*HEADER    HYDROLASE                               06-MAY-02   1IWF              
*TITLE     SOLUTION STRUCTURE OF THE N-TERMINAL DOMAIN OF PIG GASTRIC            
*TITLE    2 H/K-ATPASE                                                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GASTRIC H/K-ATPASE;                                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: N-TERMINAL DOMAIN;                                         
*COMPND   5 SYNONYM: POTASSIUM-TRANSPORTING ATPASE ALPHA CHAIN 1;                
*COMPND   6 EC: 3.6.3.10;                                                        
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THIS PEPTIDE WAS SYNTHESIZED CONTAINING THE           
*SOURCE   4 SEQUENCE OF THE N-TERMINAL DOMAIN OF PIG GASTRIC H/K-ATPASE          
*KEYWDS    FRAGMENT STRUCTURE OF H/K-ATPASE                                      
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    N.FUJITANI, M.KANAGAWA, T.AIZAWA, T.OHKUBO, S.KAYA,                   
*AUTHOR   2 M.DEMURA, K.KAWANO, K.TANIGUCHI, K.NITTA                             
*REVDAT   1   27-NOV-02 1IWF    0                                                

!NOE
!seq(a-nh b-nh)
assign (resid 6 and name HA )(resid 7 and name HN ) 4.0 2.4 1.0
assign (resid 7 and name HA )(resid 8 and name HN ) 3.0 1.4 0.5
!assign (resid 8 and name HA )(resid 9 and name HN ) 4.0 2.4 1.0
assign (resid 9 and name HA )(resid 10 and name HN ) 3.0 1.4 0.5
assign (resid 10 and name HA )(resid 11 and name HN ) 3.0 1.4 0.5
assign (resid 11 and name HA )(resid 12 and name HN ) 2.4 0.9 0.5
assign (resid 12 and name HA )(resid 13 and name HN ) 2.4 0.9 0.2
assign (resid 14 and name HA )(resid 15 and name HN ) 2.4 0.9 0.2
assign (resid 16 and name HA )(resid 17 and name HN ) 2.4 0.9 0.2
assign (resid 19 and name HA )(resid 20 and name HN ) 3.0 1.4 0.5
assign (resid 20 and name HA1 )(resid 21 and name HN ) 2.4 0.9 0.2
assign (resid 23 and name HA )(resid 24 and name HN ) 2.4 0.9 0.2
assign (resid 25 and name HA )(resid 26 and name HN ) 2.4 0.9 0.2
assign (resid 26 and name HA )(resid 27 and name HN ) 3.0 1.4 0.5
assign (resid 27 and name HA )(resid 28 and name HN ) 2.4 0.9 0.2
assign (resid 28 and name HA )(resid 29 and name HN ) 2.4 0.9 0.2
assign (resid 32 and name HA1 )(resid 33 and name HN ) 4.0 2.4 1.0
assign (resid 6 and name HN )(resid 7 and name HN ) 4.0 2.4 1.0
assign (resid 10 and name HN )(resid 11 and name HN ) 3.0 1.4 0.5
assign (resid 8 and name HN )(resid 9 and name HN ) 3.0 1.4 0.5
assign (resid 12 and name HN )(resid 13 and name HN ) 4.0 2.4 1.0 
assign (resid 14 and name HN )(resid 15 and name HN ) 4.0 2.4 1.0
assign (resid 23 and name HN )(resid 24 and name HN ) 3.0 1.4 0.5
assign (resid 25 and name HN )(resid 26 and name HN ) 3.0 1.4 0.5
assign (resid 6 and name HB1 )(resid 7 and name HN ) 4.0 2.4 1.0
assign (resid 6 and name HB2 )(resid 7 and name HN ) 4.0 2.4 1.0
assign (resid 7 and name HB1 )(resid 8 and name HN ) 4.0 2.4 1.0
assign (resid 7 and name HB2 )(resid 8 and name HN ) 4.0 2.4 1.0
assign (resid 26 and name HG1 )(resid 27 and name HN ) 4.0 2.4 1.0
assign (resid 26 and name HG2 )(resid 27 and name HN ) 4.0 2.4 1.0
assign (resid 27 and name HB1 )(resid 28 and name HN ) 4.0 2.4 1.0
assign (resid 27 and name HB2 )(resid 28 and name HN ) 4.0 2.4 1.0
assign (resid 18 and name HA )(resid 19 and name HN ) 4.0 2.4 1.0
assign (resid 18 and name HB1 )(resid 19 and name HN ) 4.0 2.4 1.0
assign (resid 18 and name HB2 )(resid 19 and name HN ) 4.0 2.4 1.0
assign (resid 16 and name HA )(resid 17 and name HN ) 2.4 0.9 0.2
assign (resid 16 and name HB1 )(resid 17 and name HN ) 4.0 2.4 1.0
assign (resid 16 and name HB2 )(resid 17 and name HN ) 4.0 2.4 1.0
!assign (resid 11 and name HA )(resid 12 and name HG11 ) 4.0 2.4 1.0
assign (resid 9 and name HD# )(resid 10 and name HD1 ) 4.0 2.4 1.5
assign (resid 9 and name HB2 )(resid 10 and name HD1 ) 4.0 2.4 1.0
assign (resid 14 and name HB1 )(resid 15 and name HN ) 4.0 2.4 1.0
assign (resid 14 and name HB2 )(resid 15 and name HN ) 4.0 2.4 1.0
assign (resid 14 and name HD21 )(resid 15 and name HN ) 4.0 2.4 1.0
assign (resid 14 and name HD11 )(resid 15 and name HN ) 4.0 2.4 1.0
assign (resid 11 and name HN )(resid 12 and name HG# ) 4.0 2.4 1.5
assign (resid 16 and name HD# )(resid 17 and name HN ) 4.0 2.4 1.0
assign (resid 16 and name HB# )(resid 17 and name HN ) 4.0 2.4 1.0
assign (resid 18 and name HD# )(resid 19 and name HN ) 4.0 2.4 1.0
assign (resid 18 and name HB# )(resid 19 and name HN ) 4.0 2.4 1.0
assign (resid 18 and name HG# )(resid 19 and name HN ) 4.0 2.4 1.0
assign (resid 8 and name HN )(resid 7 and name HD# ) 3.0 1.4 1.0
assign (resid 8 and name HN )(resid 7 and name HE# ) 4.0 2.4 1.5
assign (resid 11 and name HB2 )(resid 12 and name HN ) 4.0 2.4 1.0
assign (resid 11 and name HB1 )(resid 12 and name HN ) 4.0 2.4 1.0
!assign (resid 16 and name HD# )(resid 15 and name HN ) 4.0 2.4 1.0
assign (resid 10 and name HD1 )(resid 11 and name HG# ) 4.0 2.4 1.5
assign (resid 8 and name HG# )(resid 7 and name HD1 ) 4.0 2.4 1.5
assign (resid 25 and name HG# )(resid 26 and name HN ) 4.0 2.4 1.0
assign (resid 25 and name HD# )(resdi 26 and name HN ) 4.0 2.4 1.0
assign (resid 25 and name HB1 )(resid 26 and name HN ) 4.0 2.4 1.0
assign (resid 25 and name HB2 )(resid 26 and name HN ) 4.0 2.4 1.0
!mid
assign (resid 9 and name HA )(resid 12 and name HB ) 4.0 2.4 1.0
assign (resid 11 and name HA )(resid 14 and name HD11 ) 4.0 2.4 1.0
assign (resid 9 and name HA )(resid 12 and name HG11 ) 4.0 2.4 1.0
assign (resid 10 and name HB1 )(resid 12 and name HG11 ) 4.0 2.4 1.0
assign (resid 10 and name HB2 )(resid 12 and name HG11 ) 4.0 2.4 1.0
assign (resid 10 and name HD1 )(resid 12 and name HG11 ) 4.0 2.4 1.0
assign (resid 10 and name HE# )(resid 12 and name HN ) 4.0 2.4 1.5
assign (resid 10 and name HD1 )(resid 24 and name HN ) 4.0 2.4 1.5
assign (resid 7 and name HD1 )(resid 23 and name HA ) 4.0 2.4 1.0
assign (resid 12 and name HG11 )(resid 14 and name HA ) 4.0 2.4 1.0
assign (resid 9 and name HB1 )(resid 7 and name HD1 ) 4.0 2.4 1.5
!intra
assign (resid 6 and name HN )(resid 6 and name HB1 ) 3.0 1.4 0.5
assign (resid 6 and name HN )(resid 6 and name HB2 ) 3.0 1.4 0.5
assign (resid 7 and name HN )(resid 7 and name HB1 ) 3.0 1.4 0.5
assign (resid 7 and name HN )(resid 7 and name HB2 ) 3.0 1.4 0.5
assign (resid 7 and name HN )(resid 7 and name HD# ) 3.0 1.4 1.0
assign (resid 7 and name HN )(resid 7 and name HE# ) 4.0 2.4 1.0
assign (resid 7 and name HA )(resid 7 and name HD# ) 4.0 2.4 1.0
assign (resid 7 and name HA )(resid 7 and name HE# ) 4.0 2.4 1.5
assign (resid 7 and name HB1 )(resid 7 and name HD# ) 2.4 0.9 0.5
assign (resid 7 and name HB2 )(resid 7 and name HD# ) 2.4 0.9 0.5
assign (resid 7 and name HB1 )(resid 7 and name HE# ) 4.0 2.4 1.0
assign (resid 7 and name HB2 )(resid 7 and name HE# ) 4.0 2.4 1.0
!assign (resid 8 and name HN )(resid 8 and name HB1 ) 4.0 2.4 1.0
assign (resid 8 and name HN )(resid 8 and name HB2 ) 3.0 1.4 0.5
assign (resid 8 and name HN )(resid 8 and name HG# ) 3.0 1.4 1.0
assign (resid 8 and name HA )(resid 8 and name HG# ) 3.0 1.4 1.0
assign (resid 9 and name HN )(resid 9 and name HB1 ) 2.4 0.9 0.5
assign (resid 9 and name HN )(resid 9 and name HB2 ) 2.4 0.9 0.5
assign (resid 9 and name HN )(resid 9 and name HD11 ) 4.0 2.4 1.0
assign (resid 9 and name HN )(resid 9 and name HD21 ) 4.0 2.4 1.0
assign (resid 9 and name HA )(resid 9 and name HD11 ) 4.0 2.4 1.0
assign (resid 9 and name HA )(resid 9 and name HD21 ) 3.0 2.4 1.0
assign (resid 10 and name HN )(resid 10 and name HB1 ) 3.0 2.4 0.5
assign (resid 10 and name HN )(resid 10 and name HB2 ) 3.0 2.4 0.5
assign (resid 10 and name HB1 )(resid 10 and name HD# ) 2.4 0.9 0.5
assign (resid 10 and name HB2 )(resid 10 and name HD# ) 2.4 0.9 0.5
assign (resid 10 and name HA )(resid 10 and name HD# ) 3.0 1.4 0.5
assign (resid 10 and name HN )(resid 10 and name HD# ) 3.0 1.4 1.0
assign (resid 10 and name HN )(resid 10 and name HE# ) 4.0 2.4 1.0
!assign (resid 10 and name HB1 )(resid 10 and name HE# ) 2.4 0.9 0.5
!assign (resid 10 and name HB2 )(resid 10 and name HE# ) 2.4 0.9 0.5
assign (resid 11 and name HN )(resid 11 and name HB1 ) 3.0 1.4 0.5
assign (resid 11 and name HN )(resid 11 and name HB2 ) 3.0 1.4 0.5
assign (resid 11 and name HN )(resid 11 and name HG# ) 4.0 2.4 1.0
assign (resid 11 and name HA )(resid 11 and name HG# ) 4.0 2.4 1.0
assign (resid 12 and name HN )(resid 12 and name HB ) 2.4 0.9 0.5
assign (resid 12 and name HN )(resid 12 and name HG11 ) 4.0 2.4 1.0
assign (resid 12 and name HN )(resid 12 and name HG21 ) 4.0 2.4 1.0
assign (resid 12 and name HA )(resid 12 and name HG11 ) 3.0 1.4 0.5
assign (resid 12 and name HA )(resid 12 and name HG21 ) 3.0 1.4 0.5
!assign (resid 13 and name HN )(resid 13 and name HB1 ) 4.0 2.4 1.0
assign (resid 13 and name HN )(resid 13 and name HB2 ) 3.0 1.4 0.5
assign (resid 14 and name HN )(resid 14 and name HB1 ) 3.0 1.4 0.5
assign (resid 14 and name HN )(resid 14 and name HB2 ) 3.0 1.4 0.5
assign (resid 14 and name HN )(resid 14 and name HD11 ) 4.0 2.4 1.0
assign (resid 14 and name HN )(resid 14 and name HD21 ) 4.0 2.4 1.0 
assign (resid 14 and name HA )(resid 14 and name HD11 ) 4.0 2.4 1.0
assign (resid 14 and name HA )(resid 14 and name HD21 ) 2.4 0.9 1.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1  -1.089  17.230  14.786
    2   2H    MET   1          2HT       MET   1  -0.369  16.979  16.305
    3   3H    MET   1          3HT       MET   1  -0.105  15.873  15.043
    4    HA   MET   1           HA       MET   1   0.853  17.904  13.794
    5   1HB   MET   1          2HB       MET   1   1.164  18.700  16.707
    6   2HB   MET   1          1HB       MET   1   1.886  19.527  15.326
    7   1HG   MET   1          2HG       MET   1  -0.079  20.520  14.725
    8   2HG   MET   1          1HG       MET   1  -1.043  19.111  15.170
    9   1HE   MET   1          1HE       MET   1  -1.202  22.895  17.121
   10   2HE   MET   1          2HE       MET   1  -1.046  22.321  15.462
   11   3HE   MET   1          3HE       MET   1   0.400  22.608  16.427
   12    H    GLY   2           H        GLY   2   3.267  17.965  13.820
   13   1HA   GLY   2          2HA       GLY   2   5.398  17.080  14.477
   14   2HA   GLY   2          1HA       GLY   2   4.572  15.965  15.566
   15    H    LYS   3           H        LYS   3   3.158  14.287  14.374
   16    HA   LYS   3           HA       LYS   3   4.851  12.947  12.414
   17   1HB   LYS   3          2HB       LYS   3   2.124  12.293  13.566
   18   2HB   LYS   3          1HB       LYS   3   2.973  11.252  12.422
   19   1HG   LYS   3          2HG       LYS   3   3.657  10.349  14.460
   20   2HG   LYS   3          1HG       LYS   3   4.964  11.484  14.123
   21   1HD   LYS   3          2HD       LYS   3   4.466  12.716  15.941
   22   2HD   LYS   3          1HD       LYS   3   2.765  12.807  15.481
   23   1HE   LYS   3          2HE       LYS   3   2.261  10.736  16.556
   24   2HE   LYS   3          1HE       LYS   3   3.968  10.336  16.742
   25   1HZ   LYS   3          1HZ       LYS   3   2.674  12.680  18.019
   26   2HZ   LYS   3          2HZ       LYS   3   4.240  12.086  18.305
   27   3HZ   LYS   3          3HZ       LYS   3   2.885  11.185  18.791
   28    H    ALA   4           H        ALA   4   1.978  14.949  12.330
   29    HA   ALA   4           HA       ALA   4   0.783  15.829  10.511
   30   1HB   ALA   4          1HB       ALA   4   3.300  16.141   9.791
   31   2HB   ALA   4          2HB       ALA   4   2.016  16.360   8.603
   32   3HB   ALA   4          3HB       ALA   4   2.926  14.852   8.648
   33    H    GLU   5           H        GLU   5  -0.636  15.095   8.827
   34    HA   GLU   5           HA       GLU   5  -0.464  12.187   8.179
   35   1HB   GLU   5          2HB       GLU   5  -2.881  13.669   9.258
   36   2HB   GLU   5          1HB       GLU   5  -2.968  12.073   8.512
   37   1HG   GLU   5          2HG       GLU   5  -1.453  11.161  10.196
   38   2HG   GLU   5          1HG       GLU   5  -1.241  12.760  10.909
   39    H    ASN   6           H        ASN   6  -1.729  11.626   6.236
   40    HA   ASN   6           HA       ASN   6  -1.843  13.927   4.356
   41   1HB   ASN   6          2HB       ASN   6  -0.725  11.440   4.065
   42   2HB   ASN   6          1HB       ASN   6  -2.298  11.209   3.301
   43   1HD2  ASN   6          1HD2      ASN   6  -0.541  11.042   1.388
   44   2HD2  ASN   6          2HD2      ASN   6  -0.271  12.494   0.550
   45    H    TYR   7           H        TYR   7  -3.643  13.302   2.524
   46    HA   TYR   7           HA       TYR   7  -6.187  13.310   4.024
   47   1HB   TYR   7          2HB       TYR   7  -6.415  13.534   1.122
   48   2HB   TYR   7          1HB       TYR   7  -6.964  14.640   2.375
   49    HD1  TYR   7           1HD      TYR   7  -4.202  13.767   0.113
   50    HD2  TYR   7           2HD      TYR   7  -5.529  16.452   3.192
   51    HE1  TYR   7           1HE      TYR   7  -2.333  15.306  -0.423
   52    HE2  TYR   7           2HE      TYR   7  -3.660  17.990   2.655
   53    HH   TYR   7           HH       TYR   7  -2.205  18.384   0.363
   54    H    GLU   8           H        GLU   8  -4.878  11.690   1.127
   55    HA   GLU   8           HA       GLU   8  -6.547   9.318   1.855
   56   1HB   GLU   8          2HB       GLU   8  -5.915   9.971  -1.010
   57   2HB   GLU   8          1HB       GLU   8  -7.252   9.024  -0.354
   58   1HG   GLU   8          2HG       GLU   8  -8.472  10.913  -0.677
   59   2HG   GLU   8          1HG       GLU   8  -7.692  11.472   0.804
   60    H    LEU   9           H        LEU   9  -4.026   9.351   2.801
   61    HA   LEU   9           HA       LEU   9  -2.213   8.116   0.826
   62   1HB   LEU   9          2HB       LEU   9  -1.394   9.746   2.563
   63   2HB   LEU   9          1HB       LEU   9  -1.781   8.546   3.796
   64    HG   LEU   9           HG       LEU   9   0.643   8.571   2.980
   65   1HD1  LEU   9          1HD1      LEU   9  -0.461   5.879   2.369
   66   2HD1  LEU   9          2HD1      LEU   9  -0.884   6.564   3.937
   67   3HD1  LEU   9          3HD1      LEU   9   0.809   6.344   3.498
   68   1HD2  LEU   9          1HD2      LEU   9  -0.368   8.724   0.510
   69   2HD2  LEU   9          2HD2      LEU   9  -0.299   6.968   0.639
   70   3HD2  LEU   9          3HD2      LEU   9   1.171   7.924   0.824
   71    H    TYR  10           H        TYR  10  -3.019   7.139   4.171
   72    HA   TYR  10           HA       TYR  10  -2.636   4.343   3.506
   73   1HB   TYR  10          2HB       TYR  10  -2.962   3.929   5.795
   74   2HB   TYR  10          1HB       TYR  10  -2.199   5.509   5.744
   75    HD1  TYR  10           1HD      TYR  10  -4.808   6.906   4.657
   76    HD2  TYR  10           2HD      TYR  10  -3.985   4.312   7.978
   77    HE1  TYR  10           1HE      TYR  10  -6.736   7.866   5.883
   78    HE2  TYR  10           2HE      TYR  10  -5.916   5.270   9.205
   79    HH   TYR  10           HH       TYR  10  -7.194   7.840   8.900
   80    H    GLN  11           H        GLN  11  -5.097   6.312   2.683
   81    HA   GLN  11           HA       GLN  11  -7.308   4.474   3.359
   82   1HB   GLN  11          2HB       GLN  11  -7.084   7.239   2.652
   83   2HB   GLN  11          1HB       GLN  11  -8.083   6.445   1.433
   84   1HG   GLN  11          2HG       GLN  11  -9.618   5.640   3.077
   85   2HG   GLN  11          1HG       GLN  11  -8.525   6.054   4.399
   86   1HE2  GLN  11          1HE2      GLN  11 -10.390   7.608   1.735
   87   2HE2  GLN  11          2HE2      GLN  11 -10.650   9.064   2.569
   88    H    VAL  12           H        VAL  12  -5.093   3.544   1.711
   89    HA   VAL  12           HA       VAL  12  -6.353   3.210  -0.942
   90    HB   VAL  12           HB       VAL  12  -4.130   4.045  -1.098
   91   1HG1  VAL  12          1HG1      VAL  12  -3.390   3.583   1.163
   92   2HG1  VAL  12          2HG1      VAL  12  -2.236   2.868   0.034
   93   3HG1  VAL  12          3HG1      VAL  12  -3.417   1.845   0.854
   94   1HG2  VAL  12          1HG2      VAL  12  -3.575   1.123  -1.441
   95   2HG2  VAL  12          2HG2      VAL  12  -3.220   2.461  -2.533
   96   3HG2  VAL  12          3HG2      VAL  12  -4.867   1.844  -2.400
   97    H    GLU  13           H        GLU  13  -7.839   1.668   0.397
