   1HD   PRO   7          2HD       PRO   7  -3.424  -0.558  -2.945
   71   2HD   PRO   7          1HD       PRO   7  -4.565  -1.788  -3.529
   72    H    TRP   8           H        TRP   8   0.553  -3.156  -1.872
   73    HA   TRP   8           HA       TRP   8   2.234  -2.198  -0.508
   74   1HB   TRP   8          2HB       TRP   8   1.111   0.244  -1.856
   75   2HB   TRP   8          1HB       TRP   8   2.792  -0.224  -1.631
   76    HD1  TRP   8           HD1      TRP   8  -0.039  -0.537  -3.991
   77    HE1  TRP   8           1HE      TRP   8   0.618  -2.027  -5.994
   78    HE3  TRP   8           3HE      TRP   8   4.292  -2.486  -2.205
   79    HZ2  TRP   8           2HZ      TRP   8   2.726  -3.828  -6.723
   80    HZ3  TRP   8           3HZ      TRP   8   5.618  -4.091  -3.556
   81    HH2  TRP   8           HH2      TRP   8   4.837  -4.766  -5.812
   82    H    TRP   9           H        TRP   9   1.273  -2.432   1.641
   83    HA   TRP   9           HA       TRP   9  -0.557  -0.796   2.920
   84   1HB   TRP   9          2HB       TRP   9   0.289  -2.631   4.097
   85   2HB   TRP   9          1HB       TRP   9   1.960  -2.188   3.765
   86    HD1  TRP   9           HD1      TRP   9   2.930  -0.061   5.089
   87    HE1  TRP   9           1HE      TRP   9   2.356   0.856   7.432
   88    HE3  TRP   9           3HE      TRP   9  -1.566  -2.299   5.778
   89    HZ2  TRP   9           2HZ      TRP   9   0.230   0.651   9.351
   90    HZ3  TRP   9           3HZ      TRP   9  -2.866  -1.934   7.865
   91    HH2  TRP   9           HH2      TRP   9  -1.973  -0.458   9.649
   92    HA   PRO  10           HA       PRO  10   1.496   3.111   3.090
   93   1HB   PRO  10          2HB       PRO  10  -0.367   4.381   4.639
   94   2HB   PRO  10          1HB       PRO  10  -0.652   3.953   2.942
   95   1HG   PRO  10          2HG       PRO  10  -1.834   2.821   5.345
   96   2HG   PRO  10          1HG       PRO  10  -2.328   2.638   3.660
   97   1HD   PRO  10          2HD       PRO  10  -0.794   0.819   5.320
   98   2HD   PRO  10          1HD       PRO  10  -1.500   0.533   3.717
   99    H    TRP  11           H        TRP  11   3.374   3.116   4.361
  100    HA   TRP  11           HA       TRP  11   3.103   2.852   7.301
  101   1HB   TRP  11          2HB       TRP  11   5.554   2.404   7.094
  102   2HB   TRP  11          1HB       TRP  11   4.572   1.299   6.149
  103    HD1  TRP  11           HD1      TRP  11   6.550   4.556   5.699
  104    HE1  TRP  11           1HE      TRP  11   7.414   4.624   3.255
  105    HE3  TRP  11           3HE      TRP  11   4.334   0.384   3.955
  106    HZ2  TRP  11           2HZ      TRP  11   7.157   3.052   0.849
  107    HZ3  TRP  11           3HZ      TRP  11   4.628  -0.350   1.588
  108    HH2  TRP  11           HH2      TRP  11   6.036   0.985   0.037
  109    H    ARG  12           H        ARG  12   5.238   4.195   8.192
  110    HA   ARG  12           HA       ARG  12   5.711   6.398   8.942
  111   1HB   ARG  12          2HB       ARG  12   7.309   5.794   7.180
  112   2HB   ARG  12          1HB       ARG  12   6.195   6.395   5.953
  113   1HG   ARG  12          2HG       ARG  12   6.417   8.504   7.763
  114   2HG   ARG  12          1HG       ARG  12   8.058   7.869   7.636
  115   1HD   ARG  12          2HD       ARG  12   7.722   7.921   5.086
  116   2HD   ARG  12          1HD       ARG  12   6.295   8.925   5.413
  117    HE   ARG  12           HE       ARG  12   8.532   9.910   6.920
  118   1HH1  ARG  12          1HH2      ARG  12   6.793  10.059   3.976
  119   2HH1  ARG  12          2HH2      ARG  12   7.752  11.335   3.305
  120   1HH2  ARG  12          2HH1      ARG  12   9.986  11.408   5.957
  121   2HH2  ARG  12          1HH1      ARG  12   9.560  12.099   4.426
  122    H    ARG  13           H        ARG  13   3.139   6.616   9.131
  123    HA   ARG  13           HA       ARG  13   2.040   8.550   7.163
  124   1HB   ARG  13          2HB       ARG  13  -0.057   8.069   8.336
  125   2HB   ARG  13          1HB       ARG  13   0.769   6.553   7.973
  126   1HG   ARG  13          2HG       ARG  13   1.615   6.394  10.233
  127   2HG   ARG  13          1HG       ARG  13   1.014   8.008  10.621
  128   1HD   ARG  13          2HD       ARG  13  -1.039   6.143   9.574
  129   2HD   ARG  13          1HD       ARG  13  -0.382   5.731  11.171
  130    HE   ARG  13           HE       ARG  13  -1.091   8.569  10.769
  131   1HH1  ARG  13          1HH2      ARG  13  -2.940   5.824  11.027
  132   2HH1  ARG  13          2HH2      ARG  13  -3.688   6.233  12.535
  133   1HH2  ARG  13          1HH1      ARG  13  -1.615   8.948  13.129
  134   2HH2  ARG  13          2HH1      ARG  13  -2.938   8.003  13.724
  135   1HN   NH2  14          1HT       ARG  13   4.220   9.361   9.122
  136   2HN   NH2  14          2HT       ARG  13   3.551  10.622  10.040
  Start of MODEL   10
    1   1H    ILE   1          1H        ILE   1 -18.180  -1.226  -0.801
    2   2H    ILE   1          2H        ILE   1 -18.900   0.106  -1.572
    3   3H    ILE   1          3H        ILE   1 -19.795  -0.826  -0.466
    4    HA   ILE   1           HA       ILE   1 -18.776   1.448   0.281
    5    HB   ILE   1           HB       ILE   1 -18.508   0.247   2.558
    6   1HG1  ILE   1          2HG1      ILE   1 -19.436  -2.098   0.869
    7   2HG1  ILE   1          1HG1      ILE   1 -17.796  -1.920   1.492
    8   1HG2  ILE   1          1HG2      ILE   1 -21.017  -0.305   0.944
    9   2HG2  ILE   1          2HG2      ILE   1 -20.631   1.248   1.686
   10   3HG2  ILE   1          3HG2      ILE   1 -20.906  -0.170   2.699
   11   1HD1  ILE   1          1HD1      ILE   1 -18.783  -1.749   3.809
   12   2HD1  ILE   1          2HD1      ILE   1 -19.013  -3.321   3.039
   13   3HD1  ILE   1          3HD1      ILE   1 -20.346  -2.167   3.107
   14    H    LEU   2           H        LEU   2 -16.873   2.155   1.530
   15    HA   LEU   2           HA       LEU   2 -14.387   1.908   0.380
   16   1HB   LEU   2          2HB       LEU   2 -13.523   2.616   2.571
   17   2HB   LEU   2          1HB       LEU   2 -15.067   3.408   2.255
   18    HG   LEU   2           HG       LEU   2 -15.832   1.044   3.479
   19   1HD1  LEU   2          1HD1      LEU   2 -14.381   0.491   5.195
   20   2HD1  LEU   2          2HD1      LEU   2 -13.669   2.104   5.255
   21   3HD1  LEU   2          3HD1      LEU   2 -13.213   0.987   3.969
   22   1HD2  LEU   2          1HD2      LEU   2 -16.580   2.461   5.227
   23   2HD2  LEU   2          2HD2      LEU   2 -16.520   3.517   3.815
   24   3HD2  LEU   2          3HD2      LEU   2 -15.230   3.575   5.018
   25    HA   PRO   3           HA       PRO   3 -13.799  -2.503   1.202
   26   1HB   PRO   3          2HB       PRO   3 -11.860  -2.835  -0.698
   27   2HB   PRO   3          1HB       PRO   3 -13.594  -2.829  -1.079
   28   1HG   PRO   3          2HG       PRO   3 -11.578  -0.664  -1.402
   29   2HG   PRO   3          1HG       PRO   3 -12.927  -1.118  -2.455
   30   1HD   PRO   3          2HD       PRO   3 -12.998   1.008  -0.745
   31   2HD   PRO   3          1HD       PRO   3 -14.442   0.114  -1.267
   32    H    TRP   4           H        TRP   4 -11.521  -3.713   1.435
   33    HA   TRP   4           HA       TRP   4  -9.475  -1.904   2.622
   34   1HB   TRP   4          2HB       TRP   4  -9.474  -3.772   4.500
   35   2HB   TRP   4          1HB       TRP   4 -10.578  -2.402   4.580
   36    HD1  TRP   4           HD1      TRP   4 -10.467  -6.139   4.017
   37    HE1  TRP   4           1HE      TRP   4 -12.885  -7.052   3.951
   38    HE3  TRP   4           3HE      TRP   4 -13.040  -1.750   3.917
   39    HZ2  TRP   4           2HZ      TRP   4 -15.566  -6.035   3.864
   40    HZ3  TRP   4           3HZ      TRP   4 -15.523  -1.736   3.841
   41    HH2  TRP   4           HH2      TRP   4 -16.787  -3.872   3.812
   42    H    LYS   5           H        LYS   5  -9.087  -3.126   0.243
   43    HA   LYS   5           HA       LYS   5  -7.263  -5.400   0.906
   44   1HB   LYS   5          2HB       LYS   5  -9.530  -5.135  -0.932
   45   2HB   LYS   5          1HB       LYS   5  -8.076  -5.761  -1.707
   46   1HG   LYS   5          2HG       LYS   5  -9.300  -6.872   0.836
   47   2HG   LYS   5          1HG       LYS   5  -9.498  -7.579  -0.767
   48   1HD   LYS   5          2HD       LYS   5  -6.746  -7.068   0.347
   49   2HD   LYS   5          1HD       LYS   5  -7.633  -8.529   0.780
   50   1HE   LYS   5          2HE       LYS   5  -6.959  -7.631  -2.048
   51   2HE   LYS   5          1HE       LYS   5  -6.234  -9.000  -1.179
   52   1HZ   LYS   5          1HZ       LYS   5  -8.798  -9.529  -0.816
   53   2HZ   LYS   5          2HZ       LYS   5  -7.932 -10.110  -2.157
   54   3HZ   LYS   5          3HZ       LYS   5  -8.910  -8.729  -2.308
   55    H    TRP   6           H        TRP   6  -7.113  -2.352   0.225
   56    HA   TRP   6           HA       TRP   6  -5.796  -1.873  -2.192
   57   1HB   TRP   6          2HB       TRP   6  -6.566  -0.169  -0.683
   58   2HB   TRP   6          1HB       TRP   6  -5.520  -0.744   0.596
   59    HD1  TRP   6           HD1      TRP   6  -2.927  -0.473   0.219
   60    HE1  TRP   6           1HE      TRP   6  -1.600   1.346  -1.091