   98    HA   GLU  13           HA       GLU  13  -8.436  -0.519   1.019
   99   1HB   GLU  13          2HB       GLU  13  -8.022  -0.812  -1.416
  100   2HB   GLU  13          1HB       GLU  13  -6.336  -1.194  -1.065
  101   1HG   GLU  13          2HG       GLU  13  -6.839  -3.305  -0.426
  102   2HG   GLU  13          1HG       GLU  13  -8.212  -2.768   0.542
  103    H    LEU  14           H        LEU  14  -6.868   0.418   2.954
  104    HA   LEU  14           HA       LEU  14  -4.351  -0.781   3.416
  105   1HB   LEU  14          2HB       LEU  14  -6.267   0.718   4.924
  106   2HB   LEU  14          1HB       LEU  14  -5.769  -0.668   5.893
  107    HG   LEU  14           HG       LEU  14  -3.829   1.199   4.503
  108   1HD1  LEU  14          1HD1      LEU  14  -5.235   2.252   6.346
  109   2HD1  LEU  14          2HD1      LEU  14  -3.492   2.277   6.620
  110   3HD1  LEU  14          3HD1      LEU  14  -4.499   1.093   7.454
  111   1HD2  LEU  14          1HD2      LEU  14  -3.585  -1.117   6.427
  112   2HD2  LEU  14          2HD2      LEU  14  -2.308   0.090   6.281
  113   3HD2  LEU  14          3HD2      LEU  14  -2.764  -0.885   4.884
  114    H    GLY  15           H        GLY  15  -4.047  -2.495   5.255
  115   1HA   GLY  15          2HA       GLY  15  -4.252  -4.759   5.840
  116   2HA   GLY  15          1HA       GLY  15  -5.988  -4.464   5.818
  117    HA   PRO  16           HA       PRO  16  -4.557  -6.232   1.565
  118   1HB   PRO  16          2HB       PRO  16  -2.473  -8.006   1.829
  119   2HB   PRO  16          1HB       PRO  16  -2.254  -6.290   1.442
  120   1HG   PRO  16          2HG       PRO  16  -1.754  -7.713   4.015
  121   2HG   PRO  16          1HG       PRO  16  -1.003  -6.238   3.384
  122   1HD   PRO  16          2HD       PRO  16  -3.035  -6.352   5.351
  123   2HD   PRO  16          1HD       PRO  16  -2.512  -4.899   4.473
  124    H    GLY  17           H        GLY  17  -6.637  -7.213   2.449
  125   1HA   GLY  17          2HA       GLY  17  -6.260 -10.147   2.868
  126   2HA   GLY  17          1HA       GLY  17  -7.419  -9.242   3.844
  127    HA   PRO  18           HA       PRO  18  -9.101  -9.345  -0.656
  128   1HB   PRO  18          2HB       PRO  18  -7.830 -11.093  -2.356
  129   2HB   PRO  18          1HB       PRO  18  -7.379  -9.387  -2.189
  130   1HG   PRO  18          2HG       PRO  18  -5.977 -11.806  -1.156
  131   2HG   PRO  18          1HG       PRO  18  -5.315 -10.217  -1.569
  132   1HD   PRO  18          2HD       PRO  18  -5.862 -11.157   1.046
  133   2HD   PRO  18          1HD       PRO  18  -5.512  -9.475   0.591
  134    H    SER  19           H        SER  19  -7.746 -12.609  -0.906
  135    HA   SER  19           HA       SER  19 -10.259 -13.906  -1.084
  136   1HB   SER  19          2HB       SER  19  -8.378 -15.145  -1.822
  137   2HB   SER  19          1HB       SER  19  -7.504 -14.873  -0.316
  138    HG   SER  19           HG       SER  19  -9.962 -16.274  -0.443
  139    H    GLY  20           H        GLY  20 -11.715 -14.545   0.450
  140   1HA   GLY  20          2HA       GLY  20 -12.659 -14.938   2.564
  141   2HA   GLY  20          1HA       GLY  20 -11.018 -15.183   3.167
  142    H    ASP  21           H        ASP  21 -11.327 -13.951   5.068
  143    HA   ASP  21           HA       ASP  21 -11.814 -11.033   4.618
  144   1HB   ASP  21          2HB       ASP  21 -13.078 -12.834   6.388
  145   2HB   ASP  21          1HB       ASP  21 -12.026 -11.831   7.389
  146    H    MET  22           H        MET  22 -10.796  -9.896   6.806
  147    HA   MET  22           HA       MET  22  -7.932 -10.753   6.785
  148   1HB   MET  22          2HB       MET  22  -8.533  -8.459   5.861
  149   2HB   MET  22          1HB       MET  22  -9.001  -8.014   7.503
  150   1HG   MET  22          2HG       MET  22  -6.702  -8.704   8.265
  151   2HG   MET  22          1HG       MET  22  -6.262  -8.912   6.571
  152   1HE   MET  22          1HE       MET  22  -4.721  -6.062   8.538
  153   2HE   MET  22          2HE       MET  22  -5.707  -7.350   9.226
  154   3HE   MET  22          3HE       MET  22  -6.265  -5.680   9.313
  155    H    ALA  23           H        ALA  23  -6.768 -10.554   8.835
  156    HA   ALA  23           HA       ALA  23  -7.792  -9.812  11.317
  157   1HB   ALA  23          1HB       ALA  23  -9.623 -11.283  11.251
  158   2HB   ALA  23          2HB       ALA  23  -8.423 -12.203  12.158
  159   3HB   ALA  23          3HB       ALA  23  -8.695 -12.551  10.451
  160    H    ALA  24           H        ALA  24  -5.332  -9.555  10.767
  161    HA   ALA  24           HA       ALA  24  -3.810 -11.988  11.557
  162   1HB   ALA  24          1HB       ALA  24  -2.933  -9.344  10.366
  163   2HB   ALA  24          2HB       ALA  24  -2.962 -10.913   9.563
  164   3HB   ALA  24          3HB       ALA  24  -1.814 -10.612  10.867
  165    H    LYS  25           H        LYS  25  -5.406  -9.922  13.276
  166    HA   LYS  25           HA       LYS  25  -5.138  -8.891  15.367
  167   1HB   LYS  25          2HB       LYS  25  -3.128 -11.133  15.388
  168   2HB   LYS  25          1HB       LYS  25  -3.262 -10.041  16.766
  169   1HG   LYS  25          2HG       LYS  25  -4.768 -11.739  17.339
  170   2HG   LYS  25          1HG       LYS  25  -5.825 -10.543  16.585
  171   1HD   LYS  25          2HD       LYS  25  -6.026 -11.779  14.605
  172   2HD   LYS  25          1HD       LYS  25  -4.549 -12.692  14.912
  173   1HE   LYS  25          2HE       LYS  25  -5.852 -13.567  17.016
  174   2HE   LYS  25          1HE       LYS  25  -7.279 -13.055  16.113
  175   1HZ   LYS  25          1HZ       LYS  25  -6.700 -14.472  14.323
  176   2HZ   LYS  25          2HZ       LYS  25  -6.585 -15.403  15.739
  177   3HZ   LYS  25          3HZ       LYS  25  -5.177 -14.819  14.987
  178    H    MET  26           H        MET  26  -4.315  -7.035  13.890
  179    HA   MET  26           HA       MET  26  -1.738  -6.124  15.010
  180   1HB   MET  26          2HB       MET  26  -1.575  -7.319  12.618
  181   2HB   MET  26          1HB       MET  26  -2.074  -5.716  12.076
  182   1HG   MET  26          2HG       MET  26   0.382  -5.868  12.158
  183   2HG   MET  26          1HG       MET  26  -0.206  -4.711  13.353
  184   1HE   MET  26          1HE       MET  26   2.581  -5.529  15.133
  185   2HE   MET  26          2HE       MET  26   1.197  -5.207  16.175
  186   3HE   MET  26          3HE       MET  26   1.313  -4.416  14.605
  187    H    SER  27           H        SER  27  -4.104  -5.214  12.501
  188    HA   SER  27           HA       SER  27  -4.442  -2.611  13.937
  189   1HB   SER  27          2HB       SER  27  -4.790  -1.558  11.717
  190   2HB   SER  27          1HB       SER  27  -3.185  -2.271  11.850
  191    HG   SER  27           HG       SER  27  -5.418  -3.099  10.378
  192    H    LYS  28           H        LYS  28  -6.345  -3.362  15.000
  193    HA   LYS  28           HA       LYS  28  -8.606  -4.094  13.191
  194   1HB   LYS  28          2HB       LYS  28  -8.038  -4.694  16.094
  195   2HB   LYS  28          1HB       LYS  28  -9.658  -4.862  15.416
  196   1HG   LYS  28          2HG       LYS  28  -7.530  -6.089  13.785
  197   2HG   LYS  28          1HG       LYS  28  -7.753  -6.835  15.369
  198   1HD   LYS  28          2HD       LYS  28 -10.139  -6.219  13.644
  199   2HD   LYS  28          1HD       LYS  28  -9.200  -7.685  13.366
  200   1HE   LYS  28          2HE       LYS  28  -9.740  -7.300  16.198
  201   2HE   LYS  28          1HE       LYS  28 -11.234  -7.350  15.261
  202   1HZ   LYS  28          1HZ       LYS  28 -10.842  -9.563  15.636
  203   2HZ   LYS  28          2HZ       LYS  28  -9.153  -9.405  15.557
  204   3HZ   LYS  28          3HZ       LYS  28 -10.082  -9.364  14.134
  205    H    LYS  29           H        LYS  29  -8.914  -1.779  12.706
  206    HA   LYS  29           HA       LYS  29 -10.285  -0.356  14.954
  207   1HB   LYS  29          2HB       LYS  29  -8.030   0.493  13.525
  208   2HB   LYS  29          1HB       LYS  29  -9.370   1.392  12.812
  209   1HG   LYS  29          2HG       LYS  29  -9.995   1.622  15.441
  210   2HG   LYS  29          1HG       LYS  29  -8.236   1.544  15.547
  211   1HD   LYS  29          2HD       LYS  29  -8.345   3.778  15.123
  212   2HD   LYS  29          1HD       LYS  29  -8.556   3.263  13.448
  213   1HE   LYS  29          2HE       LYS  29 -11.116   3.065  14.451
  214   2HE   LYS  29          1HE       LYS  29 -10.493   4.489  15.286
  215   1HZ   LYS  29          1HZ       LYS  29  -9.713   4.522  12.568
  216   2HZ   LYS  29          2HZ       LYS  29 -10.638   5.659  13.430
  217   3HZ   LYS  29          3HZ       LYS  29 -11.396   4.339  12.678
  218    H    LYS  30           H        LYS  30 -11.913  -1.970  13.645
  219    HA   LYS  30           HA       LYS  30 -12.974  -0.989  11.158
  220   1HB   LYS  30          2HB       LYS  30 -13.965  -2.855  13.299
  221   2HB   LYS  30          1HB       LYS  30 -15.056  -2.338  12.012
  222   1HG   LYS  30          2HG       LYS  30 -12.347  -3.256  11.186
  223   2HG   LYS  30          1HG       LYS  30 -13.467  -4.492  11.760
  224   1HD   LYS  30          2HD       LYS  30 -14.034  -4.436   9.511
  225   2HD   LYS  30          1HD       LYS  30 -15.160  -3.239  10.152
  226   1HE   LYS  30          2HE       LYS  30 -12.549  -2.086   9.514
  227   2HE   LYS  30          1HE       LYS  30 -13.333  -2.803   8.107
  228   1HZ   LYS  30          1HZ       LYS  30 -15.343  -1.541   8.671
  229   2HZ   LYS  30          2HZ       LYS  30 -14.018  -0.527   8.347
  230   3HZ   LYS  30          3HZ       LYS  30 -14.514  -0.798   9.950
  231    H    ALA  31           H        ALA  31 -14.602  -0.939  14.351
  232    HA   ALA  31           HA       ALA  31 -15.089   1.839  14.467
  233   1HB   ALA  31          1HB       ALA  31 -16.901   0.326  12.662
  234   2HB   ALA  31          2HB       ALA  31 -16.463   2.034  12.644
  235   3HB   ALA  31          3HB       ALA  31 -17.679   1.449  13.779
  236    H    GLY  32           H        GLY  32 -14.612   0.783  16.627
  237   1HA   GLY  32          2HA       GLY  32 -16.554  -0.899  17.909
  238   2HA   GLY  32          1HA       GLY  32 -15.333   0.064  18.744
  239    H    ARG  33           H        ARG  33 -15.922   2.064  19.604
  240    HA   ARG  33           HA       ARG  33 -18.843   2.628  19.589
  241   1HB   ARG  33          2HB       ARG  33 -18.223   4.185  21.497
  242   2HB   ARG  33          1HB       ARG  33 -17.916   2.475  21.804
  243   1HG   ARG  33          2HG       ARG  33 -15.642   2.737  21.784
  244   2HG   ARG  33          1HG       ARG  33 -15.694   3.987  20.540
  245   1HD   ARG  33          2HD       ARG  33 -16.561   5.596  22.226
  246   2HD   ARG  33          1HD       ARG  33 -16.423   4.347  23.463
  247    HE   ARG  33           HE       ARG  33 -13.905   4.349  22.758
  248   1HH1  ARG  33          1HH2      ARG  33 -14.883   6.482  24.720
  249   2HH1  ARG  33          2HH2      ARG  33 -14.162   7.905  24.046
  250   1HH2  ARG  33          1HH1      ARG  33 -13.464   6.425  20.988
  251   2HH2  ARG  33          2HH1      ARG  33 -13.357   7.872  21.934
  252    H    GLY  34           H        GLY  34 -18.934   5.304  20.100
  253   1HA   GLY  34          2HA       GLY  34 -17.365   7.174  18.888
  254   2HA   GLY  34          1HA       GLY  34 -18.161   6.430  17.501
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1  -7.881  14.287  -9.899
    2   2H    MET   1          2HT       MET   1  -8.692  12.826 -10.207
    3   3H    MET   1          3HT       MET   1  -9.529  14.300 -10.303
    4    HA   MET   1           HA       MET   1  -9.159  13.847 -12.513
    5   1HB   MET   1          2HB       MET   1  -8.092  16.050 -11.583
    6   2HB   MET   1          1HB       MET   1  -6.560  15.243 -11.919
    7   1HG   MET   1          2HG       MET   1  -7.270  14.879 -14.261
    8   2HG   MET   1          1HG       MET   1  -8.788  15.712 -13.923
    9   1HE   MET   1          1HE       MET   1  -4.742  17.169 -14.934
   10   2HE   MET   1          2HE       MET   1  -5.284  15.566 -14.443
   11   3HE   MET   1          3HE       MET   1  -4.726  16.712 -13.224
   12    H    GLY   2           H        GLY   2  -8.607  11.407 -11.811
   13   1HA   GLY   2          2HA       GLY   2  -7.309   9.774 -13.157
   14   2HA   GLY   2          1HA       GLY   2  -5.910  10.833 -12.970
   15    H    LYS   3           H        LYS   3  -8.136  10.114 -10.340
   16    HA   LYS   3           HA       LYS   3  -7.756   9.058  -8.277
   17   1HB   LYS   3          2HB       LYS   3  -7.369   7.150 -10.033
   18   2HB   LYS   3          1HB       LYS   3  -5.669   7.353  -9.612
   19   1HG   LYS   3          2HG       LYS   3  -6.634   7.261  -7.134
   20   2HG   LYS   3          1HG       LYS   3  -7.932   6.368  -7.925
   21   1HD   LYS   3          2HD       LYS   3  -5.003   5.697  -8.298
   22   2HD   LYS   3          1HD       LYS   3  -6.018   4.937  -7.070
   23   1HE   LYS   3          2HE       LYS   3  -7.118   3.661  -8.594
   24   2HE   LYS   3          1HE       LYS   3  -7.205   4.972  -9.769
   25   1HZ   LYS   3          1HZ       LYS   3  -4.539   3.992  -9.318
   26   2HZ   LYS   3          2HZ       LYS   3  -5.356   4.287 -10.778
   27   3HZ   LYS   3          3HZ       LYS   3  -5.584   2.819  -9.953
   28    H    ALA   4           H        ALA   4  -6.574  11.329  -8.083
   29    HA   ALA   4           HA       ALA   4  -3.705  10.809  -7.412
   30   1HB   ALA   4          1HB       ALA   4  -3.147  12.877  -8.213
   31   2HB   ALA   4          2HB       ALA   4  -4.650  13.609  -7.651
   32   3HB   ALA   4          3HB       ALA   4  -4.627  12.682  -9.150
   33    H    GLU   5           H        GLU   5  -3.552  10.493  -5.238
   34    HA   GLU   5           HA       GLU   5  -5.218  12.242  -3.470
   35   1HB   GLU   5          2HB       GLU   5  -5.261  10.478  -1.845
   36   2HB   GLU   5          1HB       GLU   5  -5.672   9.739  -3.392
   37   1HG   GLU   5          2HG       GLU   5  -2.834   9.705  -3.161
   38   2HG   GLU   5          1HG       GLU   5  -3.496   9.097  -1.642
   39    H    ASN   6           H        ASN   6  -4.164  12.964  -1.488
   40    HA   ASN   6           HA       ASN   6  -1.183  12.802  -1.558
   41   1HB   ASN   6          2HB       ASN   6  -2.474  15.038  -2.379
   42   2HB   ASN   6          1HB       ASN   6  -2.392  15.359  -0.647
   43   1HD2  ASN   6          1HD2      ASN   6  -0.873  16.918  -2.504
   44   2HD2  ASN   6          2HD2      ASN   6   0.774  16.586  -2.264
   45    H    TYR   7           H        TYR   7  -4.041  13.731   0.368
   46    HA   TYR   7           HA       TYR   7  -2.503  13.166   2.841
   47   1HB   TYR   7          2HB       TYR   7  -5.243  13.955   3.322
   48   2HB   TYR   7          1HB       TYR   7  -3.758  14.779   3.780
   49    HD1  TYR   7           1HD      TYR   7  -6.381  14.482   1.211
   50    HD2  TYR   7           2HD      TYR   7  -2.798  16.536   2.392
   51    HE1  TYR   7           1HE      TYR   7  -6.805  16.212  -0.514
   52    HE2  TYR   7           2HE      TYR   7  -3.222  18.267   0.670
   53    HH   TYR   7           HH       TYR   7  -6.181  18.217  -1.297
   54    H    GLU   8           H        GLU   8  -5.070  11.900   0.848
   55    HA   GLU   8           HA       GLU   8  -5.897   9.973   2.933
   56   1HB   GLU   8          2HB       GLU   8  -6.862  10.614   0.147
   57   2HB   GLU   8          1HB       GLU   8  -7.395   9.156   0.985
   58   1HG   GLU   8          2HG       GLU   8  -8.108  10.602   2.912
   59   2HG   GLU   8          1HG       GLU   8  -7.731  12.015   1.926
   60    H    LEU   9           H        LEU   9  -3.224   9.621   2.294
   61    HA   LEU   9           HA       LEU   9  -2.974   7.567   0.219
   62   1HB   LEU   9          2HB       LEU   9  -1.155   9.244   0.883
   63   2HB   LEU   9          1HB       LEU   9  -0.923   8.261   2.329
   64    HG   LEU   9           HG       LEU   9  -1.032   6.623  -0.079
   65   1HD1  LEU   9          1HD1      LEU   9   0.993   8.863   0.102
   66   2HD1  LEU   9          2HD1      LEU   9  -0.048   8.450  -1.261
   67   3HD1  LEU   9          3HD1      LEU   9   1.293   7.392  -0.824
   68   1HD2  LEU   9          1HD2      LEU   9  -0.194   5.818   2.067
   69   2HD2  LEU   9          2HD2      LEU   9   1.027   7.091   2.102
   70   3HD2  LEU   9          3HD2      LEU   9   1.125   5.806   0.897
   71    H    TYR  10           H        TYR  10  -3.684   7.678   3.601
   72    HA   TYR  10           HA       TYR  10  -2.830   4.933   4.134
   73   1HB   TYR  10          2HB       TYR  10  -4.814   6.222   5.914
   74   2HB   TYR  10          1HB       TYR  10  -3.331   5.369   6.318
   75    HD1  TYR  10           1HD      TYR  10  -1.204   6.704   5.004
   76    HD2  TYR  10           2HD      TYR  10  -4.757   8.421   6.702
   77    HE1  TYR  10           1HE      TYR  10  -0.024   8.866   5.286
   78    HE2  TYR  10           2HE      TYR  10  -3.577  10.584   6.984
   79    HH   TYR  10           HH       TYR  10  -0.145  10.881   6.496
   80    H    GLN  11           H        GLN  11  -5.187   6.025   2.208
   81    HA   GLN  11           HA       GLN  11  -7.333   4.219   3.164
   82   1HB   GLN  11          2HB       GLN  11  -7.381   6.627   1.787
   83   2HB   GLN  11          1HB       GLN  11  -7.667   5.442   0.512
   84   1HG   GLN  11          2HG       GLN  11  -9.160   5.050   3.058
   85   2HG   GLN  11          1HG       GLN  11  -9.657   6.409   2.049
   86   1HE2  GLN  11          1HE2      GLN  11  -9.237   2.861   2.043
   87   2HE2  GLN  11          2HE2      GLN  11 -10.256   2.579   0.715
   88    H    VAL  12           H        VAL  12  -4.786   3.131   2.378
   89    HA   VAL  12           HA       VAL  12  -5.341   1.811  -0.204
   90    HB   VAL  12           HB       VAL  12  -3.154   2.739  -0.099
   91   1HG1  VAL  12          1HG1      VAL  12  -3.014   3.120   2.285
   92   2HG1  VAL  12          2HG1      VAL  12  -1.614   2.170   1.791
   93   3HG1  VAL  12          3HG1      VAL  12  -2.969   1.387   2.603
   94   1HG2  VAL  12          1HG2      VAL  12  -3.577  -0.082  -0.232
   95   2HG2  VAL  12          2HG2      VAL  12  -2.053   0.189   0.613
   96   3HG2  VAL  12          3HG2      VAL  12  -2.297   0.859  -1.000
   97    H    GLU  13           H        GLU  13  -7.106   0.611   1.089
   98    HA   GLU  13           HA       GLU  13  -7.844  -1.353   2.139
   99   1HB   GLU  13          2HB       GLU  13  -5.694  -2.017   0.410
  100   2HB   GLU  13          1HB       GLU  13  -5.459  -2.944   1.891
  101   1HG   GLU  13          2HG       GLU  13  -7.863  -3.661   1.749
  102   2HG   GLU  13          1HG       GLU  13  -7.956  -2.866   0.177
  103    H    LEU  14           H        LEU  14  -6.867   0.532   3.927
  104    HA   LEU  14           HA       LEU  14  -4.796  -0.115   5.662
  105   1HB   LEU  14          2HB       LEU  14  -7.189   1.459   5.797
  106   2HB   LEU  14          1HB       LEU  14  -7.031   0.556   7.303
  107    HG   LEU  14           HG       LEU  14  -4.787   2.171   6.065
  108   1HD1  LEU  14          1HD1      LEU  14  -7.116   3.027   7.543
  109   2HD1  LEU  14          2HD1      LEU  14  -5.808   4.005   6.877
  110   3HD1  LEU  14          3HD1      LEU  14  -5.660   3.320   8.495
  111   1HD2  LEU  14          1HD2      LEU  14  -4.017   0.382   7.532
  112   2HD2  LEU  14          2HD2      LEU  14  -5.179   0.856   8.771
  113   3HD2  LEU  14          3HD2      LEU  14  -3.833   1.923   8.370
  114    H    GLY  15           H        GLY  15  -5.109  -1.124   7.948
  115   1HA   GLY  15          2HA       GLY  15  -5.781  -3.886   7.627
  116   2HA   GLY  15          1HA       GLY  15  -5.464  -3.097   9.172
  117    HA   PRO  16           HA       PRO  16 -10.149  -3.579   8.277
  118   1HB   PRO  16          2HB       PRO  16 -10.626  -6.277   8.487
  119   2HB   PRO  16          1HB       PRO  16 -10.336  -5.450   6.947
  120   1HG   PRO  16          2HG       PRO  16  -8.509  -7.230   8.491
  121   2HG   PRO  16          1HG       PRO  16  -8.548  -6.900   6.752
  122   1HD   PRO  16          2HD       PRO  16  -6.731  -5.782   8.618
  123   2HD   PRO  16          1HD       PRO  16  -6.990  -5.228   6.949
  124    H    GLY  17           H        GLY  17  -9.675  -2.616  10.491
  125   1HA   GLY  17          2HA       GLY  17 -10.178  -4.625  12.653
  126   2HA   GLY  17          1HA       GLY  17  -9.218  -3.165  12.903
  127    HA   PRO  18           HA       PRO  18 -13.709  -2.315  13.883
  128   1HB   PRO  18          2HB       PRO  18 -13.423  -2.088  16.607
  129   2HB   PRO  18          1HB       PRO  18 -13.835  -3.606  15.790
  130   1HG   PRO  18          2HG       PRO  18 -11.246  -2.778  17.012
  131   2HG   PRO  18          1HG       PRO  18 -11.898  -4.406  16.759
  132   1HD   PRO  18          2HD       PRO  18  -9.925  -3.140  15.167
  133   2HD   PRO  18          1HD       PRO  18 -10.811  -4.624  14.754
  134    H    SER  19           H        SER  19 -11.066  -1.012  15.939
  135    HA   SER  19           HA       SER  19 -10.403   1.204  16.333
  136   1HB   SER  19          2HB       SER  19 -11.760   2.489  14.119
  137   2HB   SER  19          1HB       SER  19 -10.031   2.295  14.398
  138    HG   SER  19           HG       SER  19 -10.115   0.879  12.856
  139    H    GLY  20           H        GLY  20 -12.899   0.202  17.434
  140   1HA   GLY  20          2HA       GLY  20 -14.483   1.263  18.863
  141   2HA   GLY  20          1HA       GLY  20 -14.136   2.797  18.064
  142    H    ASP  21           H        ASP  21 -15.607   3.510  16.583
  143    HA   ASP  21           HA       ASP  21 -17.628   1.527  15.611
  144   1HB   ASP  21          2HB       ASP  21 -19.018   3.728  15.298
  145   2HB   ASP  21          1HB       ASP  21 -18.871   3.028  16.911
  146    H    MET  22           H        MET  22 -18.635   2.289  13.455
  147    HA   MET  22           HA       MET  22 -16.520   2.589  11.521
  148   1HB   MET  22          2HB       MET  22 -19.513   2.496  11.428
  149   2HB   MET  22          1HB       MET  22 -18.648   3.093  10.011
  150   1HG   MET  22          2HG       MET  22 -17.166   0.937  10.394
  151   2HG   MET  22          1HG       MET  22 -18.595   0.363  11.252
  152   1HE   MET  22          1HE       MET  22 -19.975  -1.523   9.220
  153   2HE   MET  22          2HE       MET  22 -18.353  -1.419   9.899
  154   3HE   MET  22          3HE       MET  22 -18.562  -1.567   8.157
  155    H    ALA  23           H        ALA  23 -15.422   4.498  11.386
  156    HA   ALA  23           HA       ALA  23 -16.485   6.852  10.336
  157   1HB   ALA  23          1HB       ALA  23 -16.164   7.966  12.895
  158   2HB   ALA  23          2HB       ALA  23 -17.149   6.525  13.141
  159   3HB   ALA  23          3HB       ALA  23 -17.678   7.773  12.012
  160    H    ALA  24           H        ALA  24 -14.332   6.509   9.417
  161    HA   ALA  24           HA       ALA  24 -12.043   7.054  11.221
  162   1HB   ALA  24          1HB       ALA  24 -11.191   5.492   9.805
  163   2HB   ALA  24          2HB       ALA  24 -10.993   6.843   8.689
  164   3HB   ALA  24          3HB       ALA  24 -12.417   5.807   8.576
  165    H    LYS  25           H        LYS  25 -10.616   8.846  10.835
  166    HA   LYS  25           HA       LYS  25 -11.395  10.856   8.830
  167   1HB   LYS  25          2HB       LYS  25 -12.280  11.031  11.563
  168   2HB   LYS  25          1HB       LYS  25 -11.138  12.335  11.237
  169   1HG   LYS  25          2HG       LYS  25 -12.559  12.532   8.990
  170   2HG   LYS  25          1HG       LYS  25 -13.806  11.800  10.002
  171   1HD   LYS  25          2HD       LYS  25 -13.873  13.609  11.467
  172   2HD   LYS  25          1HD       LYS  25 -12.232  14.120  11.072
  173   1HE   LYS  25          2HE       LYS  25 -14.162  15.550  10.136
  174   2HE   LYS  25          1HE       LYS  25 -12.900  15.065   9.005
  175   1HZ   LYS  25          1HZ       LYS  25 -15.351  13.457   9.395
  176   2HZ   LYS  25          2HZ       LYS  25 -14.246  13.404   8.105
  177   3HZ   LYS  25          3HZ       LYS  25 -15.289  14.733   8.279
  178    H    MET  26           H        MET  26  -9.232  10.329   8.086
  179    HA   MET  26           HA       MET  26  -6.935  10.779   7.917
  180   1HB   MET  26          2HB       MET  26  -8.072  13.068   8.971
  181   2HB   MET  26          1HB       MET  26  -6.814  12.686  10.147
  182   1HG   MET  26          2HG       MET  26  -5.170  12.499   8.284
  183   2HG   MET  26          1HG       MET  26  -6.433  12.981   7.153
  184   1HE   MET  26          1HE       MET  26  -4.809  15.494   6.444
  185   2HE   MET  26          2HE       MET  26  -6.270  16.400   6.826
  186   3HE   MET  26          3HE       MET  26  -6.399  14.746   6.236
  187    H    SER  27           H        SER  27  -5.205   9.681   8.762
  188    HA   SER  27           HA       SER  27  -5.482   8.701  11.572
  189   1HB   SER  27          2HB       SER  27  -3.475   7.352   9.934
  190   2HB   SER  27          1HB       SER  27  -4.817   6.668  10.846
  191    HG   SER  27           HG       SER  27  -5.052   6.360   8.587
  192    H    LYS  28           H        LYS  28  -4.220   9.890  12.923
  193    HA   LYS  28           HA       LYS  28  -1.385  10.308  12.181
  194   1HB   LYS  28          2HB       LYS  28  -3.013  12.353  11.639
  195   2HB   LYS  28          1HB       LYS  28  -2.801  12.660  13.362
  196   1HG   LYS  28          2HG       LYS  28  -0.309  12.014  11.917
  197   2HG   LYS  28          1HG       LYS  28  -1.073  13.529  11.427
  198   1HD   LYS  28          2HD       LYS  28  -0.113  14.464  13.241
  199   2HD   LYS  28          1HD       LYS  28  -1.268  13.548  14.208
  200   1HE   LYS  28          2HE       LYS  28   0.920  13.018  15.055
  201   2HE   LYS  28          1HE       LYS  28   0.369  11.612  14.143
  202   1HZ   LYS  28          1HZ       LYS  28   2.149  13.751  13.102
  203   2HZ   LYS  28          2HZ       LYS  28   1.635  12.377  12.243
  204   3HZ   LYS  28          3HZ       LYS  28   2.652  12.209  13.594
  205    H    LYS  29           H        LYS  29  -0.943   8.793  13.874
  206    HA   LYS  29           HA       LYS  29  -0.634   9.961  16.488
  207   1HB   LYS  29          2HB       LYS  29  -3.015   9.554  16.720
  208   2HB   LYS  29          1HB       LYS  29  -2.830   7.901  16.133
  209   1HG   LYS  29          2HG       LYS  29  -2.062   7.138  18.137
  210   2HG   LYS  29          1HG       LYS  29  -1.107   8.592  18.432
  211   1HD   LYS  29          2HD       LYS  29  -2.714   8.976  20.017
  212   2HD   LYS  29          1HD       LYS  29  -3.596   9.634  18.638
  213   1HE   LYS  29          2HE       LYS  29  -5.196   8.089  18.973
  214   2HE   LYS  29          1HE       LYS  29  -4.018   6.831  18.602
  215   1HZ   LYS  29          1HZ       LYS  29  -3.305   7.283  21.059
  216   2HZ   LYS  29          2HZ       LYS  29  -4.609   6.253  20.712
  217   3HZ   LYS  29          3HZ       LYS  29  -4.895   7.853  21.207
  218    H    LYS  30           H        LYS  30  -1.383   6.615  15.452
  219    HA   LYS  30           HA       LYS  30   1.480   5.924  15.904
  220   1HB   LYS  30          2HB       LYS  30   0.751   3.873  17.132
  221   2HB   LYS  30          1HB       LYS  30   0.340   5.358  17.988
  222   1HG   LYS  30          2HG       LYS  30  -1.948   5.252  16.983
  223   2HG   LYS  30          1HG       LYS  30  -1.523   3.692  16.276
  224   1HD   LYS  30          2HD       LYS  30  -1.709   4.397  19.213
  225   2HD   LYS  30          1HD       LYS  30  -2.666   3.209  18.327
  226   1HE   LYS  30          2HE       LYS  30  -1.124   1.765  19.225
  227   2HE   LYS  30          1HE       LYS  30  -0.204   2.250  17.799
  228   1HZ   LYS  30          1HZ       LYS  30   0.152   4.141  19.863
  229   2HZ   LYS  30          2HZ       LYS  30   1.315   3.179  19.088
  230   3HZ   LYS  30          3HZ       LYS  30   0.500   2.592  20.458
  231    H    ALA  31           H        ALA  31   2.057   3.836  14.883
  232    HA   ALA  31           HA       ALA  31   1.227   3.568  12.232
  233   1HB   ALA  31          1HB       ALA  31   3.027   2.208  12.458
  234   2HB   ALA  31          2HB       ALA  31   1.857   0.968  12.909
  235   3HB   ALA  31          3HB       ALA  31   2.684   1.896  14.160
  236    H    GLY  32           H        GLY  32   0.132   1.394  11.402
  237   1HA   GLY  32          2HA       GLY  32  -2.355   0.975  13.013
  238   2HA   GLY  32          1HA       GLY  32  -2.391   1.133  11.256
  239    H    ARG  33           H        ARG  33  -3.511  -1.100  11.789
  240    HA   ARG  33           HA       ARG  33  -1.574  -3.281  12.225
  241   1HB   ARG  33          2HB       ARG  33  -4.040  -3.182  13.066
  242   2HB   ARG  33          1HB       ARG  33  -4.453  -3.662  11.420
  243   1HG   ARG  33          2HG       ARG  33  -3.340  -5.720  11.603
  244   2HG   ARG  33          1HG       ARG  33  -2.356  -5.175  12.962
  245   1HD   ARG  33          2HD       ARG  33  -5.299  -5.157  13.379
  246   2HD   ARG  33          1HD       ARG  33  -4.532  -6.741  13.277
  247    HE   ARG  33           HE       ARG  33  -4.452  -5.161  15.573
  248   1HH1  ARG  33          1HH1      ARG  33  -2.620  -7.414  13.863
  249   2HH1  ARG  33          2HH1      ARG  33  -1.179  -7.208  14.800
  250   1HH2  ARG  33          1HH2      ARG  33  -2.408  -4.500  16.584
  251   2HH2  ARG  33          2HH2      ARG  33  -1.059  -5.560  16.343
  252    H    GLY  34           H        GLY  34  -1.038  -4.831  10.625
  253   1HA   GLY  34          2HA       GLY  34  -0.766  -5.687   8.446
  254   2HA   GLY  34          1HA       GLY  34  -2.154  -4.719   7.946
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1  12.237   8.870   4.749
    2   2H    MET   1          2HT       MET   1  11.981  10.474   5.249
    3   3H    MET   1          3HT       MET   1  10.849   9.702   4.244
    4    HA   MET   1           HA       MET   1  10.124   8.276   5.944
    5   1HB   MET   1          2HB       MET   1  12.320   7.711   6.859
    6   2HB   MET   1          1HB       MET   1  12.499   9.346   7.499
    7   1HG   MET   1          2HG       MET   1  10.150   8.738   8.635
    8   2HG   MET   1          1HG       MET   1  10.792   7.103   8.475
    9   1HE   MET   1          1HE       MET   1  13.326   6.639   8.936
   10   2HE   MET   1          2HE       MET   1  14.318   7.495  10.114
   11   3HE   MET   1          3HE       MET   1  14.020   8.215   8.534
   12    H    GLY   2           H        GLY   2   8.323   9.122   6.887
   13   1HA   GLY   2          2HA       GLY   2   6.991  10.635   8.128
   14   2HA   GLY   2          1HA       GLY   2   8.429  11.617   8.412
   15    H    LYS   3           H        LYS   3   7.481  10.605   5.190
   16    HA   LYS   3           HA       LYS   3   6.936  13.475   4.560
   17   1HB   LYS   3          2HB       LYS   3   8.636  11.583   3.338
   18   2HB   LYS   3          1HB       LYS   3   7.281  11.795   2.228
   19   1HG   LYS   3          2HG       LYS   3   9.056  13.444   1.764
   20   2HG   LYS   3          1HG       LYS   3   7.587  14.244   2.323
   21   1HD   LYS   3          2HD       LYS   3   8.945  15.270   3.824
   22   2HD   LYS   3          1HD       LYS   3   8.898  13.733   4.690
   23   1HE   LYS   3          2HE       LYS   3  11.163  13.812   4.467
   24   2HE   LYS   3          1HE       LYS   3  10.835  13.217   2.840
   25   1HZ   LYS   3          1HZ       LYS   3  12.257  15.149   2.762
   26   2HZ   LYS   3          2HZ       LYS   3  11.124  16.064   3.636
   27   3HZ   LYS   3          3HZ       LYS   3  10.754  15.517   2.070
   28    H    ALA   4           H        ALA   4   4.688  13.170   5.310
   29    HA   ALA   4           HA       ALA   4   3.040  11.708   3.283
   30   1HB   ALA   4          1HB       ALA   4   2.040  12.276   6.059
   31   2HB   ALA   4          2HB       ALA   4   3.099  10.893   5.783
   32   3HB   ALA   4          3HB       ALA   4   1.553  11.002   4.941
   33    H    GLU   5           H        GLU   5   1.958  13.149   2.029
   34    HA   GLU   5           HA       GLU   5   1.122  15.732   3.288
   35   1HB   GLU   5          2HB       GLU   5   1.775  15.181   0.377
   36   2HB   GLU   5          1HB       GLU   5   1.295  16.739   1.052
   37   1HG   GLU   5          2HG       GLU   5   3.627  15.326   2.284
   38   2HG   GLU   5          1HG       GLU   5   3.863  16.129   0.730