   61    HE3  TRP   6           3HE      TRP   6  -6.649   1.259  -2.633
   62    HZ2  TRP   6           2HZ      TRP   6  -2.147   3.308  -3.151
   63    HZ3  TRP   6           3HZ      TRP   6  -6.294   3.100  -4.287
   64    HH2  TRP   6           HH2      TRP   6  -4.041   4.119  -4.545
   65    HA   PRO   7           HA       PRO   7  -1.965  -3.955  -1.506
   66   1HB   PRO   7          2HB       PRO   7  -0.627  -2.994  -3.694
   67   2HB   PRO   7          1HB       PRO   7  -1.938  -4.180  -3.792
   68   1HG   PRO   7          2HG       PRO   7  -1.926  -1.364  -4.562
   69   2HG   PRO   7          1HG       PRO   7  -3.052  -2.644  -5.016
   70   1HD   PRO   7          2HD       PRO   7  -3.382  -0.582  -3.027
   71   2HD   PRO   7          1HD       PRO   7  -4.555  -1.805  -3.561
   72    H    TRP   8           H        TRP   8   0.602  -3.191  -2.069
   73    HA   TRP   8           HA       TRP   8   2.329  -2.249  -0.739
   74   1HB   TRP   8          2HB       TRP   8   1.190   0.248  -1.960
   75   2HB   TRP   8          1HB       TRP   8   2.866  -0.284  -1.866
   76    HD1  TRP   8           HD1      TRP   8  -0.159  -0.458  -4.005
   77    HE1  TRP   8           1HE      TRP   8   0.317  -1.860  -6.120
   78    HE3  TRP   8           3HE      TRP   8   4.293  -2.499  -2.675
   79    HZ2  TRP   8           2HZ      TRP   8   2.344  -3.634  -7.102
   80    HZ3  TRP   8           3HZ      TRP   8   5.487  -4.049  -4.202
   81    HH2  TRP   8           HH2      TRP   8   4.515  -4.620  -6.411
   82    H    TRP   9           H        TRP   9   1.412  -2.546   1.425
   83    HA   TRP   9           HA       TRP   9  -0.404  -0.989   2.791
   84   1HB   TRP   9          2HB       TRP   9   0.580  -2.855   3.844
   85   2HB   TRP   9          1HB       TRP   9   2.208  -2.228   3.602
   86    HD1  TRP   9           HD1      TRP   9   2.986  -0.207   5.123
   87    HE1  TRP   9           1HE      TRP   9   2.185   0.606   7.437
   88    HE3  TRP   9           3HE      TRP   9  -1.477  -2.591   5.335
   89    HZ2  TRP   9           2HZ      TRP   9  -0.099   0.272   9.156
   90    HZ3  TRP   9           3HZ      TRP   9  -2.968  -2.343   7.307
   91    HH2  TRP   9           HH2      TRP   9  -2.284  -0.910   9.216
   92    HA   PRO  10           HA       PRO  10   1.540   2.984   3.023
   93   1HB   PRO  10          2HB       PRO  10  -0.474   4.195   4.416
   94   2HB   PRO  10          1HB       PRO  10  -0.621   3.757   2.704
   95   1HG   PRO  10          2HG       PRO  10  -1.940   2.591   5.019
   96   2HG   PRO  10          1HG       PRO  10  -2.309   2.397   3.302
   97   1HD   PRO  10          2HD       PRO  10  -0.844   0.614   5.070
   98   2HD   PRO  10          1HD       PRO  10  -1.431   0.318   3.420
   99    H    TRP  11           H        TRP  11   3.245   3.305   4.482
  100    HA   TRP  11           HA       TRP  11   2.731   2.857   7.370
  101   1HB   TRP  11          2HB       TRP  11   5.219   2.635   7.400
  102   2HB   TRP  11          1HB       TRP  11   4.441   1.478   6.337
  103    HD1  TRP  11           HD1      TRP  11   6.194   4.882   6.184
  104    HE1  TRP  11           1HE      TRP  11   7.273   5.111   3.836
  105    HE3  TRP  11           3HE      TRP  11   4.440   0.653   4.088
  106    HZ2  TRP  11           2HZ      TRP  11   7.347   3.628   1.360
  107    HZ3  TRP  11           3HZ      TRP  11   4.999   0.041   1.733
  108    HH2  TRP  11           HH2      TRP  11   6.449   1.529   0.372
  109    H    ARG  12           H        ARG  12   4.604   4.342   8.524
  110    HA   ARG  12           HA       ARG  12   4.789   6.551   9.381
  111   1HB   ARG  12          2HB       ARG  12   6.627   6.146   7.800
  112   2HB   ARG  12          1HB       ARG  12   5.614   6.710   6.473
  113   1HG   ARG  12          2HG       ARG  12   5.437   8.747   8.360
  114   2HG   ARG  12          1HG       ARG  12   7.129   8.254   8.428
  115   1HD   ARG  12          2HD       ARG  12   6.421   8.320   5.674
  116   2HD   ARG  12          1HD       ARG  12   5.825   9.825   6.400
  117    HE   ARG  12           HE       ARG  12   8.125  10.163   7.325
  118   1HH1  ARG  12          2HH1      ARG  12   7.687   9.178   4.197
  119   2HH1  ARG  12          1HH1      ARG  12   9.296   8.593   3.943
  120   1HH2  ARG  12          1HH2      ARG  12  10.194   8.832   7.285
  121   2HH2  ARG  12          2HH2      ARG  12  10.716   8.397   5.692
  122    H    ARG  13           H        ARG  13   2.079   6.169   8.755
  123    HA   ARG  13           HA       ARG  13   0.859   7.854   6.874
  124   1HB   ARG  13          2HB       ARG  13   0.229   6.627   9.487
  125   2HB   ARG  13          1HB       ARG  13  -0.773   8.019   9.077
  126   1HG   ARG  13          2HG       ARG  13  -1.642   7.001   7.162
  127   2HG   ARG  13          1HG       ARG  13  -0.281   5.889   7.016
  128   1HD   ARG  13          2HD       ARG  13  -1.900   4.446   7.877
  129   2HD   ARG  13          1HD       ARG  13  -1.194   5.046   9.390
  130    HE   ARG  13           HE       ARG  13  -3.185   6.901   8.593
  131   1HH1  ARG  13          1HH2      ARG  13  -3.098   3.515   9.139
  132   2HH1  ARG  13          2HH2      ARG  13  -4.556   3.486  10.074
  133   1HH2  ARG  13          1HH1      ARG  13  -4.986   6.926  10.005
  134   2HH2  ARG  13          2HH1      ARG  13  -5.625   5.415  10.565
  135   1HN   NH2  14          1HT       ARG  13  -0.541   9.922   7.893
  136   2HN   NH2  14          2HT       ARG  13   0.452  11.104   8.598
  Start of MODEL   11
    1   1H    ILE   1          1H        ILE   1 -19.765  -0.495   0.423
    2   2H    ILE   1          2H        ILE   1 -20.404  -1.050   1.896
    3   3H    ILE   1          3H        ILE   1 -18.921  -1.655   1.326
    4    HA   ILE   1           HA       ILE   1 -19.240   1.233   1.870
    5    HB   ILE   1           HB       ILE   1 -18.291   0.533   4.172
    6   1HG1  ILE   1          2HG1      ILE   1 -19.500  -2.100   3.259
    7   2HG1  ILE   1          1HG1      ILE   1 -17.783  -1.804   3.532
    8   1HG2  ILE   1          1HG2      ILE   1 -21.118  -0.396   3.637
    9   2HG2  ILE   1          2HG2      ILE   1 -20.673   1.311   3.601
   10   3HG2  ILE   1          3HG2      ILE   1 -20.484   0.380   5.088
   11   1HD1  ILE   1          1HD1      ILE   1 -17.995  -1.936   5.790
   12   2HD1  ILE   1          2HD1      ILE   1 -19.511  -2.763   5.435
   13   3HD1  ILE   1          3HD1      ILE   1 -19.512  -1.036   5.792
   14    H    LEU   2           H        LEU   2 -17.016   2.013   2.612
   15    HA   LEU   2           HA       LEU   2 -14.988   1.650   0.788
   16   1HB   LEU   2          2HB       LEU   2 -13.522   2.523   2.532
   17   2HB   LEU   2          1HB       LEU   2 -15.113   3.267   2.705
   18    HG   LEU   2           HG       LEU   2 -15.421   1.038   4.250
   19   1HD1  LEU   2          1HD1      LEU   2 -12.863   0.708   3.774
   20   2HD1  LEU   2          2HD1      LEU   2 -13.468   0.489   5.416
   21   3HD1  LEU   2          3HD1      LEU   2 -12.660   1.991   4.967
   22   1HD2  LEU   2          1HD2      LEU   2 -14.120   3.362   5.580
   23   2HD2  LEU   2          2HD2      LEU   2 -15.649   2.567   5.951
   24   3HD2  LEU   2          3HD2      LEU   2 -15.553   3.712   4.613
   25    HA   PRO   3           HA       PRO   3 -13.997  -2.661   1.560
   26   1HB   PRO   3          2HB       PRO   3 -12.295  -2.916  -0.568
   27   2HB   PRO   3          1HB       PRO   3 -14.062  -2.973  -0.732
   28   1HG   PRO   3          2HG       PRO   3 -12.181  -0.736  -1.287
   29   2HG   PRO   3          1HG       PRO   3 -13.635  -1.234  -2.165
   30   1HD   PRO   3          2HD       PRO   3 -13.557   0.882  -0.441
   31   2HD   PRO   3          1HD       PRO   3 -15.028  -0.053  -0.789
   32    H    TRP   4           H        TRP   4 -11.595  -3.765   1.392
   33    HA   TRP   4           HA       TRP   4  -9.507  -1.887   2.335
   34   1HB   TRP   4          2HB       TRP   4  -9.208  -3.577   4.302
   35   2HB   TRP   4          1HB       TRP   4 -10.452  -2.334   4.411
   36    HD1  TRP   4           HD1      TRP   4  -9.960  -6.056   4.159
   37    HE1  TRP   4           1HE      TRP   4 -12.253  -7.235   4.323
   38    HE3  TRP   4           3HE      TRP   4 -13.023  -2.012   3.800
   39    HZ2  TRP   4           2HZ      TRP   4 -15.036  -6.532   4.297
   40    HZ3  TRP   4           3HZ      TRP   4 -15.493  -2.280   3.869
   41    HH2  TRP   4           HH2      TRP   4 -16.499  -4.534   4.116
   42    H    LYS   5           H        LYS   5  -9.122  -2.998   0.032
   43    HA   LYS   5           HA       LYS   5  -7.412  -5.406   0.524
   44   1HB   LYS   5          2HB       LYS   5  -9.650  -4.891  -1.281
   45   2HB   LYS   5          1HB       LYS   5  -8.218  -5.449  -2.139
   46   1HG   LYS   5          2HG       LYS   5  -9.646  -6.831   0.146
   47   2HG   LYS   5          1HG       LYS   5  -9.467  -7.411  -1.509
   48   1HD   LYS   5          2HD       LYS   5  -6.856  -6.861  -0.498
   49   2HD   LYS   5          1HD       LYS   5  -7.708  -7.826   0.707
   50   1HE   LYS   5          2HE       LYS   5  -8.410  -9.051  -1.693
   51   2HE   LYS   5          1HE       LYS   5  -6.698  -8.635  -1.918
   52   1HZ   LYS   5          1HZ       LYS   5  -6.528 -10.582  -0.731
   53   2HZ   LYS   5          2HZ       LYS   5  -7.946 -10.301   0.164
   54   3HZ   LYS   5          3HZ       LYS   5  -6.522  -9.448   0.530
   55    H    TRP   6           H        TRP   6  -7.069  -2.327   0.128
   56    HA   TRP   6           HA       TRP   6  -5.664  -1.778  -2.247
   57   1HB   TRP   6          2HB       TRP   6  -6.478  -0.118  -0.699
   58   2HB   TRP   6          1HB       TRP   6  -5.475  -0.752   0.590
   59    HD1  TRP   6           HD1      TRP   6  -2.869  -0.498   0.304
   60    HE1  TRP   6           1HE      TRP   6  -1.483   1.339  -0.914
   61    HE3  TRP   6           3HE      TRP   6  -6.480   1.359  -2.615
   62    HZ2  TRP   6           2HZ      TRP   6  -1.941   3.365  -2.933
   63    HZ3  TRP   6           3HZ      TRP   6  -6.052   3.241  -4.205
   64    HH2  TRP   6           HH2      TRP   6  -3.780   4.240  -4.363
   65    HA   PRO   7           HA       PRO   7  -1.912  -3.961  -1.445
   66   1HB   PRO   7          2HB       PRO   7  -0.469  -2.980  -3.555
   67   2HB   PRO   7          1HB       PRO   7  -1.800  -4.139  -3.734
   68   1HG   PRO   7          2HG       PRO   7  -1.698  -1.306  -4.442
   69   2HG   PRO   7          1HG       PRO   7  -2.838  -2.551  -4.961
   70   1HD   PRO   7          2HD       PRO   7  -3.186  -0.524  -2.937
   71   2HD   PRO   7          1HD       PRO   7  -4.371  -1.696  -3.551
   72    H    TRP   8           H        TRP   8   0.675  -3.267  -1.866
   73    HA   TRP   8           HA       TRP   8   2.373  -2.386  -0.470
   74   1HB   TRP   8          2HB       TRP   8   1.336   0.119  -1.771
   75   2HB   TRP   8          1HB       TRP   8   3.001  -0.412  -1.550
   76    HD1  TRP   8           HD1      TRP   8   0.166  -0.579  -3.925
   77    HE1  TRP   8           1HE      TRP   8   0.781  -2.043  -5.958
   78    HE3  TRP   8           3HE      TRP   8   4.429  -2.703  -2.173
   79    HZ2  TRP   8           2HZ      TRP   8   2.833  -3.892  -6.726
   80    HZ3  TRP   8           3HZ      TRP   8   5.705  -4.320  -3.558
   81    HH2  TRP   8           HH2      TRP   8   4.909  -4.920  -5.829
   82    H    TRP   9           H        TRP   9   1.415  -2.635   1.663
   83    HA   TRP   9           HA       TRP   9  -0.387  -1.111   3.041
   84   1HB   TRP   9          2HB       TRP   9   0.657  -2.827   4.216
   85   2HB   TRP   9          1HB       TRP   9   2.267  -2.302   3.735
   86    HD1  TRP   9           HD1      TRP   9   3.196  -0.056   4.908
   87    HE1  TRP   9           1HE      TRP   9   2.776   0.873   7.282
   88    HE3  TRP   9           3HE      TRP   9  -1.036  -2.599   6.070
   89    HZ2  TRP   9           2HZ      TRP   9   0.865   0.564   9.398
   90    HZ3  TRP   9           3HZ      TRP   9  -2.154  -2.278   8.264
   91    HH2  TRP   9           HH2      TRP   9  -1.210  -0.696   9.926
   92    HA   PRO  10           HA       PRO  10   1.301   2.968   3.079
   93   1HB   PRO  10          2HB       PRO  10  -0.562   4.072   4.750
   94   2HB   PRO  10          1HB       PRO  10  -0.920   3.607   3.077
   95   1HG   PRO  10          2HG       PRO  10  -1.826   2.388   5.556
   96   2HG   PRO  10          1HG       PRO  10  -2.418   2.152   3.909
   97   1HD   PRO  10          2HD       PRO  10  -0.617   0.486   5.455
   98   2HD   PRO  10          1HD       PRO  10  -1.397   0.132   3.901
   99    H    TRP  11           H        TRP  11   3.161   3.456   4.224
  100    HA   TRP  11           HA       TRP  11   3.189   3.033   7.167
  101   1HB   TRP  11          2HB       TRP  11   5.644   2.910   6.758
  102   2HB   TRP  11          1HB       TRP  11   4.752   1.720   5.833
  103    HD1  TRP  11           HD1      TRP  11   6.285   5.207   5.411
  104    HE1  TRP  11           1HE      TRP  11   6.921   5.493   2.914
  105    HE3  TRP  11           3HE      TRP  11   4.406   0.894   3.610
  106    HZ2  TRP  11           2HZ      TRP  11   6.633   4.020   0.449
  107    HZ3  TRP  11           3HZ      TRP  11   4.571   0.317   1.187
  108    HH2  TRP  11           HH2      TRP  11   5.684   1.881  -0.391
  109    H    ARG  12           H        ARG  12   5.266   4.673   7.841
  110    HA   ARG  12           HA       ARG  12   4.110   7.294   7.879
  111   1HB   ARG  12          2HB       ARG  12   6.042   7.737   9.228
  112   2HB   ARG  12          1HB       ARG  12   5.564   6.086   9.576
  113   1HG   ARG  12          2HG       ARG  12   7.229   5.487   7.639
  114   2HG   ARG  12          1HG       ARG  12   7.906   7.080   7.979
  115   1HD   ARG  12          2HD       ARG  12   7.963   6.338  10.455
  116   2HD   ARG  12          1HD       ARG  12   7.727   4.694   9.828
  117    HE   ARG  12           HE       ARG  12  10.062   6.444   9.209
  118   1HH1  ARG  12          2HH1      ARG  12   9.367   4.685   6.906
  119   2HH1  ARG  12          1HH1      ARG  12  10.282   3.253   7.241
  120   1HH2  ARG  12          1HH2      ARG  12  10.820   4.059  10.571
  121   2HH2  ARG  12          2HH2      ARG  12  11.104   2.899   9.317
  122    H    ARG  13           H        ARG  13   4.270   6.815   5.184
  123    HA   ARG  13           HA       ARG  13   6.621   7.399   3.763
  124   1HB   ARG  13          2HB       ARG  13   4.647   6.756   2.602
  125   2HB   ARG  13          1HB       ARG  13   3.696   8.042   3.346
  126   1HG   ARG  13          2HG       ARG  13   6.011   9.079   1.899
  127   2HG   ARG  13          1HG       ARG  13   4.925   8.164   0.852
  128   1HD   ARG  13          2HD       ARG  13   3.865  10.254   2.769
  129   2HD   ARG  13          1HD       ARG  13   4.395  10.674   1.128
  130    HE   ARG  13           HE       ARG  13   2.254   8.661   1.714
  131   1HH1  ARG  13          1HH1      ARG  13   4.111   9.513  -0.857
  132   2HH1  ARG  13          2HH1      ARG  13   2.824  10.085  -1.866
  133   1HH2  ARG  13          1HH2      ARG  13   0.456  10.033   0.666
  134   2HH2  ARG  13          2HH2      ARG  13   0.756  10.379  -1.005
  135   1HN   NH2  14          1HT       ARG  13   4.500   9.643   5.546
  136   2HN   NH2  14          2HT       ARG  13   5.448  11.028   5.285
  Start of MODEL   12
    1   1H    ILE   1          1H        ILE   1 -17.506   1.349   7.200
    2   2H    ILE   1          2H        ILE   1 -15.988   0.622   6.973
    3   3H    ILE   1          3H        ILE   1 -17.363  -0.010   6.197
    4    HA   ILE   1           HA       ILE   1 -17.326   1.522   4.546
    5    HB   ILE   1           HB       ILE   1 -16.504   3.882   5.151
    6   1HG1  ILE   1          2HG1      ILE   1 -16.920   3.594   7.967
    7   2HG1  ILE   1          1HG1      ILE   1 -15.682   2.435   7.479
    8   1HG2  ILE   1          1HG2      ILE   1 -18.563   4.165   6.767
    9   2HG2  ILE   1          2HG2      ILE   1 -18.854   2.469   6.379
   10   3HG2  ILE   1          3HG2      ILE   1 -18.829   3.676   5.094
   11   1HD1  ILE   1          1HD1      ILE   1 -14.170   4.069   7.074
   12   2HD1  ILE   1          2HD1      ILE   1 -15.260   5.135   7.958
   13   3HD1  ILE   1          3HD1      ILE   1 -15.348   5.047   6.199
   14    H    LEU   2           H        LEU   2 -15.584   2.519   3.155
   15    HA   LEU   2           HA       LEU   2 -13.436   2.390   2.181
   16   1HB   LEU   2          2HB       LEU   2 -12.921   2.521   5.156
   17   2HB   LEU   2          1HB       LEU   2 -11.600   2.518   3.988
   18    HG   LEU   2           HG       LEU   2 -13.898   4.498   4.014
   19   1HD1  LEU   2          1HD1      LEU   2 -11.628   4.390   5.658
   20   2HD1  LEU   2          2HD1      LEU   2 -12.662   5.794   5.388
   21   3HD1  LEU   2          3HD1      LEU   2 -11.218   5.558   4.403
   22   1HD2  LEU   2          1HD2      LEU   2 -11.806   5.515   2.505
   23   2HD2  LEU   2          2HD2      LEU   2 -13.260   4.758   1.852
   24   3HD2  LEU   2          3HD2      LEU   2 -11.796   3.803   2.085
   25    HA   PRO   3           HA       PRO   3 -13.153  -2.097   2.406
   26   1HB   PRO   3          2HB       PRO   3 -11.993  -2.380  -0.060
   27   2HB   PRO   3          1HB       PRO   3 -13.739  -2.160   0.169
   28   1HG   PRO   3          2HG       PRO   3 -11.669  -0.168  -0.612
   29   2HG   PRO   3          1HG       PRO   3 -13.327  -0.365  -1.204
   30   1HD   PRO   3          2HD       PRO   3 -12.613   1.538   0.603
   31   2HD   PRO   3          1HD       PRO   3 -14.234   0.807   0.543
   32    H    TRP   4           H        TRP   4 -11.187  -3.589   2.016
   33    HA   TRP   4           HA       TRP   4  -8.623  -2.156   2.635
   34   1HB   TRP   4          2HB       TRP   4  -9.339  -4.846   3.775
   35   2HB   TRP   4          1HB       TRP   4  -8.241  -3.631   4.424
   36    HD1  TRP   4           HD1      TRP   4 -12.028  -4.088   3.789
   37    HE1  TRP   4           1HE      TRP   4 -13.311  -2.826   5.639
   38    HE3  TRP   4           3HE      TRP   4  -8.111  -1.987   6.301
   39    HZ2  TRP   4           2HZ      TRP   4 -12.745  -1.151   7.888
   40    HZ3  TRP   4           3HZ      TRP   4  -8.508  -0.567   8.293
   41    HH2  TRP   4           HH2      TRP   4 -10.819  -0.147   9.089
   42    H    LYS   5           H        LYS   5  -9.285  -2.909   0.056
   43    HA   LYS   5           HA       LYS   5  -7.948  -5.504  -0.438