   39    H    ASN   6           H        ASN   6   0.240  13.392   0.726
   40    HA   ASN   6           HA       ASN   6  -2.393  14.364   0.288
   41   1HB   ASN   6          2HB       ASN   6  -0.911  11.867  -0.264
   42   2HB   ASN   6          1HB       ASN   6  -2.660  11.670  -0.131
   43   1HD2  ASN   6          1HD2      ASN   6  -3.783  12.067  -2.039
   44   2HD2  ASN   6          2HD2      ASN   6  -3.227  13.040  -3.315
   45    H    TYR   7           H        TYR   7  -4.420  13.666   1.167
   46    HA   TYR   7           HA       TYR   7  -4.235  12.857   3.996
   47   1HB   TYR   7          2HB       TYR   7  -6.936  13.142   2.891
   48   2HB   TYR   7          1HB       TYR   7  -6.195  13.958   4.261
   49    HD1  TYR   7           1HD      TYR   7  -4.709  15.955   3.867
   50    HD2  TYR   7           2HD      TYR   7  -7.080  14.190   0.750
   51    HE1  TYR   7           1HE      TYR   7  -4.449  18.011   2.505
   52    HE2  TYR   7           2HE      TYR   7  -6.822  16.246  -0.611
   53    HH   TYR   7           HH       TYR   7  -5.673  19.160   0.661
   54    H    GLU   8           H        GLU   8  -5.422  11.617   0.920
   55    HA   GLU   8           HA       GLU   8  -6.519   9.205   2.215
   56   1HB   GLU   8          2HB       GLU   8  -6.220   9.716  -0.751
   57   2HB   GLU   8          1HB       GLU   8  -7.340   8.614   0.049
   58   1HG   GLU   8          2HG       GLU   8  -7.942  11.031   1.237
   59   2HG   GLU   8          1HG       GLU   8  -7.580  11.503  -0.424
   60    H    LEU   9           H        LEU   9  -3.703   9.609   2.582
   61    HA   LEU   9           HA       LEU   9  -2.204   8.030   0.675
   62   1HB   LEU   9          2HB       LEU   9  -1.361   9.761   2.458
   63   2HB   LEU   9          1HB       LEU   9  -1.363   8.370   3.542
   64    HG   LEU   9           HG       LEU   9   0.842   8.595   2.511
   65   1HD1  LEU   9          1HD1      LEU   9  -0.432   6.307   2.785
   66   2HD1  LEU   9          2HD1      LEU   9   1.098   6.356   1.909
   67   3HD1  LEU   9          3HD1      LEU   9  -0.425   6.316   1.021
   68   1HD2  LEU   9          1HD2      LEU   9  -0.115   9.779   0.452
   69   2HD2  LEU   9          2HD2      LEU   9  -0.510   8.176  -0.164
   70   3HD2  LEU   9          3HD2      LEU   9   1.170   8.612   0.144
   71    H    TYR  10           H        TYR  10  -3.188   7.314   4.053
   72    HA   TYR  10           HA       TYR  10  -2.704   4.458   3.601
   73   1HB   TYR  10          2HB       TYR  10  -4.206   5.290   6.007
   74   2HB   TYR  10          1HB       TYR  10  -2.797   4.249   5.867
   75    HD1  TYR  10           1HD      TYR  10  -0.782   5.845   4.577
   76    HD2  TYR  10           2HD      TYR  10  -3.711   7.038   7.485
   77    HE1  TYR  10           1HE      TYR  10   0.684   7.715   5.286
   78    HE2  TYR  10           2HE      TYR  10  -2.244   8.909   8.194
   79    HH   TYR  10           HH       TYR  10  -0.181   9.789   8.031
   80    H    GLN  11           H        GLN  11  -5.064   6.365   2.510
   81    HA   GLN  11           HA       GLN  11  -7.362   4.662   3.268
   82   1HB   GLN  11          2HB       GLN  11  -7.650   7.133   3.059
   83   2HB   GLN  11          1HB       GLN  11  -7.222   7.015   1.351
   84   1HG   GLN  11          2HG       GLN  11  -9.255   6.183   0.771
   85   2HG   GLN  11          1HG       GLN  11  -9.342   5.149   2.196
   86   1HE2  GLN  11          1HE2      GLN  11 -11.434   5.776   2.949
   87   2HE2  GLN  11          2HE2      GLN  11 -11.804   7.358   3.441
   88    H    VAL  12           H        VAL  12  -5.201   3.446   1.853
   89    HA   VAL  12           HA       VAL  12  -6.357   2.961  -0.833
   90    HB   VAL  12           HB       VAL  12  -4.096   3.754  -0.945
   91   1HG1  VAL  12          1HG1      VAL  12  -3.509   3.255   1.402
   92   2HG1  VAL  12          2HG1      VAL  12  -2.271   2.683   0.285
   93   3HG1  VAL  12          3HG1      VAL  12  -3.407   1.541   1.004
   94   1HG2  VAL  12          1HG2      VAL  12  -4.916   1.311  -1.980
   95   2HG2  VAL  12          2HG2      VAL  12  -3.360   0.935  -1.238
   96   3HG2  VAL  12          3HG2      VAL  12  -3.470   2.196  -2.467
   97    H    GLU  13           H        GLU  13  -7.950   1.479   0.211
   98    HA   GLU  13           HA       GLU  13  -8.648  -0.642   0.954
   99   1HB   GLU  13          2HB       GLU  13  -7.474  -1.073  -1.315
  100   2HB   GLU  13          1HB       GLU  13  -6.132  -1.685  -0.350
  101   1HG   GLU  13          2HG       GLU  13  -8.524  -2.821   0.701
  102   2HG   GLU  13          1HG       GLU  13  -8.566  -3.024  -1.051
  103    H    LEU  14           H        LEU  14  -7.938   0.248   3.158
  104    HA   LEU  14           HA       LEU  14  -5.547  -0.159   4.453
  105   1HB   LEU  14          2HB       LEU  14  -8.361  -0.116   5.280
  106   2HB   LEU  14          1HB       LEU  14  -7.347  -1.078   6.353
  107    HG   LEU  14           HG       LEU  14  -7.316   1.187   7.176
  108   1HD1  LEU  14          1HD1      LEU  14  -4.739   1.112   5.648
  109   2HD1  LEU  14          2HD1      LEU  14  -5.091  -0.198   6.777
  110   3HD1  LEU  14          3HD1      LEU  14  -5.018   1.468   7.353
  111   1HD2  LEU  14          1HD2      LEU  14  -6.583   1.927   4.326
  112   2HD2  LEU  14          2HD2      LEU  14  -6.531   3.048   5.686
  113   3HD2  LEU  14          3HD2      LEU  14  -8.068   2.352   5.176
  114    H    GLY  15           H        GLY  15  -4.793  -1.943   5.875
  115   1HA   GLY  15          2HA       GLY  15  -5.864  -4.610   5.592
  116   2HA   GLY  15          1HA       GLY  15  -4.454  -4.383   4.556
  117    HA   PRO  16           HA       PRO  16  -1.779  -4.863   7.999
  118   1HB   PRO  16          2HB       PRO  16   0.132  -2.941   7.540
  119   2HB   PRO  16          1HB       PRO  16  -0.003  -4.431   6.592
  120   1HG   PRO  16          2HG       PRO  16  -0.764  -1.648   5.834
  121   2HG   PRO  16          1HG       PRO  16  -0.286  -3.003   4.796
  122   1HD   PRO  16          2HD       PRO  16  -2.932  -2.097   5.225
  123   2HD   PRO  16          1HD       PRO  16  -2.465  -3.636   4.469
  124    H    GLY  17           H        GLY  17  -3.629  -3.919   9.406
  125   1HA   GLY  17          2HA       GLY  17  -3.055  -1.172  10.376
  126   2HA   GLY  17          1HA       GLY  17  -4.499  -2.113  10.756
  127    HA   PRO  18           HA       PRO  18  -1.103  -2.661  14.029
  128   1HB   PRO  18          2HB       PRO  18  -1.577  -0.500  15.656
  129   2HB   PRO  18          1HB       PRO  18  -0.390  -0.491  14.342
  130   1HG   PRO  18          2HG       PRO  18  -3.064   0.816  14.462
  131   2HG   PRO  18          1HG       PRO  18  -1.645   1.253  13.497
  132   1HD   PRO  18          2HD       PRO  18  -3.947  -0.133  12.569
  133   2HD   PRO  18          1HD       PRO  18  -2.415   0.073  11.692
  134    H    SER  19           H        SER  19  -3.776  -3.718  13.742
  135    HA   SER  19           HA       SER  19  -5.487  -3.186  15.947
  136   1HB   SER  19          2HB       SER  19  -6.577  -5.248  15.405
  137   2HB   SER  19          1HB       SER  19  -6.003  -4.583  13.878
  138    HG   SER  19           HG       SER  19  -4.397  -6.052  13.832
  139    H    GLY  20           H        GLY  20  -5.141  -3.535  18.081
  140   1HA   GLY  20          2HA       GLY  20  -2.843  -5.169  18.930
  141   2HA   GLY  20          1HA       GLY  20  -3.856  -4.179  19.982
  142    H    ASP  21           H        ASP  21  -4.424  -5.734  21.505
  143    HA   ASP  21           HA       ASP  21  -5.695  -8.232  20.485
  144   1HB   ASP  21          2HB       ASP  21  -5.519  -8.831  23.018
  145   2HB   ASP  21          1HB       ASP  21  -4.047  -8.844  22.045
  146    H    MET  22           H        MET  22  -7.821  -7.620  20.082
  147    HA   MET  22           HA       MET  22  -9.274  -5.941  22.004
  148   1HB   MET  22          2HB       MET  22 -10.503  -7.469  19.708
  149   2HB   MET  22          1HB       MET  22 -11.048  -5.957  20.436
  150   1HG   MET  22          2HG       MET  22  -8.479  -5.341  19.633
  151   2HG   MET  22          1HG       MET  22  -9.043  -6.399  18.340
  152   1HE   MET  22          1HE       MET  22 -10.790  -5.076  16.214
  153   2HE   MET  22          2HE       MET  22  -9.103  -5.335  16.650
  154   3HE   MET  22          3HE       MET  22  -9.667  -3.709  16.275
  155    H    ALA  23           H        ALA  23  -9.796  -9.246  20.699
  156    HA   ALA  23           HA       ALA  23 -10.627 -11.161  21.780
  157   1HB   ALA  23          1HB       ALA  23  -9.170  -9.786  23.752
  158   2HB   ALA  23          2HB       ALA  23  -9.732 -11.457  23.829
  159   3HB   ALA  23          3HB       ALA  23 -10.721 -10.162  24.502
  160    H    ALA  24           H        ALA  24 -12.752 -11.071  21.022
  161    HA   ALA  24           HA       ALA  24 -15.088 -10.942  21.306
  162   1HB   ALA  24          1HB       ALA  24 -14.362 -11.276  23.798
  163   2HB   ALA  24          2HB       ALA  24 -15.975 -10.652  23.457
  164   3HB   ALA  24          3HB       ALA  24 -14.687  -9.548  23.942
  165    H    LYS  25           H        LYS  25 -16.807  -9.116  21.689
  166    HA   LYS  25           HA       LYS  25 -17.547  -6.942  21.191
  167   1HB   LYS  25          2HB       LYS  25 -15.496  -6.509  22.859
  168   2HB   LYS  25          1HB       LYS  25 -14.788  -5.821  21.397
  169   1HG   LYS  25          2HG       LYS  25 -15.940  -4.031  22.508
  170   2HG   LYS  25          1HG       LYS  25 -16.927  -4.485  21.118
  171   1HD   LYS  25          2HD       LYS  25 -18.218  -6.020  22.687
  172   2HD   LYS  25          1HD       LYS  25 -17.368  -5.231  24.017
  173   1HE   LYS  25          2HE       LYS  25 -18.846  -3.539  23.951
  174   2HE   LYS  25          1HE       LYS  25 -18.357  -3.185  22.294
  175   1HZ   LYS  25          1HZ       LYS  25 -20.129  -4.245  21.450
  176   2HZ   LYS  25          2HZ       LYS  25 -20.808  -3.971  22.983
  177   3HZ   LYS  25          3HZ       LYS  25 -20.105  -5.474  22.618
  178    H    MET  26           H        MET  26 -17.997  -7.306  18.997
  179    HA   MET  26           HA       MET  26 -15.925  -6.280  17.122
  180   1HB   MET  26          2HB       MET  26 -15.788  -8.737  17.032
  181   2HB   MET  26          1HB       MET  26 -17.523  -8.829  16.721
  182   1HG   MET  26          2HG       MET  26 -17.135  -7.396  14.671
  183   2HG   MET  26          1HG       MET  26 -15.404  -7.601  14.940
  184   1HE   MET  26          1HE       MET  26 -16.476  -8.341  12.248
  185   2HE   MET  26          2HE       MET  26 -15.776  -9.933  11.969
  186   3HE   MET  26          3HE       MET  26 -14.823  -8.687  12.772
  187    H    SER  27           H        SER  27 -17.251  -4.360  17.036
  188    HA   SER  27           HA       SER  27 -19.857  -4.766  15.621
  189   1HB   SER  27          2HB       SER  27 -18.989  -2.479  17.415
  190   2HB   SER  27          1HB       SER  27 -20.524  -2.566  16.558
  191    HG   SER  27           HG       SER  27 -19.756  -4.728  18.157
  192    H    LYS  28           H        LYS  28 -19.529  -4.359  13.482
  193    HA   LYS  28           HA       LYS  28 -18.913  -3.191  11.540
  194   1HB   LYS  28          2HB       LYS  28 -18.144  -0.921  13.392
  195   2HB   LYS  28          1HB       LYS  28 -18.600  -0.815  11.691
  196   1HG   LYS  28          2HG       LYS  28 -20.448  -1.828  13.871
  197   2HG   LYS  28          1HG       LYS  28 -20.443  -0.165  13.280
  198   1HD   LYS  28          2HD       LYS  28 -20.527  -2.046  11.072
  199   2HD   LYS  28          1HD       LYS  28 -21.866  -2.321  12.186
  200   1HE   LYS  28          2HE       LYS  28 -21.280   0.515  11.535
  201   2HE   LYS  28          1HE       LYS  28 -21.944  -0.458  10.223
  202   1HZ   LYS  28          1HZ       LYS  28 -23.499   0.730  11.934
  203   2HZ   LYS  28          2HZ       LYS  28 -23.178  -0.649  12.874
  204   3HZ   LYS  28          3HZ       LYS  28 -23.884  -0.810  11.338
  205    H    LYS  29           H        LYS  29 -17.020  -3.210  10.349
  206    HA   LYS  29           HA       LYS  29 -14.491  -3.482  11.918
  207   1HB   LYS  29          2HB       LYS  29 -15.575  -5.219  10.074
  208   2HB   LYS  29          1HB       LYS  29 -14.434  -4.297   9.093
  209   1HG   LYS  29          2HG       LYS  29 -12.670  -5.326  10.044
  210   2HG   LYS  29          1HG       LYS  29 -13.277  -4.985  11.666
  211   1HD   LYS  29          2HD       LYS  29 -13.811  -7.158  11.888
  212   2HD   LYS  29          1HD       LYS  29 -14.970  -6.977  10.571
  213   1HE   LYS  29          2HE       LYS  29 -13.340  -7.587   8.928
  214   2HE   LYS  29          1HE       LYS  29 -12.022  -7.458  10.093
  215   1HZ   LYS  29          1HZ       LYS  29 -12.654  -9.391  11.154
  216   2HZ   LYS  29          2HZ       LYS  29 -12.965  -9.768   9.527
  217   3HZ   LYS  29          3HZ       LYS  29 -14.242  -9.337  10.561
  218    H    LYS  30           H        LYS  30 -15.876  -0.982  10.856
  219    HA   LYS  30           HA       LYS  30 -13.988  -0.047   8.793
  220   1HB   LYS  30          2HB       LYS  30 -16.568   0.556   9.166
  221   2HB   LYS  30          1HB       LYS  30 -15.865   1.822  10.174
  222   1HG   LYS  30          2HG       LYS  30 -14.565   2.672   8.336
  223   2HG   LYS  30          1HG       LYS  30 -14.987   1.290   7.325
  224   1HD   LYS  30          2HD       LYS  30 -16.802   2.392   6.592
  225   2HD   LYS  30          1HD       LYS  30 -17.422   2.449   8.242
  226   1HE   LYS  30          2HE       LYS  30 -15.891   4.466   8.598
  227   2HE   LYS  30          1HE       LYS  30 -15.668   4.481   6.848
  228   1HZ   LYS  30          1HZ       LYS  30 -17.744   5.218   6.501
  229   2HZ   LYS  30          2HZ       LYS  30 -17.639   5.758   8.109
  230   3HZ   LYS  30          3HZ       LYS  30 -18.413   4.289   7.753
  231    H    ALA  31           H        ALA  31 -12.805   2.053   9.193
  232    HA   ALA  31           HA       ALA  31 -11.504   1.926  11.839
  233   1HB   ALA  31          1HB       ALA  31  -9.714   2.548  10.629
  234   2HB   ALA  31          2HB       ALA  31 -10.497   4.087  10.279
  235   3HB   ALA  31          3HB       ALA  31 -10.726   2.714   9.195
  236    H    GLY  32           H        GLY  32 -13.090   2.808  13.236
  237   1HA   GLY  32          2HA       GLY  32 -13.560   4.867  14.458
  238   2HA   GLY  32          1HA       GLY  32 -13.448   5.752  12.936
  239    H    ARG  33           H        ARG  33 -15.626   6.544  13.878
  240    HA   ARG  33           HA       ARG  33 -17.755   5.460  12.324
  241   1HB   ARG  33          2HB       ARG  33 -17.638   3.594  13.938
  242   2HB   ARG  33          1HB       ARG  33 -17.842   4.732  15.269
  243   1HG   ARG  33          2HG       ARG  33 -20.019   5.450  14.205
  244   2HG   ARG  33          1HG       ARG  33 -19.834   4.106  13.076
  245   1HD   ARG  33          2HD       ARG  33 -20.181   3.986  16.076
  246   2HD   ARG  33          1HD       ARG  33 -21.197   3.256  14.832
  247    HE   ARG  33           HE       ARG  33 -18.664   2.113  14.490
  248   1HH1  ARG  33          1HH1      ARG  33 -21.525   1.230  15.744
  249   2HH1  ARG  33          2HH1      ARG  33 -20.918   0.249  17.035
  250   1HH2  ARG  33          1HH2      ARG  33 -17.647   1.349  16.690
  251   2HH2  ARG  33          2HH2      ARG  33 -18.722   0.314  17.569
  252    H    GLY  34           H        GLY  34 -19.298   7.043  12.164
  253   1HA   GLY  34          2HA       GLY  34 -20.575   8.940  12.735
  254   2HA   GLY  34          1HA       GLY  34 -19.969   8.793  14.386
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1 -13.754  14.732  -6.159
    2   2H    MET   1          2HT       MET   1 -15.386  14.795  -6.632
    3   3H    MET   1          3HT       MET   1 -14.724  13.344  -6.049
    4    HA   MET   1           HA       MET   1 -15.999  15.357  -4.599
    5   1HB   MET   1          2HB       MET   1 -14.915  12.646  -4.249
    6   2HB   MET   1          1HB       MET   1 -14.898  13.608  -2.770
    7   1HG   MET   1          2HG       MET   1 -17.043  12.691  -2.698
    8   2HG   MET   1          1HG       MET   1 -17.348  14.238  -3.490