   44   1HB   LYS   5          2HB       LYS   5  -9.643  -3.617  -2.071
   45   2HB   LYS   5          1HB       LYS   5  -8.980  -5.117  -2.689
   46   1HG   LYS   5          2HG       LYS   5 -11.012  -4.751  -0.488
   47   2HG   LYS   5          1HG       LYS   5 -11.195  -5.663  -1.985
   48   1HD   LYS   5          2HD       LYS   5  -9.394  -6.366   0.350
   49   2HD   LYS   5          1HD       LYS   5 -10.850  -7.224  -0.154
   50   1HE   LYS   5          2HE       LYS   5  -9.684  -7.564  -2.423
   51   2HE   LYS   5          1HE       LYS   5  -8.195  -7.059  -1.598
   52   1HZ   LYS   5          1HZ       LYS   5  -8.592  -9.484  -1.466
   53   2HZ   LYS   5          2HZ       LYS   5 -10.025  -9.181  -0.607
   54   3HZ   LYS   5          3HZ       LYS   5  -8.525  -8.741   0.056
   55    H    TRP   6           H        TRP   6  -7.218  -2.287  -0.364
   56    HA   TRP   6           HA       TRP   6  -5.578  -1.885  -2.650
   57   1HB   TRP   6          2HB       TRP   6  -6.476  -0.120  -1.263
   58   2HB   TRP   6          1HB       TRP   6  -5.634  -0.734   0.143
   59    HD1  TRP   6           HD1      TRP   6  -3.002  -0.590   0.115
   60    HE1  TRP   6           1HE      TRP   6  -1.424   1.124  -1.045
   61    HE3  TRP   6           3HE      TRP   6  -6.218   1.235  -3.243
   62    HZ2  TRP   6           2HZ      TRP   6  -1.591   3.054  -3.202
   63    HZ3  TRP   6           3HZ      TRP   6  -5.558   3.012  -4.875
   64    HH2  TRP   6           HH2      TRP   6  -3.242   3.916  -4.854
   65    HA   PRO   7           HA       PRO   7  -2.063  -4.206  -1.309
   66   1HB   PRO   7          2HB       PRO   7  -0.365  -3.461  -3.314
   67   2HB   PRO   7          1HB       PRO   7  -1.742  -4.549  -3.562
   68   1HG   PRO   7          2HG       PRO   7  -1.386  -1.778  -4.424
   69   2HG   PRO   7          1HG       PRO   7  -2.536  -2.990  -4.995
   70   1HD   PRO   7          2HD       PRO   7  -2.985  -0.819  -3.145
   71   2HD   PRO   7          1HD       PRO   7  -4.163  -1.970  -3.813
   72    H    TRP   8           H        TRP   8   0.571  -3.696  -1.474
   73    HA   TRP   8           HA       TRP   8   2.165  -2.785   0.020
   74   1HB   TRP   8          2HB       TRP   8   1.428  -0.427  -1.706
   75   2HB   TRP   8          1HB       TRP   8   3.023  -0.934  -1.163
   76    HD1  TRP   8           HD1      TRP   8   0.643  -1.346  -3.945
   77    HE1  TRP   8           1HE      TRP   8   1.487  -3.132  -5.607
   78    HE3  TRP   8           3HE      TRP   8   4.356  -3.405  -1.161
   79    HZ2  TRP   8           2HZ      TRP   8   3.489  -5.181  -5.718
   80    HZ3  TRP   8           3HZ      TRP   8   5.724  -5.276  -2.049
   81    HH2  TRP   8           HH2      TRP   8   5.291  -6.168  -4.323
   82    H    TRP   9           H        TRP   9   1.012  -2.718   2.055
   83    HA   TRP   9           HA       TRP   9  -0.826  -0.905   3.006
   84   1HB   TRP   9          2HB       TRP   9  -0.081  -2.636   4.416
   85   2HB   TRP   9          1HB       TRP   9   1.606  -2.165   4.236
   86    HD1  TRP   9           HD1      TRP   9   2.387   0.065   5.474
   87    HE1  TRP   9           1HE      TRP   9   1.496   1.222   7.599
   88    HE3  TRP   9           3HE      TRP   9  -2.173  -2.126   5.759
   89    HZ2  TRP   9           2HZ      TRP   9  -0.882   1.207   9.211
   90    HZ3  TRP   9           3HZ      TRP   9  -3.752  -1.551   7.589
   91    HH2  TRP   9           HH2      TRP   9  -3.112   0.115   9.313
   92    HA   PRO  10           HA       PRO  10   1.307   2.968   2.913
   93   1HB   PRO  10          2HB       PRO  10  -0.698   4.439   4.050
   94   2HB   PRO  10          1HB       PRO  10  -0.791   3.800   2.399
   95   1HG   PRO  10          2HG       PRO  10  -2.279   2.994   4.765
   96   2HG   PRO  10          1HG       PRO  10  -2.570   2.599   3.067
   97   1HD   PRO  10          2HD       PRO  10  -1.280   0.999   5.124
   98   2HD   PRO  10          1HD       PRO  10  -1.810   0.513   3.500
   99    H    TRP  11           H        TRP  11   3.018   3.107   4.416
  100    HA   TRP  11           HA       TRP  11   2.352   3.242   7.303
  101   1HB   TRP  11          2HB       TRP  11   4.790   2.725   7.492
  102   2HB   TRP  11          1HB       TRP  11   3.910   1.527   6.562
  103    HD1  TRP  11           HD1      TRP  11   6.033   4.673   5.985
  104    HE1  TRP  11           1HE      TRP  11   7.218   4.412   3.694
  105    HE3  TRP  11           3HE      TRP  11   3.946   0.340   4.501
  106    HZ2  TRP  11           2HZ      TRP  11   7.240   2.543   1.497
  107    HZ3  TRP  11           3HZ      TRP  11   4.530  -0.701   2.309
  108    HH2  TRP  11           HH2      TRP  11   6.176   0.403   0.810
  109    H    ARG  12           H        ARG  12   4.473   4.659   8.242
  110    HA   ARG  12           HA       ARG  12   3.810   7.403   7.550
  111   1HB   ARG  12          2HB       ARG  12   4.342   6.696   9.826
  112   2HB   ARG  12          1HB       ARG  12   5.930   6.130   9.310
  113   1HG   ARG  12          2HG       ARG  12   6.769   8.190   9.634
  114   2HG   ARG  12          1HG       ARG  12   5.643   8.833   8.438
  115   1HD   ARG  12          2HD       ARG  12   5.158   8.509  11.418
  116   2HD   ARG  12          1HD       ARG  12   5.192  10.020  10.488
  117    HE   ARG  12           HE       ARG  12   3.271   8.537   9.184
  118   1HH1  ARG  12          1HH2      ARG  12   3.862   9.384  12.480
  119   2HH1  ARG  12          2HH2      ARG  12   2.183   9.403  12.909
  120   1HH2  ARG  12          2HH1      ARG  12   1.081   8.576   9.729
  121   2HH2  ARG  12          1HH1      ARG  12   0.611   8.947  11.354
  122    H    ARG  13           H        ARG  13   4.703   6.348   5.178
  123    HA   ARG  13           HA       ARG  13   6.362   6.561   3.496
  124   1HB   ARG  13          2HB       ARG  13   5.608   8.927   4.428
  125   2HB   ARG  13          1HB       ARG  13   7.274   8.989   5.007
  126   1HG   ARG  13          2HG       ARG  13   8.113   9.254   2.917
  127   2HG   ARG  13          1HG       ARG  13   7.021   8.049   2.231
  128   1HD   ARG  13          2HD       ARG  13   6.172   9.973   1.227
  129   2HD   ARG  13          1HD       ARG  13   5.211   9.972   2.719
  130    HE   ARG  13           HE       ARG  13   7.840  11.351   2.776
  131   1HH1  ARG  13          1HH1      ARG  13   5.924  12.963   1.180
  132   2HH1  ARG  13          2HH1      ARG  13   5.147  13.930   2.388
  133   1HH2  ARG  13          1HH2      ARG  13   6.188  11.938   5.029
  134   2HH2  ARG  13          2HH2      ARG  13   5.295  13.349   4.569
  135   1HN   NH2  14          1HT       ARG  13   8.920   8.187   4.356
  136   2HN   NH2  14          2HT       ARG  13   9.894   7.012   5.104
  Start of MODEL   13
    1   1H    ILE   1          1H        ILE   1 -18.296   0.758   3.519
    2   2H    ILE   1          2H        ILE   1 -19.049   1.474   4.864
    3   3H    ILE   1          3H        ILE   1 -17.819   0.323   5.088
    4    HA   ILE   1           HA       ILE   1 -17.557   3.105   4.098
    5    HB   ILE   1           HB       ILE   1 -15.914   1.706   6.173
    6   1HG1  ILE   1          2HG1      ILE   1 -18.269   1.123   6.716
    7   2HG1  ILE   1          1HG1      ILE   1 -17.583   2.234   7.901
    8   1HG2  ILE   1          1HG2      ILE   1 -16.708   4.245   7.021
    9   2HG2  ILE   1          2HG2      ILE   1 -16.478   4.418   5.281
   10   3HG2  ILE   1          3HG2      ILE   1 -15.157   3.828   6.290
   11   1HD1  ILE   1          1HD1      ILE   1 -19.973   2.684   6.808
   12   2HD1  ILE   1          2HD1      ILE   1 -18.987   3.411   5.539
   13   3HD1  ILE   1          3HD1      ILE   1 -18.879   4.012   7.193
   14    H    LEU   2           H        LEU   2 -14.827   3.280   4.298
   15    HA   LEU   2           HA       LEU   2 -13.729   2.539   1.905
   16   1HB   LEU   2          2HB       LEU   2 -11.568   2.686   3.060
   17   2HB   LEU   2          1HB       LEU   2 -12.680   3.888   3.718
   18    HG   LEU   2           HG       LEU   2 -13.203   1.670   5.279
   19   1HD1  LEU   2          1HD1      LEU   2 -10.624   1.308   4.065
   20   2HD1  LEU   2          2HD1      LEU   2 -11.442   0.272   5.234
   21   3HD1  LEU   2          3HD1      LEU   2 -10.412   1.590   5.794
   22   1HD2  LEU   2          1HD2      LEU   2 -11.929   2.910   7.019
   23   2HD2  LEU   2          2HD2      LEU   2 -12.957   3.983   6.070
   24   3HD2  LEU   2          3HD2      LEU   2 -11.222   3.921   5.759
   25    HA   PRO   3           HA       PRO   3 -13.685  -1.893   1.975
   26   1HB   PRO   3          2HB       PRO   3 -12.172  -2.249  -0.278
   27   2HB   PRO   3          1HB       PRO   3 -13.880  -1.771  -0.330
   28   1HG   PRO   3          2HG       PRO   3 -11.439  -0.111  -0.663
   29   2HG   PRO   3          1HG       PRO   3 -13.001  -0.002  -1.489
   30   1HD   PRO   3          2HD       PRO   3 -12.225   1.655   0.553
   31   2HD   PRO   3          1HD       PRO   3 -13.919   1.297   0.148
   32    H    TRP   4           H        TRP   4 -11.599  -3.511   1.277
   33    HA   TRP   4           HA       TRP   4  -9.140  -2.483   2.599
   34   1HB   TRP   4          2HB       TRP   4  -9.538  -5.056   3.653