    9   1HE   MET   1          1HE       MET   1 -17.356  10.692  -3.373
   10   2HE   MET   1          2HE       MET   1 -18.058  10.088  -4.871
   11   3HE   MET   1          3HE       MET   1 -19.035  11.066  -3.781
   12    H    GLY   2           H        GLY   2 -14.171  17.039  -5.253
   13   1HA   GLY   2          2HA       GLY   2 -11.964  16.945  -3.253
   14   2HA   GLY   2          1HA       GLY   2 -11.986  17.972  -4.688
   15    H    LYS   3           H        LYS   3 -13.825  17.449  -1.663
   16    HA   LYS   3           HA       LYS   3 -14.974  20.114  -1.726
   17   1HB   LYS   3          2HB       LYS   3 -15.000  17.781   0.100
   18   2HB   LYS   3          1HB       LYS   3 -15.208  19.351   0.878
   19   1HG   LYS   3          2HG       LYS   3 -16.785  18.646  -1.590
   20   2HG   LYS   3          1HG       LYS   3 -17.328  18.117   0.003
   21   1HD   LYS   3          2HD       LYS   3 -17.173  20.507   0.774
   22   2HD   LYS   3          1HD       LYS   3 -16.840  20.969  -0.896
   23   1HE   LYS   3          2HE       LYS   3 -19.230  21.231  -0.417
   24   2HE   LYS   3          1HE       LYS   3 -18.989  19.937  -1.590
   25   1HZ   LYS   3          1HZ       LYS   3 -19.943  18.517  -0.209
   26   2HZ   LYS   3          2HZ       LYS   3 -20.264  19.786   0.874
   27   3HZ   LYS   3          3HZ       LYS   3 -18.830  18.885   1.016
   28    H    ALA   4           H        ALA   4 -12.005  18.730  -0.557
   29    HA   ALA   4           HA       ALA   4 -10.988  21.394   0.088
   30   1HB   ALA   4          1HB       ALA   4 -11.822  21.188   2.241
   31   2HB   ALA   4          2HB       ALA   4 -10.264  20.385   2.440
   32   3HB   ALA   4          3HB       ALA   4 -11.729  19.427   2.221
   33    H    GLU   5           H        GLU   5  -8.679  20.826   1.354
   34    HA   GLU   5           HA       GLU   5  -7.305  19.070  -0.597
   35   1HB   GLU   5          2HB       GLU   5  -6.636  21.512   0.516
   36   2HB   GLU   5          1HB       GLU   5  -5.658  20.380   1.453
   37   1HG   GLU   5          2HG       GLU   5  -5.764  20.500  -1.577
   38   2HG   GLU   5          1HG       GLU   5  -4.462  21.150  -0.579
   39    H    ASN   6           H        ASN   6  -7.659  16.958   0.128
   40    HA   ASN   6           HA       ASN   6  -6.926  16.362   2.956
   41   1HB   ASN   6          2HB       ASN   6  -7.991  14.065   2.204
   42   2HB   ASN   6          1HB       ASN   6  -9.029  15.418   2.649
   43   1HD2  ASN   6          1HD2      ASN   6  -7.490  13.896  -0.229
   44   2HD2  ASN   6          2HD2      ASN   6  -8.709  14.365  -1.315
   45    H    TYR   7           H        TYR   7  -5.810  14.156   3.197
   46    HA   TYR   7           HA       TYR   7  -3.530  14.091   1.335
   47   1HB   TYR   7          2HB       TYR   7  -3.646  12.089   3.499
   48   2HB   TYR   7          1HB       TYR   7  -2.351  13.197   3.061
   49    HD1  TYR   7           1HD      TYR   7  -4.322  12.402   5.705
   50    HD2  TYR   7           2HD      TYR   7  -3.348  15.831   3.310
   51    HE1  TYR   7           1HE      TYR   7  -4.962  13.893   7.581
   52    HE2  TYR   7           2HE      TYR   7  -3.986  17.322   5.186
   53    HH   TYR   7           HH       TYR   7  -5.266  15.994   8.235
   54    H    GLU   8           H        GLU   8  -5.568  11.564   2.817
   55    HA   GLU   8           HA       GLU   8  -6.422   9.577   1.904
   56   1HB   GLU   8          2HB       GLU   8  -6.234  11.423  -0.423
   57   2HB   GLU   8          1HB       GLU   8  -6.386   9.704  -0.790
   58   1HG   GLU   8          2HG       GLU   8  -8.386   9.567   0.645
   59   2HG   GLU   8          1HG       GLU   8  -8.235  11.283   1.022
   60    H    LEU   9           H        LEU   9  -4.101   8.995   2.778
   61    HA   LEU   9           HA       LEU   9  -2.542   7.836   0.500
   62   1HB   LEU   9          2HB       LEU   9  -1.494   9.698   2.029
   63   2HB   LEU   9          1HB       LEU   9  -1.321   8.383   3.193
   64    HG   LEU   9           HG       LEU   9  -0.377   8.080   0.346
   65   1HD1  LEU   9          1HD1      LEU   9   0.629  10.108   1.640
   66   2HD1  LEU   9          2HD1      LEU   9   1.735   8.969   0.874
   67   3HD1  LEU   9          3HD1      LEU   9   1.441   8.879   2.610
   68   1HD2  LEU   9          1HD2      LEU   9   0.065   6.698   2.988
   69   2HD2  LEU   9          2HD2      LEU   9   1.242   6.535   1.686
   70   3HD2  LEU   9          3HD2      LEU   9  -0.419   5.996   1.445
   71    H    TYR  10           H        TYR  10  -3.406   7.377   3.940
   72    HA   TYR  10           HA       TYR  10  -2.693   4.535   3.785
   73   1HB   TYR  10          2HB       TYR  10  -4.289   5.460   6.082
   74   2HB   TYR  10          1HB       TYR  10  -2.784   4.552   6.055
   75    HD1  TYR  10           1HD      TYR  10  -0.799   6.076   4.837
   76    HD2  TYR  10           2HD      TYR  10  -4.103   7.511   7.177
   77    HE1  TYR  10           1HE      TYR  10   0.472   8.140   5.366
   78    HE2  TYR  10           2HE      TYR  10  -2.833   9.576   7.705
   79    HH   TYR  10           HH       TYR  10  -0.703  10.471   7.710
   80    H    GLN  11           H        GLN  11  -5.114   6.075   2.403
   81    HA   GLN  11           HA       GLN  11  -7.335   4.365   3.352
   82   1HB   GLN  11          2HB       GLN  11  -7.227   6.923   2.250
   83   2HB   GLN  11          1HB       GLN  11  -7.821   5.922   0.923
   84   1HG   GLN  11          2HG       GLN  11  -9.760   5.351   2.034
   85   2HG   GLN  11          1HG       GLN  11  -9.010   5.478   3.625
   86   1HE2  GLN  11          1HE2      GLN  11  -8.077   8.007   3.831
   87   2HE2  GLN  11          2HE2      GLN  11  -9.292   9.157   3.550
   88    H    VAL  12           H        VAL  12  -4.982   3.176   2.125
   89    HA   VAL  12           HA       VAL  12  -6.085   2.141  -0.423
   90    HB   VAL  12           HB       VAL  12  -3.917   3.162  -0.682
   91   1HG1  VAL  12          1HG1      VAL  12  -3.266   3.026   1.705
   92   2HG1  VAL  12          2HG1      VAL  12  -1.983   2.463   0.633
   93   3HG1  VAL  12          3HG1      VAL  12  -2.973   1.297   1.510
   94   1HG2  VAL  12          1HG2      VAL  12  -3.601   0.145  -0.577
   95   2HG2  VAL  12          2HG2      VAL  12  -2.624   1.257  -1.532
   96   3HG2  VAL  12          3HG2      VAL  12  -4.333   1.036  -1.910
   97    H    GLU  13           H        GLU  13  -7.506   0.739   0.974
   98    HA   GLU  13           HA       GLU  13  -7.983  -1.301   2.039
   99   1HB   GLU  13          2HB       GLU  13  -6.906  -2.025  -0.163
  100   2HB   GLU  13          1HB       GLU  13  -5.415  -2.255   0.752
  101   1HG   GLU  13          2HG       GLU  13  -7.385  -3.521   2.288
  102   2HG   GLU  13          1HG       GLU  13  -7.767  -3.959   0.622
  103    H    LEU  14           H        LEU  14  -7.144   0.164   3.969
  104    HA   LEU  14           HA       LEU  14  -4.672  -0.083   5.200
  105   1HB   LEU  14          2HB       LEU  14  -7.431   0.360   6.123
  106   2HB   LEU  14          1HB       LEU  14  -6.373  -0.332   7.354
  107    HG   LEU  14           HG       LEU  14  -5.714   2.125   5.702
  108   1HD1  LEU  14          1HD1      LEU  14  -7.563   1.972   7.733
  109   2HD1  LEU  14          2HD1      LEU  14  -6.656   3.424   7.311
  110   3HD1  LEU  14          3HD1      LEU  14  -6.089   2.378   8.612
  111   1HD2  LEU  14          1HD2      LEU  14  -3.628   1.474   6.370
  112   2HD2  LEU  14          2HD2      LEU  14  -4.253   0.433   7.649
  113   3HD2  LEU  14          3HD2      LEU  14  -4.122   2.173   7.913
  114    H    GLY  15           H        GLY  15  -4.062  -1.512   7.092
  115   1HA   GLY  15          2HA       GLY  15  -3.912  -4.219   6.366
  116   2HA   GLY  15          1HA       GLY  15  -3.704  -3.640   8.019
  117    HA   PRO  16           HA       PRO  16  -7.475  -5.675   9.013
  118   1HB   PRO  16          2HB       PRO  16  -7.962  -4.408  11.392
  119   2HB   PRO  16          1HB       PRO  16  -6.720  -5.657  11.192
  120   1HG   PRO  16          2HG       PRO  16  -6.388  -2.712  11.484
  121   2HG   PRO  16          1HG       PRO  16  -5.253  -4.015  11.877
  122   1HD   PRO  16          2HD       PRO  16  -5.176  -2.363   9.571
  123   2HD   PRO  16          1HD       PRO  16  -4.230  -3.842   9.838
  124    H    GLY  17           H        GLY  17  -9.566  -4.670  10.359
  125   1HA   GLY  17          2HA       GLY  17 -10.735  -2.258  10.047
  126   2HA   GLY  17          1HA       GLY  17 -10.789  -2.848   8.387
  127    HA   PRO  18           HA       PRO  18 -14.523  -4.900   9.493
  128   1HB   PRO  18          2HB       PRO  18 -14.687  -6.544   7.296
  129   2HB   PRO  18          1HB       PRO  18 -15.066  -4.814   7.255
  130   1HG   PRO  18          2HG       PRO  18 -12.663  -6.234   6.204
  131   2HG   PRO  18          1HG       PRO  18 -13.385  -4.706   5.674
  132   1HD   PRO  18          2HD       PRO  18 -11.082  -4.974   7.297
  133   2HD   PRO  18          1HD       PRO  18 -12.006  -3.479   7.033
  134    H    SER  19           H        SER  19 -11.566  -6.665   8.813
  135    HA   SER  19           HA       SER  19 -12.222  -8.642  10.858
  136   1HB   SER  19          2HB       SER  19 -12.712  -9.223   8.043
  137   2HB   SER  19          1HB       SER  19 -11.554 -10.346   8.749
  138    HG   SER  19           HG       SER  19 -14.240 -10.037   9.213
  139    H    GLY  20           H        GLY  20 -10.334 -10.565  10.301
  140   1HA   GLY  20          2HA       GLY  20  -7.877  -9.201  10.933
  141   2HA   GLY  20          1HA       GLY  20  -8.028 -10.924  10.580
  142    H    ASP  21           H        ASP  21  -7.452 -11.656   8.549
  143    HA   ASP  21           HA       ASP  21  -6.747 -11.557   6.302
  144   1HB   ASP  21          2HB       ASP  21  -8.599  -9.719   6.232
  145   2HB   ASP  21          1HB       ASP  21  -7.246  -8.587   6.292
  146    H    MET  22           H        MET  22  -4.590 -11.969   7.104
  147    HA   MET  22           HA       MET  22  -2.869  -9.680   7.766
  148   1HB   MET  22          2HB       MET  22  -1.896 -12.484   7.226
  149   2HB   MET  22          1HB       MET  22  -1.221 -11.273   8.317
  150   1HG   MET  22          2HG       MET  22  -2.450 -12.101  10.006
  151   2HG   MET  22          1HG       MET  22  -3.925 -11.759   9.105
  152   1HE   MET  22          1HE       MET  22  -2.764 -13.832  11.160
  153   2HE   MET  22          2HE       MET  22  -1.501 -14.737  10.327
  154   3HE   MET  22          3HE       MET  22  -3.040 -15.515  10.691
  155    H    ALA  23           H        ALA  23  -3.168 -12.051   5.120
  156    HA   ALA  23           HA       ALA  23  -2.183 -10.095   3.198
  157   1HB   ALA  23          1HB       ALA  23  -0.502 -12.581   3.597
  158   2HB   ALA  23          2HB       ALA  23  -0.084 -11.024   4.311
  159   3HB   ALA  23          3HB       ALA  23  -0.154 -11.201   2.558
  160    H    ALA  24           H        ALA  24  -4.385 -10.770   2.491
  161    HA   ALA  24           HA       ALA  24  -4.574 -13.509   1.383
  162   1HB   ALA  24          1HB       ALA  24  -6.706 -13.184   2.052
  163   2HB   ALA  24          2HB       ALA  24  -6.878 -12.113   0.662
  164   3HB   ALA  24          3HB       ALA  24  -6.454 -11.449   2.240
  165    H    LYS  25           H        LYS  25  -3.300 -13.541  -0.474
  166    HA   LYS  25           HA       LYS  25  -2.689 -13.076  -2.692
  167   1HB   LYS  25          2HB       LYS  25  -5.310 -13.369  -2.763
  168   2HB   LYS  25          1HB       LYS  25  -5.296 -11.631  -3.064
  169   1HG   LYS  25          2HG       LYS  25  -3.434 -13.363  -4.644
  170   2HG   LYS  25          1HG       LYS  25  -5.144 -13.351  -5.079
  171   1HD   LYS  25          2HD       LYS  25  -4.684 -11.481  -6.262
  172   2HD   LYS  25          1HD       LYS  25  -4.558 -10.661  -4.705
  173   1HE   LYS  25          2HE       LYS  25  -2.389 -10.259  -5.147
  174   2HE   LYS  25          1HE       LYS  25  -2.098 -11.997  -5.085
  175   1HZ   LYS  25          1HZ       LYS  25  -1.376 -11.289  -7.189
  176   2HZ   LYS  25          2HZ       LYS  25  -2.766 -10.346  -7.450
  177   3HZ   LYS  25          3HZ       LYS  25  -2.871 -12.041  -7.462
  178    H    MET  26           H        MET  26  -1.231 -11.443  -1.473
  179    HA   MET  26           HA       MET  26  -1.749  -8.714  -1.206
  180   1HB   MET  26          2HB       MET  26   0.407  -9.939  -0.637
  181   2HB   MET  26          1HB       MET  26   0.838  -9.803  -2.342
  182   1HG   MET  26          2HG       MET  26   1.536  -7.690  -2.019
  183   2HG   MET  26          1HG       MET  26  -0.061  -7.240  -1.423
  184   1HE   MET  26          1HE       MET  26   3.070  -9.488   0.769
  185   2HE   MET  26          2HE       MET  26   3.813  -7.989   0.215
  186   3HE   MET  26          3HE       MET  26   2.996  -9.037  -0.941
  187    H    SER  27           H        SER  27  -2.703  -7.421  -2.704
  188    HA   SER  27           HA       SER  27  -1.540  -7.359  -5.434
  189   1HB   SER  27          2HB       SER  27  -3.791  -8.788  -5.098
  190   2HB   SER  27          1HB       SER  27  -4.512  -7.188  -5.252
  191    HG   SER  27           HG       SER  27  -2.517  -8.046  -7.046
  192    H    LYS  28           H        LYS  28  -1.574  -5.291  -6.332
  193    HA   LYS  28           HA       LYS  28  -3.219  -3.186  -5.100
  194   1HB   LYS  28          2HB       LYS  28  -0.553  -3.630  -4.212
  195   2HB   LYS  28          1HB       LYS  28  -0.539  -2.162  -5.189
  196   1HG   LYS  28          2HG       LYS  28  -2.653  -1.495  -3.840
  197   2HG   LYS  28          1HG       LYS  28  -2.143  -2.747  -2.707
  198   1HD   LYS  28          2HD       LYS  28  -0.223  -0.617  -3.646
  199   2HD   LYS  28          1HD       LYS  28  -1.299  -0.339  -2.276
  200   1HE   LYS  28          2HE       LYS  28  -0.381  -2.271  -1.107
  201   2HE   LYS  28          1HE       LYS  28   0.619  -2.677  -2.502
  202   1HZ   LYS  28          1HZ       LYS  28   1.606  -0.390  -2.237
  203   2HZ   LYS  28          2HZ       LYS  28   2.004  -1.515  -1.027
  204   3HZ   LYS  28          3HZ       LYS  28   0.838  -0.317  -0.728
  205    H    LYS  29           H        LYS  29  -3.835  -1.813  -6.704
  206    HA   LYS  29           HA       LYS  29  -3.855  -0.704  -8.771
  207   1HB   LYS  29          2HB       LYS  29  -1.090  -0.799  -7.943
  208   2HB   LYS  29          1HB       LYS  29  -1.196  -0.976  -9.695
  209   1HG   LYS  29          2HG       LYS  29  -2.120   1.118  -9.993
  210   2HG   LYS  29          1HG       LYS  29  -2.902   1.112  -8.411
  211   1HD   LYS  29          2HD       LYS  29  -0.456   1.168  -7.485
  212   2HD   LYS  29          1HD       LYS  29  -0.042   1.743  -9.102
  213   1HE   LYS  29          2HE       LYS  29  -0.517   3.783  -8.178
  214   2HE   LYS  29          1HE       LYS  29  -2.170   3.330  -8.593
  215   1HZ   LYS  29          1HZ       LYS  29  -1.677   2.138  -6.170
  216   2HZ   LYS  29          2HZ       LYS  29  -2.628   3.519  -6.446
  217   3HZ   LYS  29          3HZ       LYS  29  -0.989   3.682  -6.028
  218    H    LYS  30           H        LYS  30  -4.780  -1.704 -10.479
  219    HA   LYS  30           HA       LYS  30  -3.415  -3.408 -12.286
  220   1HB   LYS  30          2HB       LYS  30  -4.628  -5.568 -11.742
  221   2HB   LYS  30          1HB       LYS  30  -3.380  -5.109 -10.582
  222   1HG   LYS  30          2HG       LYS  30  -5.150  -4.056  -9.164
  223   2HG   LYS  30          1HG       LYS  30  -6.365  -4.669 -10.286
  224   1HD   LYS  30          2HD       LYS  30  -4.946  -6.941  -9.808
  225   2HD   LYS  30          1HD       LYS  30  -4.770  -6.119  -8.256
  226   1HE   LYS  30          2HE       LYS  30  -6.826  -6.888  -7.739
  227   2HE   LYS  30          1HE       LYS  30  -7.456  -5.750  -8.930
  228   1HZ   LYS  30          1HZ       LYS  30  -8.275  -7.784  -9.632
  229   2HZ   LYS  30          2HZ       LYS  30  -6.843  -8.617  -9.257
  230   3HZ   LYS  30          3HZ       LYS  30  -6.901  -7.584 -10.604
  231    H    ALA  31           H        ALA  31  -6.522  -2.613 -10.786
  232    HA   ALA  31           HA       ALA  31  -7.925  -3.081 -13.350