   35   2HB   TRP   4          1HB       TRP   4  -9.654  -3.530   4.521
   36    HD1  TRP   4           HD1      TRP   4 -11.821  -6.108   2.688
   37    HE1  TRP   4           1HE      TRP   4 -14.263  -5.834   3.476
   38    HE3  TRP   4           3HE      TRP   4 -11.351  -1.914   5.552
   39    HZ2  TRP   4           2HZ      TRP   4 -15.812  -4.061   5.105
   40    HZ3  TRP   4           3HZ      TRP   4 -13.321  -0.950   6.710
   41    HH2  TRP   4           HH2      TRP   4 -15.548  -2.017   6.488
   42    H    LYS   5           H        LYS   5  -9.079  -2.876   0.001
   43    HA   LYS   5           HA       LYS   5  -7.811  -5.556  -0.368
   44   1HB   LYS   5          2HB       LYS   5 -10.058  -4.270  -1.670
   45   2HB   LYS   5          1HB       LYS   5  -8.791  -4.639  -2.840
   46   1HG   LYS   5          2HG       LYS   5  -8.866  -6.940  -2.389
   47   2HG   LYS   5          1HG       LYS   5  -9.634  -6.700  -0.818
   48   1HD   LYS   5          2HD       LYS   5 -11.688  -6.821  -1.729
   49   2HD   LYS   5          1HD       LYS   5 -11.279  -5.595  -2.930
   50   1HE   LYS   5          2HE       LYS   5  -9.985  -7.517  -4.133
   51   2HE   LYS   5          1HE       LYS   5 -10.979  -8.591  -3.129
   52   1HZ   LYS   5          1HZ       LYS   5 -12.346  -6.349  -4.387
   53   2HZ   LYS   5          2HZ       LYS   5 -12.880  -7.942  -4.136
   54   3HZ   LYS   5          3HZ       LYS   5 -11.840  -7.585  -5.430
   55    H    TRP   6           H        TRP   6  -7.033  -2.512   0.004
   56    HA   TRP   6           HA       TRP   6  -5.525  -1.830  -2.346
   57   1HB   TRP   6          2HB       TRP   6  -6.437  -0.215  -0.789
   58   2HB   TRP   6          1HB       TRP   6  -5.524  -0.914   0.532
   59    HD1  TRP   6           HD1      TRP   6  -2.903  -0.666   0.443
   60    HE1  TRP   6           1HE      TRP   6  -1.417   1.162  -0.659
   61    HE3  TRP   6           3HE      TRP   6  -6.279   1.254  -2.701
   62    HZ2  TRP   6           2HZ      TRP   6  -1.708   3.210  -2.686
   63    HZ3  TRP   6           3HZ      TRP   6  -5.720   3.144  -4.243
   64    HH2  TRP   6           HH2      TRP   6  -3.432   4.117  -4.234
   65    HA   PRO   7           HA       PRO   7  -1.914  -4.146  -1.249
   66   1HB   PRO   7          2HB       PRO   7  -0.351  -3.292  -3.330
   67   2HB   PRO   7          1HB       PRO   7  -1.708  -4.416  -3.531
   68   1HG   PRO   7          2HG       PRO   7  -1.481  -1.620  -4.342
   69   2HG   PRO   7          1HG       PRO   7  -2.639  -2.845  -4.864
   70   1HD   PRO   7          2HD       PRO   7  -2.997  -0.730  -2.922
   71   2HD   PRO   7          1HD       PRO   7  -4.199  -1.867  -3.567
   72    H    TRP   8           H        TRP   8   0.720  -3.469  -1.606
   73    HA   TRP   8           HA       TRP   8   2.369  -2.520  -0.206
   74   1HB   TRP   8          2HB       TRP   8   1.267  -0.150  -1.709
   75   2HB   TRP   8          1HB       TRP   8   2.942  -0.499  -1.298
   76    HD1  TRP   8           HD1      TRP   8   0.464  -0.997  -3.960
   77    HE1  TRP   8           1HE      TRP   8   1.379  -2.591  -5.773
   78    HE3  TRP   8           3HE      TRP   8   4.497  -2.844  -1.499
   79    HZ2  TRP   8           2HZ      TRP   8   3.557  -4.424  -6.112
   80    HZ3  TRP   8           3HZ      TRP   8   5.986  -4.515  -2.569
   81    HH2  TRP   8           HH2      TRP   8   5.517  -5.311  -4.872
   82    H    TRP   9           H        TRP   9   1.421  -2.668   1.925
   83    HA   TRP   9           HA       TRP   9  -0.435  -1.131   3.221
   84   1HB   TRP   9          2HB       TRP   9   0.712  -2.785   4.429
   85   2HB   TRP   9          1HB       TRP   9   2.289  -2.123   4.008
   86    HD1  TRP   9           HD1      TRP   9   2.983   0.192   5.186
   87    HE1  TRP   9           1HE      TRP   9   2.342   1.148   7.497
   88    HE3  TRP   9           3HE      TRP   9  -1.117  -2.629   6.157
   89    HZ2  TRP   9           2HZ      TRP   9   0.324   0.751   9.500
   90    HZ3  TRP   9           3HZ      TRP   9  -2.397  -2.338   8.265
   91    HH2  TRP   9           HH2      TRP   9  -1.682  -0.648   9.935
   92    HA   PRO  10           HA       PRO  10   1.141   2.995   3.038
   93   1HB   PRO  10          2HB       PRO  10  -0.795   4.134   4.599
   94   2HB   PRO  10          1HB       PRO  10  -1.099   3.558   2.951
   95   1HG   PRO  10          2HG       PRO  10  -2.031   2.464   5.477
   96   2HG   PRO  10          1HG       PRO  10  -2.561   2.095   3.832
   97   1HD   PRO  10          2HD       PRO  10  -0.730   0.618   5.540
   98   2HD   PRO  10          1HD       PRO  10  -1.475   0.116   4.011
   99    H    TRP  11           H        TRP  11   3.018   3.477   4.201
  100    HA   TRP  11           HA       TRP  11   2.878   3.454   7.173
  101   1HB   TRP  11          2HB       TRP  11   5.274   2.984   7.011
  102   2HB   TRP  11          1HB       TRP  11   4.373   1.829   6.058
  103    HD1  TRP  11           HD1      TRP  11   6.405   5.046   5.641
  104    HE1  TRP  11           1HE      TRP  11   7.337   5.075   3.221
  105    HE3  TRP  11           3HE      TRP  11   4.095   0.946   3.852
  106    HZ2  TRP  11           2HZ      TRP  11   7.088   3.503   0.810
  107    HZ3  TRP  11           3HZ      TRP  11   4.423   0.195   1.493
  108    HH2  TRP  11           HH2      TRP  11   5.917   1.474  -0.023
  109    H    ARG  12           H        ARG  12   5.114   4.974   7.676
  110    HA   ARG  12           HA       ARG  12   4.177   7.677   7.258
  111   1HB   ARG  12          2HB       ARG  12   5.389   6.864   9.258
  112   2HB   ARG  12          1HB       ARG  12   6.817   6.567   8.268
  113   1HG   ARG  12          2HG       ARG  12   5.932   9.244   7.776
  114   2HG   ARG  12          1HG       ARG  12   6.031   9.005   9.522
  115   1HD   ARG  12          2HD       ARG  12   8.349   7.993   9.125
  116   2HD   ARG  12          1HD       ARG  12   8.234   8.633   7.474
  117    HE   ARG  12           HE       ARG  12   7.804  10.894   8.567
  118   1HH1  ARG  12          1HH2      ARG  12  10.448   9.077   9.214
  119   2HH1  ARG  12          2HH2      ARG  12  10.822   9.778  10.753
  120   1HH2  ARG  12          2HH1      ARG  12   7.819  11.490  11.003
  121   2HH2  ARG  12          1HH1      ARG  12   9.335  11.145  11.765
  122    H    ARG  13           H        ARG  13   4.390   6.781   4.700
  123    HA   ARG  13           HA       ARG  13   7.003   7.208   3.499
  124   1HB   ARG  13          2HB       ARG  13   4.736   5.957   2.771
  125   2HB   ARG  13          1HB       ARG  13   4.463   7.498   1.957
  126   1HG   ARG  13          2HG       ARG  13   7.121   6.121   1.689
  127   2HG   ARG  13          1HG       ARG  13   5.762   5.603   0.695
  128   1HD   ARG  13          2HD       ARG  13   5.557   7.754  -0.330
  129   2HD   ARG  13          1HD       ARG  13   6.623   8.504   0.875
  130    HE   ARG  13           HE       ARG  13   7.498   6.704  -1.316
  131   1HH1  ARG  13          1HH1      ARG  13   8.223   8.085   1.741
  132   2HH1  ARG  13          2HH1      ARG  13   9.907   8.297   1.403
  133   1HH2  ARG  13          1HH2      ARG  13   9.668   7.161  -1.863
  134   2HH2  ARG  13          2HH2      ARG  13  10.727   7.773  -0.637
  135   1HN   NH2  14          1HT       ARG  13   3.973   9.195   3.458
  136   2HN   NH2  14          2HT       ARG  13   4.760  10.665   3.143
  Start of MODEL   14
    1   1H    ILE   1          1H        ILE   1 -19.039  -0.183  -1.076
    2   2H    ILE   1          2H        ILE   1 -19.258  -0.177   0.608
    3   3H    ILE   1          3H        ILE   1 -17.902  -0.946  -0.073
    4    HA   ILE   1           HA       ILE   1 -17.381   1.405  -1.020
    5    HB   ILE   1           HB       ILE   1 -18.983   2.065   1.442
    6   1HG1  ILE   1          2HG1      ILE   1 -20.480   1.011  -0.236
    7   2HG1  ILE   1          1HG1      ILE   1 -20.827   2.729  -0.041
    8   1HG2  ILE   1          1HG2      ILE   1 -18.747   4.299   0.748
    9   2HG2  ILE   1          2HG2      ILE   1 -18.372   3.839  -0.912
   10   3HG2  ILE   1          3HG2      ILE   1 -17.178   3.594   0.364
   11   1HD1  ILE   1          1HD1      ILE   1 -19.666   3.286  -2.061
   12   2HD1  ILE   1          2HD1      ILE   1 -20.699   1.911  -2.450
   13   3HD1  ILE   1          3HD1      ILE   1 -18.972   1.669  -2.184
   14    H    LEU   2           H        LEU   2 -15.632   2.486   0.159
   15    HA   LEU   2           HA       LEU   2 -13.758   2.436   1.600
   16   1HB   LEU   2          2HB       LEU   2 -15.878   1.340   3.478
   17   2HB   LEU   2          1HB       LEU   2 -14.387   2.155   3.951
   18    HG   LEU   2           HG       LEU   2 -16.708   3.361   2.421
   19   1HD1  LEU   2          1HD1      LEU   2 -17.392   3.694   4.567
   20   2HD1  LEU   2          2HD1      LEU   2 -16.162   4.958   4.581
   21   3HD1  LEU   2          3HD1      LEU   2 -15.792   3.359   5.226
   22   1HD2  LEU   2          1HD2      LEU   2 -14.860   4.415   1.446
   23   2HD2  LEU   2          2HD2      LEU   2 -13.890   4.291   2.914
   24   3HD2  LEU   2          3HD2      LEU   2 -15.195   5.475   2.815
   25    HA   PRO   3           HA       PRO   3 -13.434  -2.161   0.945
   26   1HB   PRO   3          2HB       PRO   3 -11.353  -2.041  -0.827
   27   2HB   PRO   3          1HB       PRO   3 -13.053  -1.960  -1.327
   28   1HG   PRO   3          2HG       PRO   3 -11.074   0.235  -0.993
   29   2HG   PRO   3          1HG       PRO   3 -12.329   0.024  -2.223
   30   1HD   PRO   3          2HD       PRO   3 -12.583   1.703  -0.090
   31   2HD   PRO   3          1HD       PRO   3 -13.960   0.929  -0.900
   32    H    TRP   4           H        TRP   4 -11.328  -3.460   1.264
   33    HA   TRP   4           HA       TRP   4  -9.223  -1.986   2.759
   34   1HB   TRP   4          2HB       TRP   4  -9.987  -4.414   4.157
   35   2HB   TRP   4          1HB       TRP   4  -9.854  -2.777   4.785
   36    HD1  TRP   4           HD1      TRP   4 -12.349  -5.184   3.175
   37    HE1  TRP   4           1HE      TRP   4 -14.739  -4.328   3.633
   38    HE3  TRP   4           3HE      TRP   4 -11.275  -0.684   5.336
   39    HZ2  TRP   4           2HZ      TRP   4 -16.024  -2.035   4.765
   40    HZ3  TRP   4           3HZ      TRP   4 -13.096   0.816   6.093
   41    HH2  TRP   4           HH2      TRP   4 -15.468   0.147   5.811
   42    H    LYS   5           H        LYS   5  -9.094  -3.180   0.254
   43    HA   LYS   5           HA       LYS   5  -7.353  -5.560   0.774
   44   1HB   LYS   5          2HB       LYS   5  -9.672  -5.090  -0.960
   45   2HB   LYS   5          1HB       LYS   5  -8.291  -5.769  -1.816
   46   1HG   LYS   5          2HG       LYS   5  -8.311  -7.732  -0.574
   47   2HG   LYS   5          1HG       LYS   5  -9.060  -6.956   0.823
   48   1HD   LYS   5          2HD       LYS   5 -11.197  -7.122  -0.052
   49   2HD   LYS   5          1HD       LYS   5 -10.627  -7.105  -1.721
   50   1HE   LYS   5          2HE       LYS   5  -9.868  -9.426   0.030
   51   2HE   LYS   5          1HE       LYS   5 -11.495  -9.371  -0.675
   52   1HZ   LYS   5          1HZ       LYS   5 -10.678  -9.354  -2.807
   53   2HZ   LYS   5          2HZ       LYS   5  -9.532 -10.353  -2.048
   54   3HZ   LYS   5          3HZ       LYS   5  -9.172  -8.721  -2.354
   55    H    TRP   6           H        TRP   6  -7.081  -2.498   0.208
   56    HA   TRP   6           HA       TRP   6  -5.795  -2.064  -2.261
   57   1HB   TRP   6          2HB       TRP   6  -6.625  -0.339  -0.792
   58   2HB   TRP   6          1HB       TRP   6  -5.543  -0.839   0.489
   59    HD1  TRP   6           HD1      TRP   6  -2.971  -0.487   0.082
   60    HE1  TRP   6           1HE      TRP   6  -1.716   1.313  -1.324
   61    HE3  TRP   6           3HE      TRP   6  -6.775   0.999  -2.807
   62    HZ2  TRP   6           2HZ      TRP   6  -2.345   3.164  -3.462
   63    HZ3  TRP   6           3HZ      TRP   6  -6.494   2.774  -4.545
   64    HH2  TRP   6           HH2      TRP   6  -4.276   3.854  -4.870
   65    HA   PRO   7           HA       PRO   7  -1.925  -4.027  -1.473
   66   1HB   PRO   7          2HB       PRO   7  -0.593  -3.084  -3.680
   67   2HB   PRO   7          1HB       PRO   7  -1.865  -4.313  -3.752
   68   1HG   PRO   7          2HG       PRO   7  -1.929  -1.527  -4.612
   69   2HG   PRO   7          1HG       PRO   7  -3.024  -2.850  -5.019
   70   1HD   PRO   7          2HD       PRO   7  -3.400  -0.733  -3.094
   71   2HD   PRO   7          1HD       PRO   7  -4.546  -1.989  -3.606
   72    H    TRP   8           H        TRP   8   0.633  -3.132  -2.105
   73    HA   TRP   8           HA       TRP   8   2.330  -2.111  -0.807
   74   1HB   TRP   8          2HB       TRP   8   0.996   0.338  -1.924
   75   2HB   TRP   8          1HB       TRP   8   2.705  -0.080  -1.876
   76    HD1  TRP   8           HD1      TRP   8  -0.333  -0.395  -3.974
   77    HE1  TRP   8           1HE      TRP   8   0.197  -1.718  -6.128
   78    HE3  TRP   8           3HE      TRP   8   4.252  -2.182  -2.751
   79    HZ2  TRP   8           2HZ      TRP   8   2.317  -3.343  -7.175
   80    HZ3  TRP   8           3HZ      TRP   8   5.519  -3.622  -4.323
   81    HH2  TRP   8           HH2      TRP   8   4.554  -4.208  -6.532
   82    H    TRP   9           H        TRP   9   1.443  -2.552   1.362
   83    HA   TRP   9           HA       TRP   9  -0.379  -1.201   2.881
   84   1HB   TRP   9          2HB       TRP   9   0.763  -2.877   3.983
   85   2HB   TRP   9          1HB       TRP   9   2.326  -2.349   3.371
   86    HD1  TRP   9           HD1      TRP   9   3.314  -0.068   4.464
   87    HE1  TRP   9           1HE      TRP   9   3.136   0.801   6.887
   88    HE3  TRP   9           3HE      TRP   9  -0.687  -2.767   6.029
   89    HZ2  TRP   9           2HZ      TRP   9   1.480   0.387   9.200
   90    HZ3  TRP   9           3HZ      TRP   9  -1.562  -2.525   8.340
   91    HH2  TRP   9           HH2      TRP   9  -0.486  -0.947   9.923
   92    HA   PRO  10           HA       PRO  10   1.100   2.957   3.120
   93   1HB   PRO  10          2HB       PRO  10  -0.756   3.842   4.921
   94   2HB   PRO  10          1HB       PRO  10  -1.156   3.457   3.238
   95   1HG   PRO  10          2HG       PRO  10  -1.894   2.040   5.665
   96   2HG   PRO  10          1HG       PRO  10  -2.527   1.858   4.026
   97   1HD   PRO  10          2HD       PRO  10  -0.556   0.235   5.419
   98   2HD   PRO  10          1HD       PRO  10  -1.390  -0.093   3.887
   99    H    TRP  11           H        TRP  11   2.883   3.662   4.279
  100    HA   TRP  11           HA       TRP  11   3.165   2.858   7.124
  101   1HB   TRP  11          2HB       TRP  11   5.558   3.292   6.635
  102   2HB   TRP  11          1HB       TRP  11   4.867   2.142   5.509
  103    HD1  TRP  11           HD1      TRP  11   5.588   5.906   5.738
  104    HE1  TRP  11           1HE      TRP  11   6.042   6.758   3.328
  105    HE3  TRP  11           3HE      TRP  11   4.653   1.655   3.208
  106    HZ2  TRP  11           2HZ      TRP  11   5.992   5.702   0.640
  107    HZ3  TRP  11           3HZ      TRP  11   4.847   1.554   0.719
  108    HH2  TRP  11           HH2      TRP  11   5.513   3.577  -0.561
  109    H    ARG  12           H        ARG  12   4.955   4.808   7.919
  110    HA   ARG  12           HA       ARG  12   3.458   7.368   7.553
  111   1HB   ARG  12          2HB       ARG  12   3.094   6.020   9.706
  112   2HB   ARG  12          1HB       ARG  12   4.769   6.411  10.105
  113   1HG   ARG  12          2HG       ARG  12   4.334   8.733  10.164
  114   2HG   ARG  12          1HG       ARG  12   2.792   8.547   9.326
  115   1HD   ARG  12          2HD       ARG  12   1.673   8.050  11.256
  116   2HD   ARG  12          1HD       ARG  12   2.993   7.029  11.861
  117    HE   ARG  12           HE       ARG  12   3.844   8.924  12.977
  118   1HH1  ARG  12          2HH1      ARG  12   0.980   9.880  11.625
  119   2HH1  ARG  12          1HH1      ARG  12   1.407  11.545  11.409
  120   1HH2  ARG  12          1HH2      ARG  12   4.757  11.058  12.158
  121   2HH2  ARG  12          2HH2      ARG  12   3.545  12.212  11.710
  122    H    ARG  13           H        ARG  13   5.256   7.728   5.927
  123    HA   ARG  13           HA       ARG  13   7.775   8.616   7.301
  124   1HB   ARG  13          2HB       ARG  13   7.916   6.580   5.818
  125   2HB   ARG  13          1HB       ARG  13   7.419   7.596   4.466
  126   1HG   ARG  13          2HG       ARG  13   9.510   8.385   4.217
  127   2HG   ARG  13          1HG       ARG  13   9.576   8.862   5.914
  128   1HD   ARG  13          2HD       ARG  13   9.860   6.186   6.205
  129   2HD   ARG  13          1HD       ARG  13  10.608   6.395   4.610
  130    HE   ARG  13           HE       ARG  13  11.835   7.200   7.028
  131   1HH1  ARG  13          1HH1      ARG  13  12.792   7.348   4.049
  132   2HH1  ARG  13          2HH1      ARG  13  13.250   9.017   3.976
  133   1HH2  ARG  13          1HH2      ARG  13  11.621   9.868   6.916
  134   2HH2  ARG  13          2HH2      ARG  13  12.588  10.444   5.599
  135   1HN   NH2  14          1HT       ARG  13   8.809  10.546   6.206
  136   2HN   NH2  14          2HT       ARG  13   7.831  11.652   5.368
  Start of MODEL   15
    1   1H    ILE   1          1H        ILE   1 -20.458   0.388   0.980
    2   2H    ILE   1          2H        ILE   1 -19.096   1.204   1.583
    3   3H    ILE   1          3H        ILE   1 -19.009  -0.457   1.236
    4    HA   ILE   1           HA       ILE   1 -19.230  -0.043  -1.107
    5    HB   ILE   1           HB       ILE   1 -19.539   2.800  -0.153
    6   1HG1  ILE   1          2HG1      ILE   1 -21.751   2.014  -1.689
    7   2HG1  ILE   1          1HG1      ILE   1 -21.424   0.645  -0.626
    8   1HG2  ILE   1          1HG2      ILE   1 -18.447   2.920  -2.252
    9   2HG2  ILE   1          2HG2      ILE   1 -20.158   3.110  -2.641
   10   3HG2  ILE   1          3HG2      ILE   1 -19.363   1.557  -2.895
   11   1HD1  ILE   1          1HD1      ILE   1 -22.219   1.760   1.161
   12   2HD1  ILE   1          2HD1      ILE   1 -22.748   3.032   0.059
   13   3HD1  ILE   1          3HD1      ILE   1 -21.165   3.135   0.828
   14    H    LEU   2           H        LEU   2 -17.236   0.193   1.266
   15    HA   LEU   2           HA       LEU   2 -14.964   1.222  -0.393
   16   1HB   LEU   2          2HB       LEU   2 -15.305   1.643   2.587
   17   2HB   LEU   2          1HB       LEU   2 -14.140   2.423   1.519