  233   1HB   ALA  31          1HB       ALA  31  -8.713  -3.394 -10.735
  234   2HB   ALA  31          2HB       ALA  31  -9.817  -3.255 -12.102
  235   3HB   ALA  31          3HB       ALA  31  -9.421  -1.830 -11.141
  236    H    GLY  32           H        GLY  32  -6.915  -0.439 -11.235
  237   1HA   GLY  32          2HA       GLY  32  -7.310   1.439 -13.483
  238   2HA   GLY  32          1HA       GLY  32  -8.206   1.791 -12.003
  239    H    ARG  33           H        ARG  33  -6.483   3.717 -12.677
  240    HA   ARG  33           HA       ARG  33  -3.964   3.197 -11.171
  241   1HB   ARG  33          2HB       ARG  33  -3.087   5.189 -12.262
  242   2HB   ARG  33          1HB       ARG  33  -3.791   4.133 -13.488
  243   1HG   ARG  33          2HG       ARG  33  -5.355   5.666 -14.045
  244   2HG   ARG  33          1HG       ARG  33  -5.761   5.966 -12.356
  245   1HD   ARG  33          2HD       ARG  33  -4.776   7.948 -13.637
  246   2HD   ARG  33          1HD       ARG  33  -3.994   7.549 -12.107
  247    HE   ARG  33           HE       ARG  33  -2.850   6.411 -14.602
  248   1HH1  ARG  33          1HH2      ARG  33  -1.676   6.587 -11.718
  249   2HH1  ARG  33          2HH2      ARG  33  -0.450   7.786 -11.971
  250   1HH2  ARG  33          1HH1      ARG  33  -1.718   8.821 -15.028
  251   2HH2  ARG  33          2HH1      ARG  33  -0.475   9.052 -13.843
  252    H    GLY  34           H        GLY  34  -6.337   3.476  -9.664
  253   1HA   GLY  34          2HA       GLY  34  -5.770   5.086  -7.568
  254   2HA   GLY  34          1HA       GLY  34  -6.432   6.262  -8.705
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1 -15.586  13.747 -14.788
    2   2H    MET   1          2HT       MET   1 -16.353  12.440 -14.019
    3   3H    MET   1          3HT       MET   1 -15.262  13.416 -13.156
    4    HA   MET   1           HA       MET   1 -16.764  15.324 -13.441
    5   1HB   MET   1          2HB       MET   1 -18.234  13.220 -14.969
    6   2HB   MET   1          1HB       MET   1 -19.192  14.370 -14.034
    7   1HG   MET   1          2HG       MET   1 -17.759  16.199 -15.143
    8   2HG   MET   1          1HG       MET   1 -17.254  14.944 -16.275
    9   1HE   MET   1          1HE       MET   1 -19.704  17.591 -15.402
   10   2HE   MET   1          2HE       MET   1 -20.417  16.297 -14.443
   11   3HE   MET   1          3HE       MET   1 -21.308  16.969 -15.806
   12    H    GLY   2           H        GLY   2 -17.449  15.714 -11.386
   13   1HA   GLY   2          2HA       GLY   2 -19.033  15.093  -9.564
   14   2HA   GLY   2          1HA       GLY   2 -18.567  13.414  -9.834
   15    H    LYS   3           H        LYS   3 -18.096  15.933  -7.769
   16    HA   LYS   3           HA       LYS   3 -16.509  16.361  -6.096
   17   1HB   LYS   3          2HB       LYS   3 -15.623  13.544  -6.792
   18   2HB   LYS   3          1HB       LYS   3 -15.180  14.430  -5.333
   19   1HG   LYS   3          2HG       LYS   3 -17.143  13.942  -4.332
   20   2HG   LYS   3          1HG       LYS   3 -18.066  14.416  -5.759
   21   1HD   LYS   3          2HD       LYS   3 -17.370  12.202  -6.801
   22   2HD   LYS   3          1HD       LYS   3 -16.769  11.739  -5.208
   23   1HE   LYS   3          2HE       LYS   3 -18.868  11.497  -4.338
   24   2HE   LYS   3          1HE       LYS   3 -19.521  12.841  -5.273
   25   1HZ   LYS   3          1HZ       LYS   3 -19.082  10.049  -6.119
   26   2HZ   LYS   3          2HZ       LYS   3 -19.199  11.298  -7.264
   27   3HZ   LYS   3          3HZ       LYS   3 -20.497  10.977  -6.216
   28    H    ALA   4           H        ALA   4 -13.913  16.053  -5.769
   29    HA   ALA   4           HA       ALA   4 -12.553  16.434  -8.385
   30   1HB   ALA   4          1HB       ALA   4 -12.261  18.378  -6.075
   31   2HB   ALA   4          2HB       ALA   4 -13.263  18.682  -7.494
   32   3HB   ALA   4          3HB       ALA   4 -11.518  18.507  -7.669
   33    H    GLU   5           H        GLU   5 -11.629  16.977  -4.974
   34    HA   GLU   5           HA       GLU   5  -9.310  15.175  -5.397
   35   1HB   GLU   5          2HB       GLU   5  -9.082  17.476  -4.320
   36   2HB   GLU   5          1HB       GLU   5  -9.956  16.817  -2.935
   37   1HG   GLU   5          2HG       GLU   5  -8.241  15.302  -2.410
   38   2HG   GLU   5          1HG       GLU   5  -7.539  15.393  -4.026
   39    H    ASN   6           H        ASN   6  -8.938  13.364  -3.985
   40    HA   ASN   6           HA       ASN   6 -11.042  12.635  -2.058
   41   1HB   ASN   6          2HB       ASN   6 -11.323  11.787  -4.690
   42   2HB   ASN   6          1HB       ASN   6 -10.571  10.406  -3.891
   43   1HD2  ASN   6          1HD2      ASN   6 -11.772   9.344  -2.162
   44   2HD2  ASN   6          2HD2      ASN   6 -13.419   9.657  -1.904
   45    H    TYR   7           H        TYR   7  -8.227  11.373  -3.884
   46    HA   TYR   7           HA       TYR   7  -7.319   9.372  -2.262
   47   1HB   TYR   7          2HB       TYR   7  -5.982  11.452  -3.893
   48   2HB   TYR   7          1HB       TYR   7  -4.961  10.597  -2.736
   49    HD1  TYR   7           1HD      TYR   7  -3.759   8.955  -3.896
   50    HD2  TYR   7           2HD      TYR   7  -7.936   9.508  -4.704
   51    HE1  TYR   7           1HE      TYR   7  -3.735   6.972  -5.372
   52    HE2  TYR   7           2HE      TYR   7  -7.920   7.531  -6.182
   53    HH   TYR   7           HH       TYR   7  -6.576   5.472  -6.488
   54    H    GLU   8           H        GLU   8  -5.566   9.378  -0.605
   55    HA   GLU   8           HA       GLU   8  -5.311  11.780   1.060
   56   1HB   GLU   8          2HB       GLU   8  -7.056   9.466   1.822
   57   2HB   GLU   8          1HB       GLU   8  -6.119  10.264   3.086
   58   1HG   GLU   8          2HG       GLU   8  -7.230  12.337   1.527
   59   2HG   GLU   8          1HG       GLU   8  -8.530  11.170   1.780
   60    H    LEU   9           H        LEU   9  -5.082   8.717   2.667
   61    HA   LEU   9           HA       LEU   9  -2.142   8.678   2.156
   62   1HB   LEU   9          2HB       LEU   9  -3.156   9.573   4.461
   63   2HB   LEU   9          1HB       LEU   9  -3.221   7.855   4.821
   64    HG   LEU   9           HG       LEU   9  -1.085   8.574   5.600
   65   1HD1  LEU   9          1HD1      LEU   9  -0.904   7.296   2.870
   66   2HD1  LEU   9          2HD1      LEU   9  -0.699   6.543   4.451
   67   3HD1  LEU   9          3HD1      LEU   9   0.538   7.629   3.824
   68   1HD2  LEU   9          1HD2      LEU   9  -1.405  10.562   3.621
   69   2HD2  LEU   9          2HD2      LEU   9   0.077   9.700   3.209
   70   3HD2  LEU   9          3HD2      LEU   9  -0.102  10.433   4.803
   71    H    TYR  10           H        TYR  10  -2.513   6.313   4.313
   72    HA   TYR  10           HA       TYR  10  -2.496   4.225   2.347
   73   1HB   TYR  10          2HB       TYR  10  -2.835   2.774   4.510
   74   2HB   TYR  10          1HB       TYR  10  -1.317   3.618   4.241
   75    HD1  TYR  10           1HD      TYR  10  -4.499   5.267   5.181
   76    HD2  TYR  10           2HD      TYR  10  -0.670   3.889   6.540
   77    HE1  TYR  10           1HE      TYR  10  -4.817   6.499   7.308
   78    HE2  TYR  10           2HE      TYR  10  -0.983   5.123   8.669
   79    HH   TYR  10           HH       TYR  10  -3.945   7.018   9.274
   80    H    GLN  11           H        GLN  11  -5.092   6.001   3.417
   81    HA   GLN  11           HA       GLN  11  -7.000   3.738   3.424
   82   1HB   GLN  11          2HB       GLN  11  -7.000   6.151   4.748
   83   2HB   GLN  11          1HB       GLN  11  -8.072   6.488   3.387
   84   1HG   GLN  11          2HG       GLN  11  -9.721   5.263   4.307
   85   2HG   GLN  11          1HG       GLN  11  -8.647   3.874   4.486
   86   1HE2  GLN  11          1HE2      GLN  11 -10.675   5.308   6.399
   87   2HE2  GLN  11          2HE2      GLN  11  -9.785   5.487   7.832
   88    H    VAL  12           H        VAL  12  -5.422   4.388   1.068
   89    HA   VAL  12           HA       VAL  12  -7.470   5.406  -0.811
   90    HB   VAL  12           HB       VAL  12  -5.388   6.591  -0.957
   91   1HG1  VAL  12          1HG1      VAL  12  -4.019   4.816   0.145
   92   2HG1  VAL  12          2HG1      VAL  12  -3.252   5.488  -1.292
   93   3HG1  VAL  12          3HG1      VAL  12  -4.037   3.912  -1.368
   94   1HG2  VAL  12          1HG2      VAL  12  -5.634   4.545  -3.184
   95   2HG2  VAL  12          2HG2      VAL  12  -4.694   6.035  -3.290
   96   3HG2  VAL  12          3HG2      VAL  12  -6.446   6.108  -3.110
   97    H    GLU  13           H        GLU  13  -8.715   3.579  -1.264
   98    HA   GLU  13           HA       GLU  13  -9.208   1.418  -2.062
   99   1HB   GLU  13          2HB       GLU  13  -8.119   2.695  -4.051
  100   2HB   GLU  13          1HB       GLU  13  -6.708   1.687  -3.727
  101   1HG   GLU  13          2HG       GLU  13  -8.933  -0.052  -3.676
  102   2HG   GLU  13          1HG       GLU  13  -9.155   0.985  -5.087
  103    H    LEU  14           H        LEU  14  -7.409   1.619   0.286
  104    HA   LEU  14           HA       LEU  14  -5.186  -0.066   0.209
  105   1HB   LEU  14          2HB       LEU  14  -5.338  -0.177   2.529
  106   2HB   LEU  14          1HB       LEU  14  -6.289   1.264   2.189
  107    HG   LEU  14           HG       LEU  14  -7.335  -1.527   2.735
  108   1HD1  LEU  14          1HD1      LEU  14  -6.841  -0.441   4.786
  109   2HD1  LEU  14          2HD1      LEU  14  -8.567  -0.165   4.544
  110   3HD1  LEU  14          3HD1      LEU  14  -7.409   1.118   4.191
  111   1HD2  LEU  14          1HD2      LEU  14  -8.567  -0.272   0.904
  112   2HD2  LEU  14          2HD2      LEU  14  -8.943   0.963   2.103
  113   3HD2  LEU  14          3HD2      LEU  14  -9.549  -0.680   2.310
  114    H    GLY  15           H        GLY  15  -5.296  -2.358   1.451
  115   1HA   GLY  15          2HA       GLY  15  -7.435  -3.952   0.092
  116   2HA   GLY  15          1HA       GLY  15  -5.761  -4.506   0.172
  117    HA   PRO  16           HA       PRO  16  -6.566  -6.400   4.035
  118   1HB   PRO  16          2HB       PRO  16  -4.128  -6.102   5.272
  119   2HB   PRO  16          1HB       PRO  16  -4.425  -7.247   3.952
  120   1HG   PRO  16          2HG       PRO  16  -2.978  -4.636   3.884
  121   2HG   PRO  16          1HG       PRO  16  -2.763  -6.065   2.860
  122   1HD   PRO  16          2HD       PRO  16  -4.145  -3.713   2.131
  123   2HD   PRO  16          1HD       PRO  16  -4.231  -5.274   1.284
  124    H    GLY  17           H        GLY  17  -8.080  -4.599   4.683
  125   1HA   GLY  17          2HA       GLY  17  -6.876  -2.706   6.650
  126   2HA   GLY  17          1HA       GLY  17  -8.459  -2.505   5.891
  127    HA   PRO  18           HA       PRO  18  -9.382  -4.341   9.956
  128   1HB   PRO  18          2HB       PRO  18 -11.620  -2.793  10.358
  129   2HB   PRO  18          1HB       PRO  18  -9.982  -2.278  10.798
  130   1HG   PRO  18          2HG       PRO  18 -11.678  -1.388   8.512
  131   2HG   PRO  18          1HG       PRO  18 -10.378  -0.522   9.349
  132   1HD   PRO  18          2HD       PRO  18 -10.162  -1.820   6.841
  133   2HD   PRO  18          1HD       PRO  18  -8.811  -1.237   7.835
  134    H    SER  19           H        SER  19 -11.489  -3.624   7.196
  135    HA   SER  19           HA       SER  19 -12.990  -6.144   7.795
  136   1HB   SER  19          2HB       SER  19 -14.179  -3.892   6.193
  137   2HB   SER  19          1HB       SER  19 -14.999  -5.161   7.098
  138    HG   SER  19           HG       SER  19 -13.555  -2.938   8.113
  139    H    GLY  20           H        GLY  20 -13.907  -7.142   5.737
  140   1HA   GLY  20          2HA       GLY  20 -12.122  -6.572   3.406
  141   2HA   GLY  20          1HA       GLY  20 -12.440  -8.227   3.928
  142    H    ASP  21           H        ASP  21 -14.393  -9.195   3.355
  143    HA   ASP  21           HA       ASP  21 -15.889  -7.846   1.213
  144   1HB   ASP  21          2HB       ASP  21 -15.202 -10.460   1.653
  145   2HB   ASP  21          1HB       ASP  21 -16.877 -10.445   2.203
  146    H    MET  22           H        MET  22 -16.274  -6.484   3.614
  147    HA   MET  22           HA       MET  22 -18.560  -7.363   5.105
  148   1HB   MET  22          2HB       MET  22 -18.684  -5.070   5.921
  149   2HB   MET  22          1HB       MET  22 -16.988  -5.553   5.839
  150   1HG   MET  22          2HG       MET  22 -16.587  -3.787   4.503
  151   2HG   MET  22          1HG       MET  22 -17.652  -4.501   3.292
  152   1HE   MET  22          1HE       MET  22 -18.146  -0.660   5.345
  153   2HE   MET  22          2HE       MET  22 -16.844  -1.451   4.462
  154   3HE   MET  22          3HE       MET  22 -17.185  -1.925   6.123
  155    H    ALA  23           H        ALA  23 -20.772  -6.913   4.795
  156    HA   ALA  23           HA       ALA  23 -21.558  -5.351   2.406
  157   1HB   ALA  23          1HB       ALA  23 -22.984  -7.929   2.646
  158   2HB   ALA  23          2HB       ALA  23 -21.296  -8.063   2.152
  159   3HB   ALA  23          3HB       ALA  23 -22.417  -7.085   1.204
  160    H    ALA  24           H        ALA  24 -22.432  -3.912   4.035
  161    HA   ALA  24           HA       ALA  24 -24.934  -4.976   5.289
  162   1HB   ALA  24          1HB       ALA  24 -22.987  -4.338   6.862
  163   2HB   ALA  24          2HB       ALA  24 -24.569  -3.644   7.214
  164   3HB   ALA  24          3HB       ALA  24 -23.338  -2.671   6.409
  165    H    LYS  25           H        LYS  25 -24.138  -3.395   2.713
  166    HA   LYS  25           HA       LYS  25 -26.516  -1.721   2.704
  167   1HB   LYS  25          2HB       LYS  25 -25.148   0.378   2.111
  168   2HB   LYS  25          1HB       LYS  25 -25.187  -0.087   3.811
  169   1HG   LYS  25          2HG       LYS  25 -22.940  -0.189   3.794
  170   2HG   LYS  25          1HG       LYS  25 -23.044  -1.520   2.642
  171   1HD   LYS  25          2HD       LYS  25 -22.875  -0.069   0.776
  172   2HD   LYS  25          1HD       LYS  25 -23.237   1.357   1.749
  173   1HE   LYS  25          2HE       LYS  25 -21.037   0.478   3.049
  174   2HE   LYS  25          1HE       LYS  25 -20.675  -0.113   1.427
  175   1HZ   LYS  25          1HZ       LYS  25 -21.127   2.663   2.323
  176   2HZ   LYS  25          2HZ       LYS  25 -21.336   2.230   0.694
  177   3HZ   LYS  25          3HZ       LYS  25 -19.824   2.029   1.442
  178    H    MET  26           H        MET  26 -26.684  -3.379   0.937
  179    HA   MET  26           HA       MET  26 -25.690  -2.222  -1.589
  180   1HB   MET  26          2HB       MET  26 -24.527  -4.582  -0.374
  181   2HB   MET  26          1HB       MET  26 -25.283  -4.992  -1.915
  182   1HG   MET  26          2HG       MET  26 -23.570  -2.535  -1.743
  183   2HG   MET  26          1HG       MET  26 -22.794  -4.114  -1.858
  184   1HE   MET  26          1HE       MET  26 -23.180  -5.758  -3.270
  185   2HE   MET  26          2HE       MET  26 -23.190  -5.510  -5.016
  186   3HE   MET  26          3HE       MET  26 -24.697  -5.867  -4.175
  187    H    SER  27           H        SER  27 -27.181  -2.523  -3.226
  188    HA   SER  27           HA       SER  27 -29.708  -3.847  -2.484
  189   1HB   SER  27          2HB       SER  27 -29.263  -1.580  -3.854
  190   2HB   SER  27          1HB       SER  27 -29.289  -2.706  -5.209
  191    HG   SER  27           HG       SER  27 -31.270  -2.734  -3.194
  192    H    LYS  28           H        LYS  28 -30.736  -5.040  -4.562
  193    HA   LYS  28           HA       LYS  28 -28.694  -6.750  -5.873
  194   1HB   LYS  28          2HB       LYS  28 -29.950  -7.640  -3.589
  195   2HB   LYS  28          1HB       LYS  28 -30.999  -8.275  -4.856
  196   1HG   LYS  28          2HG       LYS  28 -29.396  -9.971  -4.644
  197   2HG   LYS  28          1HG       LYS  28 -28.758  -9.018  -5.986
  198   1HD   LYS  28          2HD       LYS  28 -26.854  -8.793  -4.803
  199   2HD   LYS  28          1HD       LYS  28 -27.756  -7.775  -3.680
  200   1HE   LYS  28          2HE       LYS  28 -27.860  -9.402  -2.097
  201   2HE   LYS  28          1HE       LYS  28 -28.167 -10.666  -3.287
  202   1HZ   LYS  28          1HZ       LYS  28 -25.912 -10.893  -3.742
  203   2HZ   LYS  28          2HZ       LYS  28 -25.958 -10.714  -2.053