   18    HG   LEU   2           HG       LEU   2 -17.150   2.751   1.369
   19   1HD1  LEU   2          1HD1      LEU   2 -14.994   4.710   2.214
   20   2HD1  LEU   2          2HD1      LEU   2 -16.063   3.856   3.327
   21   3HD1  LEU   2          3HD1      LEU   2 -16.731   5.015   2.178
   22   1HD2  LEU   2          1HD2      LEU   2 -15.593   4.732  -0.030
   23   2HD2  LEU   2          2HD2      LEU   2 -16.815   3.636  -0.676
   24   3HD2  LEU   2          3HD2      LEU   2 -15.129   3.124  -0.586
   25    HA   PRO   3           HA       PRO   3 -13.740  -2.918   0.893
   26   1HB   PRO   3          2HB       PRO   3 -11.663  -3.108  -0.879
   27   2HB   PRO   3          1HB       PRO   3 -13.352  -3.393  -1.339
   28   1HG   PRO   3          2HG       PRO   3 -11.662  -0.979  -1.748
   29   2HG   PRO   3          1HG       PRO   3 -12.854  -1.719  -2.828
   30   1HD   PRO   3          2HD       PRO   3 -13.363   0.500  -1.330
   31   2HD   PRO   3          1HD       PRO   3 -14.617  -0.660  -1.821
   32    H    TRP   4           H        TRP   4 -11.376  -3.771   1.401
   33    HA   TRP   4           HA       TRP   4  -9.590  -1.620   2.416
   34   1HB   TRP   4          2HB       TRP   4 -10.058  -3.783   4.354
   35   2HB   TRP   4          1HB       TRP   4  -9.985  -2.045   4.619
   36    HD1  TRP   4           HD1      TRP   4 -12.430  -4.723   3.305
   37    HE1  TRP   4           1HE      TRP   4 -14.838  -3.927   3.794
   38    HE3  TRP   4           3HE      TRP   4 -11.456  -0.104   5.245
   39    HZ2  TRP   4           2HZ      TRP   4 -16.169  -1.634   4.869
   40    HZ3  TRP   4           3HZ      TRP   4 -13.307   1.365   5.993
   41    HH2  TRP   4           HH2      TRP   4 -15.660   0.608   5.807
   42    H    LYS   5           H        LYS   5  -9.150  -3.334   0.283
   43    HA   LYS   5           HA       LYS   5  -7.135  -5.258   1.376
   44   1HB   LYS   5          2HB       LYS   5  -9.279  -5.400  -0.665
   45   2HB   LYS   5          1HB       LYS   5  -7.766  -6.199  -1.074
   46   1HG   LYS   5          2HG       LYS   5  -8.043  -7.820   0.515
   47   2HG   LYS   5          1HG       LYS   5  -8.736  -6.687   1.678
   48   1HD   LYS   5          2HD       LYS   5 -10.770  -7.510   1.191
   49   2HD   LYS   5          1HD       LYS   5 -10.597  -6.862  -0.439
   50   1HE   LYS   5          2HE       LYS   5 -10.372  -8.947  -1.299
   51   2HE   LYS   5          1HE       LYS   5  -9.076  -9.327  -0.146
   52   1HZ   LYS   5          1HZ       LYS   5 -10.740  -9.698   1.561
   53   2HZ   LYS   5          2HZ       LYS   5 -11.036 -10.715   0.233
   54   3HZ   LYS   5          3HZ       LYS   5 -11.985  -9.326   0.472
   55    H    TRP   6           H        TRP   6  -7.198  -2.365   0.194
   56    HA   TRP   6           HA       TRP   6  -5.885  -2.091  -2.219
   57   1HB   TRP   6          2HB       TRP   6  -6.696  -0.267  -0.902
   58   2HB   TRP   6          1HB       TRP   6  -5.646  -0.678   0.437
   59    HD1  TRP   6           HD1      TRP   6  -3.058  -0.384   0.042
   60    HE1  TRP   6           1HE      TRP   6  -1.771   1.337  -1.430
   61    HE3  TRP   6           3HE      TRP   6  -6.809   0.981  -2.968
   62    HZ2  TRP   6           2HZ      TRP   6  -2.357   3.088  -3.661
   63    HZ3  TRP   6           3HZ      TRP   6  -6.493   2.672  -4.783
   64    HH2  TRP   6           HH2      TRP   6  -4.264   3.720  -5.128
   65    HA   PRO   7           HA       PRO   7  -1.959  -3.936  -1.457
   66   1HB   PRO   7          2HB       PRO   7  -0.679  -3.034  -3.713
   67   2HB   PRO   7          1HB       PRO   7  -1.923  -4.293  -3.724
   68   1HG   PRO   7          2HG       PRO   7  -2.066  -1.524  -4.649
   69   2HG   PRO   7          1HG       PRO   7  -3.108  -2.894  -5.038
   70   1HD   PRO   7          2HD       PRO   7  -3.601  -0.754  -3.188
   71   2HD   PRO   7          1HD       PRO   7  -4.667  -2.108  -3.619
   72    H    TRP   8           H        TRP   8   0.579  -2.985  -2.184
   73    HA   TRP   8           HA       TRP   8   2.280  -1.906  -0.931
   74   1HB   TRP   8          2HB       TRP   8   0.901   0.531  -1.988
   75   2HB   TRP   8          1HB       TRP   8   2.598   0.077  -2.074
   76    HD1  TRP   8           HD1      TRP   8  -0.653  -0.255  -3.871
   77    HE1  TRP   8           1HE      TRP   8  -0.309  -1.516  -6.099
   78    HE3  TRP   8           3HE      TRP   8   4.098  -1.898  -3.181
   79    HZ2  TRP   8           2HZ      TRP   8   1.741  -3.040  -7.402
   80    HZ3  TRP   8           3HZ      TRP   8   5.239  -3.257  -4.916
   81    HH2  TRP   8           HH2      TRP   8   4.063  -3.832  -7.024
   82    H    TRP   9           H        TRP   9   1.349  -2.389   1.249
   83    HA   TRP   9           HA       TRP   9  -0.463  -0.934   2.727
   84   1HB   TRP   9          2HB       TRP   9   0.527  -2.802   3.720
   85   2HB   TRP   9          1HB       TRP   9   2.155  -2.250   3.343
   86    HD1  TRP   9           HD1      TRP   9   3.079  -0.158   4.773
   87    HE1  TRP   9           1HE      TRP   9   2.588   0.535   7.212
   88    HE3  TRP   9           3HE      TRP   9  -1.231  -2.726   5.525
   89    HZ2  TRP   9           2HZ      TRP   9   0.595   0.049   9.221
   90    HZ3  TRP   9           3HZ      TRP   9  -2.422  -2.607   7.701
   91    HH2  TRP   9           HH2      TRP   9  -1.516  -1.219   9.546
   92    HA   PRO  10           HA       PRO  10   1.397   3.054   3.167
   93   1HB   PRO  10          2HB       PRO  10  -0.480   4.073   4.877
   94   2HB   PRO  10          1HB       PRO  10  -0.804   3.777   3.158
   95   1HG   PRO  10          2HG       PRO  10  -1.839   2.379   5.485
   96   2HG   PRO  10          1HG       PRO  10  -2.371   2.300   3.802
   97   1HD   PRO  10          2HD       PRO  10  -0.666   0.461   5.272
   98   2HD   PRO  10          1HD       PRO  10  -1.425   0.246   3.683
   99    H    TRP  11           H        TRP  11   3.273   3.230   4.413
  100    HA   TRP  11           HA       TRP  11   3.139   2.560   7.302
  101   1HB   TRP  11          2HB       TRP  11   5.613   2.385   6.977
  102   2HB   TRP  11          1HB       TRP  11   4.706   1.313   5.929
  103    HD1  TRP  11           HD1      TRP  11   6.362   4.769   5.838
  104    HE1  TRP  11           1HE      TRP  11   7.114   5.219   3.397
  105    HE3  TRP  11           3HE      TRP  11   4.447   0.661   3.647
  106    HZ2  TRP  11           2HZ      TRP  11   6.894   3.938   0.821
  107    HZ3  TRP  11           3HZ      TRP  11   4.703   0.254   1.200
  108    HH2  TRP  11           HH2      TRP  11   5.925   1.894  -0.213
  109    H    ARG  12           H        ARG  12   5.252   4.017   8.225
  110    HA   ARG  12           HA       ARG  12   5.627   6.143   9.180
  111   1HB   ARG  12          2HB       ARG  12   6.929   6.105   7.121
  112   2HB   ARG  12          1HB       ARG  12   5.514   6.591   6.188
  113   1HG   ARG  12          2HG       ARG  12   5.575   8.551   8.070
  114   2HG   ARG  12          1HG       ARG  12   7.297   8.210   7.895
  115   1HD   ARG  12          2HD       ARG  12   6.615   8.268   5.282
  116   2HD   ARG  12          1HD       ARG  12   5.399   9.390   5.925
  117    HE   ARG  12           HE       ARG  12   8.318   9.700   6.524
  118   1HH1  ARG  12          1HH2      ARG  12   5.720  11.218   7.594
  119   2HH1  ARG  12          2HH2      ARG  12   5.961  12.735   6.796
  120   1HH2  ARG  12          2HH1      ARG  12   8.417  11.528   4.666
  121   2HH2  ARG  12          1HH1      ARG  12   7.489  12.911   5.138
  122    H    ARG  13           H        ARG  13   3.260   6.044   9.999
  123    HA   ARG  13           HA       ARG  13   1.094   7.318   8.682
  124   1HB   ARG  13          2HB       ARG  13   1.732   6.180  11.186
  125   2HB   ARG  13          1HB       ARG  13   1.144   7.805  11.540
  126   1HG   ARG  13          2HG       ARG  13  -0.750   7.197   9.826
  127   2HG   ARG  13          1HG       ARG  13  -0.281   5.535  10.182
  128   1HD   ARG  13          2HD       ARG  13  -0.413   6.552  12.711
  129   2HD   ARG  13          1HD       ARG  13  -1.682   7.495  11.904
  130    HE   ARG  13           HE       ARG  13  -1.678   4.597  11.341
  131   1HH1  ARG  13          1HH1      ARG  13  -2.321   5.743  14.248
  132   2HH1  ARG  13          2HH1      ARG  13  -4.048   5.620  14.201
  133   1HH2  ARG  13          1HH2      ARG  13  -4.180   5.089  10.775
  134   2HH2  ARG  13          2HH2      ARG  13  -5.099   5.250  12.234
  135   1HN   NH2  14          1HT       ARG  13   0.185   9.516   9.962
  136   2HN   NH2  14          2HT       ARG  13   1.285  10.808   9.907
  Start of MODEL   16
    1   1H    ILE   1          1H        ILE   1 -18.991   2.456   2.628
    2   2H    ILE   1          2H        ILE   1 -18.131   1.077   2.133
    3   3H    ILE   1          3H        ILE   1 -18.808   2.120   0.976
    4    HA   ILE   1           HA       ILE   1 -17.232   3.786   1.347
    5    HB   ILE   1           HB       ILE   1 -15.747   3.483   3.442
    6   1HG1  ILE   1          2HG1      ILE   1 -18.001   1.870   4.556
    7   2HG1  ILE   1          1HG1      ILE   1 -16.805   1.023   3.574
    8   1HG2  ILE   1          1HG2      ILE   1 -18.498   4.422   3.148
    9   2HG2  ILE   1          2HG2      ILE   1 -17.141   5.178   3.985
   10   3HG2  ILE   1          3HG2      ILE   1 -18.125   3.969   4.810
   11   1HD1  ILE   1          1HD1      ILE   1 -15.097   1.395   5.079
   12   2HD1  ILE   1          2HD1      ILE   1 -16.457   1.370   6.201
   13   3HD1  ILE   1          3HD1      ILE   1 -15.793   2.910   5.654
   14    H    LEU   2           H        LEU   2 -14.771   3.634   1.151
   15    HA   LEU   2           HA       LEU   2 -13.860   1.833  -0.718
   16   1HB   LEU   2          2HB       LEU   2 -11.620   2.382   0.136
   17   2HB   LEU   2          1HB       LEU   2 -12.659   3.807   0.212
   18    HG   LEU   2           HG       LEU   2 -13.110   2.534   2.647
   19   1HD1  LEU   2          1HD1      LEU   2 -10.387   2.665   3.162
   20   2HD1  LEU   2          2HD1      LEU   2 -10.461   1.845   1.602
   21   3HD1  LEU   2          3HD1      LEU   2 -11.327   1.182   2.989
   22   1HD2  LEU   2          1HD2      LEU   2 -11.884   4.454   3.573
   23   2HD2  LEU   2          2HD2      LEU   2 -12.870   4.969   2.207
   24   3HD2  LEU   2          3HD2      LEU   2 -11.133   4.748   2.006
   25    HA   PRO   3           HA       PRO   3 -13.810  -2.099   1.280
   26   1HB   PRO   3          2HB       PRO   3 -12.126  -3.395  -0.444
   27   2HB   PRO   3          1HB       PRO   3 -13.809  -3.006  -0.849
   28   1HG   PRO   3          2HG       PRO   3 -11.300  -1.628  -1.657
   29   2HG   PRO   3          1HG       PRO   3 -12.779  -1.919  -2.585
   30   1HD   PRO   3          2HD       PRO   3 -12.151   0.480  -1.430
   31   2HD   PRO   3          1HD       PRO   3 -13.813  -0.055  -1.767
   32    H    TRP   4           H        TRP   4 -11.746  -3.844   1.565
   33    HA   TRP   4           HA       TRP   4  -9.511  -2.249   2.778
   34   1HB   TRP   4          2HB       TRP   4 -10.030  -4.786   4.094
   35   2HB   TRP   4          1HB       TRP   4  -9.953  -3.173   4.793
   36    HD1  TRP   4           HD1      TRP   4 -12.430  -5.521   3.005
   37    HE1  TRP   4           1HE      TRP   4 -14.820  -4.892   3.741
   38    HE3  TRP   4           3HE      TRP   4 -11.423  -1.394   5.838
   39    HZ2  TRP   4           2HZ      TRP   4 -16.132  -2.899   5.323
   40    HZ3  TRP   4           3HZ      TRP   4 -13.257  -0.150   6.947
   41    HH2  TRP   4           HH2      TRP   4 -15.609  -0.897   6.693
   42    H    LYS   5           H        LYS   5  -9.233  -3.209   0.245
   43    HA   LYS   5           HA       LYS   5  -7.459  -5.594   0.601
   44   1HB   LYS   5          2HB       LYS   5  -9.770  -5.075  -1.107
   45   2HB   LYS   5          1HB       LYS   5  -8.355  -5.582  -2.028
   46   1HG   LYS   5          2HG       LYS   5  -8.161  -7.619  -0.811
   47   2HG   LYS   5          1HG       LYS   5  -9.259  -7.055   0.450
   48   1HD   LYS   5          2HD       LYS   5 -10.963  -8.005  -0.670
   49   2HD   LYS   5          1HD       LYS   5 -10.686  -6.863  -1.986
   50   1HE   LYS   5          2HE       LYS   5  -8.685  -8.681  -2.446
   51   2HE   LYS   5          1HE       LYS   5  -9.975  -9.725  -1.816
   52   1HZ   LYS   5          1HZ       LYS   5 -11.439  -8.202  -3.337
   53   2HZ   LYS   5          2HZ       LYS   5 -10.628  -9.546  -3.986
   54   3HZ   LYS   5          3HZ       LYS   5  -9.983  -7.985  -4.179
   55    H    TRP   6           H        TRP   6  -7.207  -2.499   0.301
   56    HA   TRP   6           HA       TRP   6  -5.894  -1.850  -2.109
   57   1HB   TRP   6          2HB       TRP   6  -6.734  -0.251  -0.513
   58   2HB   TRP   6          1HB       TRP   6  -5.673  -0.864   0.738
   59    HD1  TRP   6           HD1      TRP   6  -3.088  -0.496   0.390
   60    HE1  TRP   6           1HE      TRP   6  -1.811   1.413  -0.834
   61    HE3  TRP   6           3HE      TRP   6  -6.845   1.245  -2.410
   62    HZ2  TRP   6           2HZ      TRP   6  -2.403   3.445  -2.813
   63    HZ3  TRP   6           3HZ      TRP   6  -6.536   3.165  -3.983
   64    HH2  TRP   6           HH2      TRP   6  -4.313   4.260  -4.184
   65    HA   PRO   7           HA       PRO   7  -2.044  -3.901  -1.417
   66   1HB   PRO   7          2HB       PRO   7  -0.709  -2.873  -3.574
   67   2HB   PRO   7          1HB       PRO   7  -2.000  -4.080  -3.708
   68   1HG   PRO   7          2HG       PRO   7  -2.027  -1.251  -4.429
   69   2HG   PRO   7          1HG       PRO   7  -3.137  -2.537  -4.905
   70   1HD   PRO   7          2HD       PRO   7  -3.488  -0.515  -2.872
   71   2HD   PRO   7          1HD       PRO   7  -4.652  -1.727  -3.448
   72    H    TRP   8           H        TRP   8   0.497  -3.114  -1.915
   73    HA   TRP   8           HA       TRP   8   2.205  -2.169  -0.570
   74   1HB   TRP   8          2HB       TRP   8   1.071   0.307  -1.840
   75   2HB   TRP   8          1HB       TRP   8   2.750  -0.200  -1.690
   76    HD1  TRP   8           HD1      TRP   8  -0.196  -0.428  -3.927
   77    HE1  TRP   8           1HE      TRP   8   0.360  -1.863  -5.999
   78    HE3  TRP   8           3HE      TRP   8   4.213  -2.429  -2.407
   79    HZ2  TRP   8           2HZ      TRP   8   2.425  -3.644  -6.879
   80    HZ3  TRP   8           3HZ      TRP   8   5.467  -3.997  -3.864
   81    HH2  TRP   8           HH2      TRP   8   4.576  -4.610  -6.097
   82    H    TRP   9           H        TRP   9   1.314  -2.425   1.596
   83    HA   TRP   9           HA       TRP   9  -0.506  -0.827   2.939
   84   1HB   TRP   9          2HB       TRP   9   0.407  -2.673   4.062
   85   2HB   TRP   9          1HB       TRP   9   2.060  -2.171   3.721
   86    HD1  TRP   9           HD1      TRP   9   2.999  -0.072   5.088
   87    HE1  TRP   9           1HE      TRP   9   2.406   0.810   7.440
   88    HE3  TRP   9           3HE      TRP   9  -1.473  -2.368   5.733
   89    HZ2  TRP   9           2HZ      TRP   9   0.273   0.559   9.350
   90    HZ3  TRP   9           3HZ      TRP   9  -2.785  -2.044   7.817
   91    HH2  TRP   9           HH2      TRP   9  -1.918  -0.580   9.623
   92    HA   PRO  10           HA       PRO  10   1.500   3.108   3.092
   93   1HB   PRO  10          2HB       PRO  10  -0.362   4.348   4.663
   94   2HB   PRO  10          1HB       PRO  10  -0.661   3.923   2.968
   95   1HG   PRO  10          2HG       PRO  10  -1.799   2.765   5.380
   96   2HG   PRO  10          1HG       PRO  10  -2.318   2.590   3.699
   97   1HD   PRO  10          2HD       PRO  10  -0.748   0.768   5.323
   98   2HD   PRO  10          1HD       PRO  10  -1.464   0.494   3.722
   99    H    TRP  11           H        TRP  11   3.373   3.227   4.355
  100    HA   TRP  11           HA       TRP  11   3.125   2.904   7.295
  101   1HB   TRP  11          2HB       TRP  11   5.574   2.462   7.070
  102   2HB   TRP  11          1HB       TRP  11   4.593   1.367   6.117
  103    HD1  TRP  11           HD1      TRP  11   6.581   4.619   5.704
  104    HE1  TRP  11           1HE      TRP  11   7.422   4.725   3.254
  105    HE3  TRP  11           3HE      TRP  11   4.316   0.499   3.903
  106    HZ2  TRP  11           2HZ      TRP  11   7.131   3.198   0.822
  107    HZ3  TRP  11           3HZ      TRP  11   4.582  -0.196   1.521
  108    HH2  TRP  11           HH2      TRP  11   5.987   1.157  -0.018
  109    H    ARG  12           H        ARG  12   5.310   4.266   8.142
  110    HA   ARG  12           HA       ARG  12   4.527   7.023   8.011
  111   1HB   ARG  12          2HB       ARG  12   6.231   7.226   9.643
  112   2HB   ARG  12          1HB       ARG  12   5.610   5.601   9.864
  113   1HG   ARG  12          2HG       ARG  12   7.524   5.082   8.043
  114   2HG   ARG  12          1HG       ARG  12   8.247   6.493   8.815
  115   1HD   ARG  12          2HD       ARG  12   7.136   4.677  10.803
  116   2HD   ARG  12          1HD       ARG  12   8.347   3.871   9.787
  117    HE   ARG  12           HE       ARG  12   8.853   6.457  11.214
  118   1HH1  ARG  12          1HH2      ARG  12  10.547   5.296   8.849
  119   2HH1  ARG  12          2HH2      ARG  12  11.886   4.652   9.740
  120   1HH2  ARG  12          2HH1      ARG  12  10.277   4.833  12.805
  121   2HH2  ARG  12          1HH1      ARG  12  11.732   4.391  11.979
  122    H    ARG  13           H        ARG  13   4.953   6.435   5.364
  123    HA   ARG  13           HA       ARG  13   7.605   6.765   4.359
  124   1HB   ARG  13          2HB       ARG  13   5.512   5.986   3.168
  125   2HB   ARG  13          1HB       ARG  13   4.988   7.669   3.124
  126   1HG   ARG  13          2HG       ARG  13   7.725   7.424   2.197
  127   2HG   ARG  13          1HG       ARG  13   6.651   6.385   1.261
  128   1HD   ARG  13          2HD       ARG  13   5.092   8.508   1.202
  129   2HD   ARG  13          1HD       ARG  13   6.600   9.378   1.549
  130    HE   ARG  13           HE       ARG  13   7.235   8.916  -0.672
  131   1HH1  ARG  13          1HH1      ARG  13   4.255   7.634  -0.584
  132   2HH1  ARG  13          2HH1      ARG  13   4.574   6.238  -1.560
  133   1HH2  ARG  13          1HH2      ARG  13   8.018   6.633  -1.462
  134   2HH2  ARG  13          2HH2      ARG  13   6.706   5.672  -2.058
  135   1HN   NH2  14          1HT       ARG  13   8.238   8.587   6.017
  136   2HN   NH2  14          2HT       ARG  13   7.941  10.190   5.541