  204   3HZ   LYS  28          3HZ       LYS  28 -25.509  -9.403  -3.037
  205    H    LYS  29           H        LYS  29 -29.399  -5.618  -7.794
  206    HA   LYS  29           HA       LYS  29 -31.750  -6.863  -9.031
  207   1HB   LYS  29          2HB       LYS  29 -32.650  -4.859  -7.783
  208   2HB   LYS  29          1HB       LYS  29 -31.636  -3.842  -8.807
  209   1HG   LYS  29          2HG       LYS  29 -33.489  -3.809 -10.143
  210   2HG   LYS  29          1HG       LYS  29 -32.850  -5.356 -10.702
  211   1HD   LYS  29          2HD       LYS  29 -34.316  -6.593  -9.312
  212   2HD   LYS  29          1HD       LYS  29 -34.706  -5.183  -8.327
  213   1HE   LYS  29          2HE       LYS  29 -35.513  -5.667 -11.207
  214   2HE   LYS  29          1HE       LYS  29 -36.579  -5.610  -9.804
  215   1HZ   LYS  29          1HZ       LYS  29 -36.810  -3.480 -10.449
  216   2HZ   LYS  29          2HZ       LYS  29 -35.327  -3.442 -11.278
  217   3HZ   LYS  29          3HZ       LYS  29 -35.365  -3.260  -9.588
  218    H    LYS  30           H        LYS  30 -29.366  -7.406  -9.946
  219    HA   LYS  30           HA       LYS  30 -28.420  -5.401 -11.876
  220   1HB   LYS  30          2HB       LYS  30 -27.474  -7.999 -10.824
  221   2HB   LYS  30          1HB       LYS  30 -27.074  -7.687 -12.513
  222   1HG   LYS  30          2HG       LYS  30 -26.507  -5.264 -11.364
  223   2HG   LYS  30          1HG       LYS  30 -26.062  -6.379 -10.071
  224   1HD   LYS  30          2HD       LYS  30 -25.139  -7.394 -12.613
  225   2HD   LYS  30          1HD       LYS  30 -24.550  -5.751 -12.369
  226   1HE   LYS  30          2HE       LYS  30 -24.269  -8.039 -10.398
  227   2HE   LYS  30          1HE       LYS  30 -22.979  -7.384 -11.404
  228   1HZ   LYS  30          1HZ       LYS  30 -22.603  -5.918  -9.807
  229   2HZ   LYS  30          2HZ       LYS  30 -23.961  -6.435  -8.926
  230   3HZ   LYS  30          3HZ       LYS  30 -24.122  -5.228 -10.110
  231    H    ALA  31           H        ALA  31 -30.562  -8.126 -11.814
  232    HA   ALA  31           HA       ALA  31 -31.894  -9.074 -13.497
  233   1HB   ALA  31          1HB       ALA  31 -31.767  -7.419 -15.682
  234   2HB   ALA  31          2HB       ALA  31 -31.344  -6.313 -14.375
  235   3HB   ALA  31          3HB       ALA  31 -32.870  -7.195 -14.324
  236    H    GLY  32           H        GLY  32 -31.673 -10.308 -15.470
  237   1HA   GLY  32          2HA       GLY  32 -29.497 -10.178 -17.267
  238   2HA   GLY  32          1HA       GLY  32 -29.019 -11.268 -15.963
  239    H    ARG  33           H        ARG  33 -31.238 -10.814 -18.642
  240    HA   ARG  33           HA       ARG  33 -32.710 -12.320 -19.691
  241   1HB   ARG  33          2HB       ARG  33 -30.320 -13.304 -19.988
  242   2HB   ARG  33          1HB       ARG  33 -30.829 -14.489 -18.782
  243   1HG   ARG  33          2HG       ARG  33 -32.839 -14.982 -20.208
  244   2HG   ARG  33          1HG       ARG  33 -32.159 -13.924 -21.446
  245   1HD   ARG  33          2HD       ARG  33 -30.931 -16.467 -20.349
  246   2HD   ARG  33          1HD       ARG  33 -31.524 -16.194 -21.986
  247    HE   ARG  33           HE       ARG  33 -29.490 -14.267 -21.366
  248   1HH1  ARG  33          1HH2      ARG  33 -29.856 -17.672 -21.667
  249   2HH1  ARG  33          2HH2      ARG  33 -28.370 -17.894 -22.529
  250   1HH2  ARG  33          1HH1      ARG  33 -27.622 -14.510 -22.644
  251   2HH2  ARG  33          2HH1      ARG  33 -27.104 -16.105 -23.079
  252    H    GLY  34           H        GLY  34 -32.984 -11.860 -16.703
  253   1HA   GLY  34          2HA       GLY  34 -35.020 -13.901 -16.267
  254   2HA   GLY  34          1HA       GLY  34 -33.630 -14.081 -15.195
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1  -7.315  27.093 -12.491
    2   2H    MET   1          2HT       MET   1  -6.436  27.016 -11.039
    3   3H    MET   1          3HT       MET   1  -7.088  25.601 -11.718
    4    HA   MET   1           HA       MET   1  -5.601  25.700 -13.566
    5   1HB   MET   1          2HB       MET   1  -5.353  28.458 -12.623
    6   2HB   MET   1          1HB       MET   1  -3.787  27.714 -12.946
    7   1HG   MET   1          2HG       MET   1  -5.841  27.148 -14.984
    8   2HG   MET   1          1HG       MET   1  -5.385  28.848 -14.865
    9   1HE   MET   1          1HE       MET   1  -3.458  25.972 -17.404
   10   2HE   MET   1          2HE       MET   1  -5.092  26.567 -17.121
   11   3HE   MET   1          3HE       MET   1  -4.422  25.320 -16.072
   12    H    GLY   2           H        GLY   2  -5.757  25.027 -10.527
   13   1HA   GLY   2          2HA       GLY   2  -3.376  23.501 -10.365
   14   2HA   GLY   2          1HA       GLY   2  -3.088  25.012  -9.501
   15    H    LYS   3           H        LYS   3  -3.473  22.138  -8.554
   16    HA   LYS   3           HA       LYS   3  -5.457  22.818  -6.440
   17   1HB   LYS   3          2HB       LYS   3  -6.133  21.126  -8.478
   18   2HB   LYS   3          1HB       LYS   3  -5.464  19.991  -7.305
   19   1HG   LYS   3          2HG       LYS   3  -6.985  21.554  -5.674
   20   2HG   LYS   3          1HG       LYS   3  -7.932  21.615  -7.162
   21   1HD   LYS   3          2HD       LYS   3  -8.524  19.425  -7.020
   22   2HD   LYS   3          1HD       LYS   3  -6.921  18.931  -6.475
   23   1HE   LYS   3          2HE       LYS   3  -7.425  19.252  -4.246
   24   2HE   LYS   3          1HE       LYS   3  -8.586  20.535  -4.586
   25   1HZ   LYS   3          1HZ       LYS   3  -9.855  18.564  -5.727
   26   2HZ   LYS   3          2HZ       LYS   3  -9.995  18.849  -4.058
   27   3HZ   LYS   3          3HZ       LYS   3  -8.956  17.633  -4.631
   28    H    ALA   4           H        ALA   4  -5.163  21.464  -4.485
   29    HA   ALA   4           HA       ALA   4  -2.932  19.671  -4.208
   30   1HB   ALA   4          1HB       ALA   4  -1.292  21.005  -3.200
   31   2HB   ALA   4          2HB       ALA   4  -2.437  22.291  -2.816
   32   3HB   ALA   4          3HB       ALA   4  -1.892  22.061  -4.478
   33    H    GLU   5           H        GLU   5  -5.304  19.067  -3.356
   34    HA   GLU   5           HA       GLU   5  -5.123  19.286  -0.413
   35   1HB   GLU   5          2HB       GLU   5  -6.611  21.163  -1.249
   36   2HB   GLU   5          1HB       GLU   5  -7.709  19.922  -1.854
   37   1HG   GLU   5          2HG       GLU   5  -7.446  18.985   0.626
   38   2HG   GLU   5          1HG       GLU   5  -7.068  20.675   0.968
   39    H    ASN   6           H        ASN   6  -4.477  16.991  -1.368
   40    HA   ASN   6           HA       ASN   6  -6.861  15.277  -0.968
   41   1HB   ASN   6          2HB       ASN   6  -5.863  15.766  -3.535
   42   2HB   ASN   6          1HB       ASN   6  -5.179  14.203  -3.089
   43   1HD2  ASN   6          1HD2      ASN   6  -6.541  12.693  -4.099
   44   2HD2  ASN   6          2HD2      ASN   6  -8.232  12.674  -3.945
   45    H    TYR   7           H        TYR   7  -6.208  14.076   0.754
   46    HA   TYR   7           HA       TYR   7  -3.355  13.311   0.978
   47   1HB   TYR   7          2HB       TYR   7  -5.022  12.332   3.137
   48   2HB   TYR   7          1HB       TYR   7  -3.670  13.452   3.201
   49    HD1  TYR   7           1HD      TYR   7  -7.259  13.103   3.334
   50    HD2  TYR   7           2HD      TYR   7  -4.074  15.906   2.662
   51    HE1  TYR   7           1HE      TYR   7  -8.825  14.982   3.741
   52    HE2  TYR   7           2HE      TYR   7  -5.642  17.785   3.069
   53    HH   TYR   7           HH       TYR   7  -7.915  18.011   4.450
   54    H    GLU   8           H        GLU   8  -6.231  11.497   1.994
   55    HA   GLU   8           HA       GLU   8  -6.626   9.173   1.806
   56   1HB   GLU   8          2HB       GLU   8  -5.986   9.966  -1.050
   57   2HB   GLU   8          1HB       GLU   8  -6.765   8.454  -0.583
   58   1HG   GLU   8          2HG       GLU   8  -8.412  10.083   0.706
   59   2HG   GLU   8          1HG       GLU   8  -7.838  11.250  -0.486
   60    H    LEU   9           H        LEU   9  -4.016   9.616   2.724
   61    HA   LEU   9           HA       LEU   9  -2.033   8.301   1.107
   62   1HB   LEU   9          2HB       LEU   9  -1.524   9.823   3.030
   63   2HB   LEU   9          1HB       LEU   9  -2.081   8.568   4.129
   64    HG   LEU   9           HG       LEU   9  -0.046   7.821   2.072
   65   1HD1  LEU   9          1HD1      LEU   9   0.514   9.430   4.581
   66   2HD1  LEU   9          2HD1      LEU   9   0.903   9.881   2.921
   67   3HD1  LEU   9          3HD1      LEU   9   1.749   8.540   3.690
   68   1HD2  LEU   9          1HD2      LEU   9  -1.033   6.916   4.724
   69   2HD2  LEU   9          2HD2      LEU   9   0.696   6.714   4.439
   70   3HD2  LEU   9          3HD2      LEU   9  -0.471   5.965   3.348
   71    H    TYR  10           H        TYR  10  -2.845   6.955   4.286
   72    HA   TYR  10           HA       TYR  10  -2.607   4.279   3.224
   73   1HB   TYR  10          2HB       TYR  10  -3.391   3.644   5.577
   74   2HB   TYR  10          1HB       TYR  10  -1.858   4.488   5.433
   75    HD1  TYR  10           1HD      TYR  10  -4.844   6.487   4.823
   76    HD2  TYR  10           2HD      TYR  10  -2.152   5.076   7.854
   77    HE1  TYR  10           1HE      TYR  10  -5.681   8.228   6.374
   78    HE2  TYR  10           2HE      TYR  10  -2.982   6.825   9.404
   79    HH   TYR  10           HH       TYR  10  -5.442   9.185   8.364
   80    H    GLN  11           H        GLN  11  -5.067   6.381   2.837
   81    HA   GLN  11           HA       GLN  11  -7.243   4.422   3.317
   82   1HB   GLN  11          2HB       GLN  11  -7.116   7.228   3.405
   83   2HB   GLN  11          1HB       GLN  11  -8.031   6.862   1.941
   84   1HG   GLN  11          2HG       GLN  11  -8.620   5.692   4.676
   85   2HG   GLN  11          1HG       GLN  11  -9.490   7.047   3.957
   86   1HE2  GLN  11          1HE2      GLN  11 -11.103   6.572   2.388
   87   2HE2  GLN  11          2HE2      GLN  11 -11.470   4.998   1.872
   88    H    VAL  12           H        VAL  12  -5.166   3.938   1.342
   89    HA   VAL  12           HA       VAL  12  -6.604   4.253  -1.224
   90    HB   VAL  12           HB       VAL  12  -4.345   4.996  -1.338
   91   1HG1  VAL  12          1HG1      VAL  12  -3.506   3.954   0.684
   92   2HG1  VAL  12          2HG1      VAL  12  -2.466   3.498  -0.665
   93   3HG1  VAL  12          3HG1      VAL  12  -3.649   2.351  -0.037
   94   1HG2  VAL  12          1HG2      VAL  12  -4.298   2.164  -2.413
   95   2HG2  VAL  12          2HG2      VAL  12  -3.439   3.566  -3.050
   96   3HG2  VAL  12          3HG2      VAL  12  -5.194   3.470  -3.190
   97    H    GLU  13           H        GLU  13  -8.174   2.558  -0.838
   98    HA   GLU  13           HA       GLU  13  -8.923   0.322  -0.715
   99   1HB   GLU  13          2HB       GLU  13  -6.702   0.416  -2.726
  100   2HB   GLU  13          1HB       GLU  13  -7.387  -1.152  -2.296
  101   1HG   GLU  13          2HG       GLU  13  -9.148   1.183  -3.049
  102   2HG   GLU  13          1HG       GLU  13  -8.472   0.104  -4.272
  103    H    LEU  14           H        LEU  14  -7.483   0.901   1.553
  104    HA   LEU  14           HA       LEU  14  -5.187  -0.539   2.183
  105   1HB   LEU  14          2HB       LEU  14  -7.421   0.581   3.652
  106   2HB   LEU  14          1HB       LEU  14  -6.891  -0.932   4.390
  107    HG   LEU  14           HG       LEU  14  -5.034   1.347   3.647
  108   1HD1  LEU  14          1HD1      LEU  14  -6.458   0.620   6.199
  109   2HD1  LEU  14          2HD1      LEU  14  -6.277   2.205   5.449
  110   3HD1  LEU  14          3HD1      LEU  14  -4.902   1.448   6.251
  111   1HD2  LEU  14          1HD2      LEU  14  -4.631  -1.413   4.365
  112   2HD2  LEU  14          2HD2      LEU  14  -3.990  -0.381   5.644
  113   3HD2  LEU  14          3HD2      LEU  14  -3.420  -0.189   3.986
  114    H    GLY  15           H        GLY  15  -4.819  -2.688   2.989
  115   1HA   GLY  15          2HA       GLY  15  -6.909  -4.642   2.118
  116   2HA   GLY  15          1HA       GLY  15  -5.179  -4.988   2.152
  117    HA   PRO  16           HA       PRO  16  -7.295  -5.991   6.280
  118   1HB   PRO  16          2HB       PRO  16  -8.049  -8.598   5.837
  119   2HB   PRO  16          1HB       PRO  16  -9.122  -7.211   5.581
  120   1HG   PRO  16          2HG       PRO  16  -7.726  -8.900   3.559
  121   2HG   PRO  16          1HG       PRO  16  -9.226  -7.971   3.401
  122   1HD   PRO  16          2HD       PRO  16  -6.685  -7.193   2.425
  123   2HD   PRO  16          1HD       PRO  16  -8.112  -6.145   2.576
  124    H    GLY  17           H        GLY  17  -4.907  -5.855   6.673
  125   1HA   GLY  17          2HA       GLY  17  -3.722  -8.586   6.940
  126   2HA   GLY  17          1HA       GLY  17  -2.751  -7.238   6.344
  127    HA   PRO  18           HA       PRO  18  -2.766  -7.395  11.053
  128   1HB   PRO  18          2HB       PRO  18  -0.359  -8.665  11.438
  129   2HB   PRO  18          1HB       PRO  18  -1.914  -9.513  11.368
  130   1HG   PRO  18          2HG       PRO  18   0.250  -9.391   9.321
  131   2HG   PRO  18          1HG       PRO  18  -0.975 -10.642   9.585
  132   1HD   PRO  18          2HD       PRO  18  -1.042  -8.646   7.574
  133   2HD   PRO  18          1HD       PRO  18  -2.392  -9.700   8.049
  134    H    SER  19           H        SER  19   0.009  -7.023   8.832
  135    HA   SER  19           HA       SER  19   1.217  -4.959  10.539
  136   1HB   SER  19          2HB       SER  19   2.470  -6.659   9.037
  137   2HB   SER  19          1HB       SER  19   2.031  -5.595   7.704
  138    HG   SER  19           HG       SER  19   3.180  -3.961   8.643
  139    H    GLY  20           H        GLY  20   1.393  -2.736   9.946
  140   1HA   GLY  20          2HA       GLY  20   0.135  -1.728   7.522
  141   2HA   GLY  20          1HA       GLY  20  -0.834  -1.425   8.963
  142    H    ASP  21           H        ASP  21  -0.391   0.891   8.419
  143    HA   ASP  21           HA       ASP  21   0.731   2.898   8.876
  144   1HB   ASP  21          2HB       ASP  21   2.356   1.128  10.730
  145   2HB   ASP  21          1HB       ASP  21   2.295   2.891  10.775
  146    H    MET  22           H        MET  22   2.092   3.812   7.427
  147    HA   MET  22           HA       MET  22   4.314   2.178   6.332
  148   1HB   MET  22          2HB       MET  22   3.140   4.830   5.443
  149   2HB   MET  22          1HB       MET  22   4.450   3.985   4.618
  150   1HG   MET  22          2HG       MET  22   2.703   1.966   4.720
  151   2HG   MET  22          1HG       MET  22   1.549   3.297   4.774
  152   1HE   MET  22          1HE       MET  22   2.676   0.871   2.435
  153   2HE   MET  22          2HE       MET  22   4.255   1.416   3.000
  154   3HE   MET  22          3HE       MET  22   3.814   1.620   1.306
  155    H    ALA  23           H        ALA  23   5.671   2.393   8.254
  156    HA   ALA  23           HA       ALA  23   6.908   5.110   8.475
  157   1HB   ALA  23          1HB       ALA  23   7.312   3.323  10.766
  158   2HB   ALA  23          2HB       ALA  23   5.617   3.722  10.491
  159   3HB   ALA  23          3HB       ALA  23   6.797   5.009  10.737
  160    H    ALA  24           H        ALA  24   8.080   3.837   6.555
  161    HA   ALA  24           HA       ALA  24  10.717   3.194   7.521
  162   1HB   ALA  24          1HB       ALA  24  10.704   0.812   6.618
  163   2HB   ALA  24          2HB       ALA  24   8.944   0.919   6.606
  164   3HB   ALA  24          3HB       ALA  24   9.825   1.053   8.127
  165    H    LYS  25           H        LYS  25   8.372   2.906   4.869
  166    HA   LYS  25           HA       LYS  25  10.556   3.761   3.015
  167   1HB   LYS  25          2HB       LYS  25   8.482   1.600   2.653
  168   2HB   LYS  25          1HB       LYS  25   9.220   2.396   1.263
  169   1HG   LYS  25          2HG       LYS  25  11.473   1.806   2.185
  170   2HG   LYS  25          1HG       LYS  25  10.667   0.893   3.462
  171   1HD   LYS  25          2HD       LYS  25  10.151  -0.829   2.074
  172   2HD   LYS  25          1HD       LYS  25   9.722   0.250   0.745
  173   1HE   LYS  25          2HE       LYS  25  12.579   0.330   1.338
  174   2HE   LYS  25          1HE       LYS  25  12.035  -1.294   0.914
  175   1HZ   LYS  25          1HZ       LYS  25  11.810  -0.692  -1.191
  176   2HZ   LYS  25          2HZ       LYS  25  12.535   0.795  -0.812
  177   3HZ   LYS  25          3HZ       LYS  25  10.843   0.640  -0.781
  178    H    MET  26           H        MET  26   9.316   5.832   3.888
  179    HA   MET  26           HA       MET  26   6.885   6.320   2.233
  180   1HB   MET  26          2HB       MET  26   7.470   6.965   4.875
  181   2HB   MET  26          1HB       MET  26   7.717   8.485   4.017
  182   1HG   MET  26          2HG       MET  26   5.469   8.123   2.915
  183   2HG   MET  26          1HG       MET  26   5.226   6.765   4.015
  184   1HE   MET  26          1HE       MET  26   4.369   7.194   6.696
  185   2HE   MET  26          2HE       MET  26   3.509   7.140   5.160
  186   3HE   MET  26          3HE       MET  26   3.127   8.400   6.332
  187    H    SER  27           H        SER  27   6.821   8.710   1.391
  188    HA   SER  27           HA       SER  27   9.381   9.935   0.756
  189   1HB   SER  27          2HB       SER  27   7.932   8.966  -1.677
  190   2HB   SER  27          1HB       SER  27   9.639   9.348  -1.472
  191    HG   SER  27           HG       SER  27   8.616   6.994  -1.448
  192    H    LYS  28           H        LYS  28   8.885  11.637  -1.152
  193    HA   LYS  28           HA       LYS  28   6.497  13.108  -0.218
  194   1HB   LYS  28          2HB       LYS  28   8.848  14.129  -0.575
  195   2HB   LYS  28          1HB       LYS  28   8.466  14.065  -2.295
  196   1HG   LYS  28          2HG       LYS  28   6.173  15.163  -1.221
  197   2HG   LYS  28          1HG       LYS  28   7.441  15.875  -0.222
  198   1HD   LYS  28          2HD       LYS  28   8.212  15.851  -3.022
  199   2HD   LYS  28          1HD       LYS  28   6.683  16.701  -2.791
  200   1HE   LYS  28          2HE       LYS  28   8.370  18.353  -2.476
  201   2HE   LYS  28          1HE       LYS  28   7.832  17.924  -0.853
  202   1HZ   LYS  28          1HZ       LYS  28   9.772  16.926  -0.369
  203   2HZ   LYS  28          2HZ       LYS  28  10.380  17.946  -1.585
  204   3HZ   LYS  28          3HZ       LYS  28   9.999  16.329  -1.941
  205    H    LYS  29           H        LYS  29   4.697  12.215  -1.221
  206    HA   LYS  29           HA       LYS  29   4.712  12.290  -4.210
  207   1HB   LYS  29          2HB       LYS  29   3.222  10.322  -4.206
  208   2HB   LYS  29          1HB       LYS  29   4.761   9.946  -3.432
  209   1HG   LYS  29          2HG       LYS  29   3.734  10.347  -1.213
  210   2HG   LYS  29          1HG       LYS  29   2.190  10.680  -1.999
  211   1HD   LYS  29          2HD       LYS  29   2.521   8.339  -3.104
  212   2HD   LYS  29          1HD       LYS  29   3.680   8.071  -1.802
  213   1HE   LYS  29          2HE       LYS  29   0.989   9.168  -1.092
  214   2HE   LYS  29          1HE       LYS  29   1.114   7.454  -1.489
  215   1HZ   LYS  29          1HZ       LYS  29   1.592   7.371   0.714
  216   2HZ   LYS  29          2HZ       LYS  29   2.256   8.933   0.758
  217   3HZ   LYS  29          3HZ       LYS  29   3.161   7.640   0.129
  218    H    LYS  30           H        LYS  30   3.145  13.610  -5.002
  219    HA   LYS  30           HA       LYS  30   0.970  14.449  -3.136
  220   1HB   LYS  30          2HB       LYS  30   1.873  15.788  -5.703
  221   2HB   LYS  30          1HB       LYS  30   0.769  16.449  -4.496
  222   1HG   LYS  30          2HG       LYS  30   3.619  15.663  -3.851
  223   2HG   LYS  30          1HG       LYS  30   3.167  17.292  -4.352
  224   1HD   LYS  30          2HD       LYS  30   1.510  17.346  -2.463
  225   2HD   LYS  30          1HD       LYS  30   2.156  15.796  -1.918
  226   1HE   LYS  30          2HE       LYS  30   3.318  17.452  -0.654
  227   2HE   LYS  30          1HE       LYS  30   4.452  16.918  -1.894
  228   1HZ   LYS  30          1HZ       LYS  30   3.024  19.458  -1.645
  229   2HZ   LYS  30          2HZ       LYS  30   3.312  18.867  -3.211
  230   3HZ   LYS  30          3HZ       LYS  30   4.614  19.153  -2.156
  231    H    ALA  31           H        ALA  31  -0.854  15.412  -5.003
  232    HA   ALA  31           HA       ALA  31  -2.378  13.156  -5.672
  233   1HB   ALA  31          1HB       ALA  31  -3.684  14.617  -7.109
  234   2HB   ALA  31          2HB       ALA  31  -2.351  15.767  -7.213
  235   3HB   ALA  31          3HB       ALA  31  -3.195  15.531  -5.682
  236    H    GLY  32           H        GLY  32  -1.050  11.557  -6.657
  237   1HA   GLY  32          2HA       GLY  32  -0.414  12.133  -9.519
  238   2HA   GLY  32          1HA       GLY  32   0.749  11.285  -8.499
  239    H    ARG  33           H        ARG  33  -0.364  10.134 -10.850
  240    HA   ARG  33           HA       ARG  33  -1.784   7.826  -9.615
  241   1HB   ARG  33          2HB       ARG  33  -2.941   9.706 -11.445
  242   2HB   ARG  33          1HB       ARG  33  -2.775   8.153 -12.267
  243   1HG   ARG  33          2HG       ARG  33  -3.719   7.252  -9.930
  244   2HG   ARG  33          1HG       ARG  33  -4.418   8.871  -9.882
  245   1HD   ARG  33          2HD       ARG  33  -4.686   7.023 -12.265
  246   2HD   ARG  33          1HD       ARG  33  -5.885   7.117 -10.975
  247    HE   ARG  33           HE       ARG  33  -5.381   9.756 -11.933
  248   1HH1  ARG  33          1HH1      ARG  33  -7.749   7.488 -11.846
  249   2HH1  ARG  33          2HH1      ARG  33  -8.458   7.858 -13.382
  250   1HH2  ARG  33          1HH2      ARG  33  -5.862   9.930 -14.378
  251   2HH2  ARG  33          2HH2      ARG  33  -7.389   9.240 -14.817
  252    H    GLY  34           H        GLY  34  -0.291   6.230  -9.897
  253   1HA   GLY  34          2HA       GLY  34   1.290   4.851 -10.952
  254   2HA   GLY  34          1HA       GLY  34   0.321   5.114 -12.404
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1 -15.855   7.729   0.027
    2   2H    MET   1          2HT       MET   1 -17.491   7.681  -0.426
    3   3H    MET   1          3HT       MET   1 -16.942   6.750   0.886
    4    HA   MET   1           HA       MET   1 -16.203   9.309   1.524
    5   1HB   MET   1          2HB       MET   1 -18.341  10.548   1.324
    6   2HB   MET   1          1HB       MET   1 -17.675  10.146  -0.260
    7   1HG   MET   1          2HG       MET   1 -19.642   9.160  -0.747
    8   2HG   MET   1          1HG       MET   1 -19.250   7.931   0.456
    9   1HE   MET   1          1HE       MET   1 -21.735   8.202  -0.356
   10   2HE   MET   1          2HE       MET   1 -22.546   9.761  -0.240
   11   3HE   MET   1          3HE       MET   1 -22.864   8.519   0.968
   12    H    GLY   2           H        GLY   2 -16.356   6.806   2.728
   13   1HA   GLY   2          2HA       GLY   2 -18.732   6.887   4.506
   14   2HA   GLY   2          1HA       GLY   2 -17.569   5.565   4.409
   15    H    LYS   3           H        LYS   3 -17.316   5.642   6.741
   16    HA   LYS   3           HA       LYS   3 -16.309   8.091   7.987
   17   1HB   LYS   3          2HB       LYS   3 -16.395   5.261   9.075
   18   2HB   LYS   3          1HB       LYS   3 -16.134   6.730  10.014
   19   1HG   LYS   3          2HG       LYS   3 -18.338   7.347   9.921
   20   2HG   LYS   3          1HG       LYS   3 -18.566   6.672   8.307
   21   1HD   LYS   3          2HD       LYS   3 -18.272   4.366   9.477
   22   2HD   LYS   3          1HD       LYS   3 -18.611   5.253  10.963
   23   1HE   LYS   3          2HE       LYS   3 -20.809   5.453  10.466
   24   2HE   LYS   3          1HE       LYS   3 -20.471   5.909   8.797
   25   1HZ   LYS   3          1HZ       LYS   3 -21.352   3.444   9.761
   26   2HZ   LYS   3          2HZ       LYS   3 -19.783   3.216   9.151
   27   3HZ   LYS   3          3HZ       LYS   3 -20.996   3.874   8.160
   28    H    ALA   4           H        ALA   4 -14.284   8.687   7.297
   29    HA   ALA   4           HA       ALA   4 -12.047   6.904   7.941
   30   1HB   ALA   4          1HB       ALA   4 -11.347   7.691   5.361
   31   2HB   ALA   4          2HB       ALA   4 -13.033   7.197   5.209
   32   3HB   ALA   4          3HB       ALA   4 -11.838   6.070   5.851
   33    H    GLU   5           H        GLU   5 -10.030   8.079   8.014
   34    HA   GLU   5           HA       GLU   5 -10.444  11.027   8.145
   35   1HB   GLU   5          2HB       GLU   5  -8.063   9.482   9.188
   36   2HB   GLU   5          1HB       GLU   5  -8.591  11.103   9.644
   37   1HG   GLU   5          2HG       GLU   5  -9.937  10.265  11.239
   38   2HG   GLU   5          1HG       GLU   5 -10.746   9.233  10.059
   39    H    ASN   6           H        ASN   6  -7.692   8.882   7.319
   40    HA   ASN   6           HA       ASN   6  -6.548  10.878   5.553
   41   1HB   ASN   6          2HB       ASN   6  -5.887   8.124   6.428
   42   2HB   ASN   6          1HB       ASN   6  -5.275   8.592   4.842
   43   1HD2  ASN   6          1HD2      ASN   6  -4.761  11.347   5.273
   44   2HD2  ASN   6          2HD2      ASN   6  -3.542  11.507   6.443
   45    H    TYR   7           H        TYR   7  -7.554  11.358   3.656
   46    HA   TYR   7           HA       TYR   7  -9.045   9.256   2.212
   47   1HB   TYR   7          2HB       TYR   7  -8.826  11.858   0.882
   48   2HB   TYR   7          1HB       TYR   7 -10.263  10.952   1.341
   49    HD1  TYR   7           1HD      TYR   7  -7.822  13.487   2.401
   50    HD2  TYR   7           2HD      TYR   7 -11.304  11.242   3.537
   51    HE1  TYR   7           1HE      TYR   7  -8.190  15.024   4.310
   52    HE2  TYR   7           2HE      TYR   7 -11.671  12.778   5.447
   53    HH   TYR   7           HH       TYR   7 -11.055  14.718   6.389
   54    H    GLU   8           H        GLU   8  -6.099  11.146   1.972
   55    HA   GLU   8           HA       GLU   8  -5.500   9.771  -0.618
   56   1HB   GLU   8          2HB       GLU   8  -4.231  12.287   0.501
   57   2HB   GLU   8          1HB       GLU   8  -3.964  11.598  -1.102
   58   1HG   GLU   8          2HG       GLU   8  -6.041  12.259  -1.885
   59   2HG   GLU   8          1HG       GLU   8  -6.773  12.226  -0.280
   60    H    LEU   9           H        LEU   9  -5.038   9.062   2.413
   61    HA   LEU   9           HA       LEU   9  -2.094   8.646   2.233
   62   1HB   LEU   9          2HB       LEU   9  -3.571   9.645   4.290
   63   2HB   LEU   9          1HB       LEU   9  -3.530   7.938   4.722
   64    HG   LEU   9           HG       LEU   9  -0.917   8.767   3.827
   65   1HD1  LEU   9          1HD1      LEU   9  -2.072  10.359   6.138
   66   2HD1  LEU   9          2HD1      LEU   9  -1.694  11.020   4.546
   67   3HD1  LEU   9          3HD1      LEU   9  -0.402  10.404   5.576
   68   1HD2  LEU   9          1HD2      LEU   9  -2.218   7.350   6.030
   69   2HD2  LEU   9          2HD2      LEU   9  -0.817   8.277   6.565
   70   3HD2  LEU   9          3HD2      LEU   9  -0.641   7.065   5.294
   71    H    TYR  10           H        TYR  10  -2.549   6.441   4.334
   72    HA   TYR  10           HA       TYR  10  -2.488   4.238   2.515
   73   1HB   TYR  10          2HB       TYR  10  -2.969   2.940   4.774
   74   2HB   TYR  10          1HB       TYR  10  -1.408   3.698   4.478
   75    HD1  TYR  10           1HD      TYR  10  -4.642   5.351   5.304
   76    HD2  TYR  10           2HD      TYR  10  -0.700   4.326   6.650
   77    HE1  TYR  10           1HE      TYR  10  -4.960   6.774   7.308
   78    HE2  TYR  10           2HE      TYR  10  -1.014   5.752   8.656
   79    HH   TYR  10           HH       TYR  10  -3.286   6.573   9.986
   80    H    GLN  11           H        GLN  11  -5.136   6.051   3.519
   81    HA   GLN  11           HA       GLN  11  -7.034   3.780   3.467
   82   1HB   GLN  11          2HB       GLN  11  -7.056   6.368   4.624
   83   2HB   GLN  11          1HB       GLN  11  -8.299   6.377   3.373
   84   1HG   GLN  11          2HG       GLN  11  -8.036   4.259   5.528
   85   2HG   GLN  11          1HG       GLN  11  -9.182   5.600   5.568
   86   1HE2  GLN  11          1HE2      GLN  11  -9.562   2.540   5.252
   87   2HE2  GLN  11          2HE2      GLN  11 -10.561   2.400   3.886
   88    H    VAL  12           H        VAL  12  -5.506   4.164   1.146
   89    HA   VAL  12           HA       VAL  12  -7.451   5.291  -0.790
   90    HB   VAL  12           HB       VAL  12  -5.347   6.436  -0.879
   91   1HG1  VAL  12          1HG1      VAL  12  -4.061   4.658   0.305
   92   2HG1  VAL  12          2HG1      VAL  12  -3.221   5.287  -1.113
   93   3HG1  VAL  12          3HG1      VAL  12  -4.037   3.726  -1.193
   94   1HG2  VAL  12          1HG2      VAL  12  -5.407   4.368  -3.098
   95   2HG2  VAL  12          2HG2      VAL  12  -4.641   5.954  -3.175
   96   3HG2  VAL  12          3HG2      VAL  12  -6.396   5.827  -3.061
   97    H    GLU  13           H        GLU  13  -8.672   3.268  -0.836
   98    HA   GLU  13           HA       GLU  13  -9.084   1.047  -1.522
   99   1HB   GLU  13          2HB       GLU  13  -7.764   2.534  -3.653
  100   2HB   GLU  13          1HB       GLU  13  -7.440   0.804  -3.773
  101   1HG   GLU  13          2HG       GLU  13 -10.221   1.281  -3.099
  102   2HG   GLU  13          1HG       GLU  13  -9.782   2.134  -4.579
  103    H    LEU  14           H        LEU  14  -7.822   0.321   0.424
  104    HA   LEU  14           HA       LEU  14  -5.130  -0.261   0.598
  105   1HB   LEU  14          2HB       LEU  14  -7.599  -1.539   1.638
  106   2HB   LEU  14          1HB       LEU  14  -6.143  -2.532   1.683
  107    HG   LEU  14           HG       LEU  14  -6.524  -1.121   3.752
  108   1HD1  LEU  14          1HD1      LEU  14  -4.066   0.007   3.307
  109   2HD1  LEU  14          2HD1      LEU  14  -4.098  -1.256   2.077
  110   3HD1  LEU  14          3HD1      LEU  14  -4.318  -1.675   3.776
  111   1HD2  LEU  14          1HD2      LEU  14  -7.293   0.848   2.188
  112   2HD2  LEU  14          2HD2      LEU  14  -5.569   1.206   2.104
  113   3HD2  LEU  14          3HD2      LEU  14  -6.395   1.213   3.662
  114    H    GLY  15           H        GLY  15  -4.073  -2.499   0.337
  115   1HA   GLY  15          2HA       GLY  15  -5.109  -4.007  -2.000
  116   2HA   GLY  15          1HA       GLY  15  -3.500  -3.294  -2.137
  117    HA   PRO  16           HA       PRO  16  -3.249  -7.458  -0.018
  118   1HB   PRO  16          2HB       PRO  16  -2.090  -8.836  -2.096
  119   2HB   PRO  16          1HB       PRO  16  -3.841  -8.752  -1.832
  120   1HG   PRO  16          2HG       PRO  16  -2.185  -7.361  -3.882
  121   2HG   PRO  16          1HG       PRO  16  -3.898  -7.809  -3.939
  122   1HD   PRO  16          2HD       PRO  16  -2.872  -5.221  -3.409
  123   2HD   PRO  16          1HD       PRO  16  -4.549  -5.753  -3.163
  124    H    GLY  17           H        GLY  17  -1.591  -6.220   1.180
  125   1HA   GLY  17          2HA       GLY  17   0.623  -5.851   1.864
  126   2HA   GLY  17          1HA       GLY  17   1.064  -7.189   0.804
  127    HA   PRO  18           HA       PRO  18   1.349  -3.093  -1.709
  128   1HB   PRO  18          2HB       PRO  18   1.504  -0.820  -0.169
  129   2HB   PRO  18          1HB       PRO  18  -0.015  -1.470  -0.809
  130   1HG   PRO  18          2HG       PRO  18   1.035  -1.556   1.981
  131   2HG   PRO  18          1HG       PRO  18  -0.641  -1.602   1.411
  132   1HD   PRO  18          2HD       PRO  18   0.879  -3.830   2.279
  133   2HD   PRO  18          1HD       PRO  18  -0.670  -3.894   1.411
  134    H    SER  19           H        SER  19   2.850  -2.045   1.371
  135    HA   SER  19           HA       SER  19   5.458  -3.083   0.784
  136   1HB   SER  19          2HB       SER  19   6.606  -1.197  -0.069
  137   2HB   SER  19          1HB       SER  19   5.120  -1.254  -1.013
  138    HG   SER  19           HG       SER  19   4.583   0.594  -0.182
  139    H    GLY  20           H        GLY  20   5.430  -3.535   3.022
  140   1HA   GLY  20          2HA       GLY  20   6.694  -2.160   4.898
  141   2HA   GLY  20          1HA       GLY  20   5.194  -1.229   4.882
  142    H    ASP  21           H        ASP  21   4.133  -1.811   6.733
  143    HA   ASP  21           HA       ASP  21   4.231  -4.581   7.706
  144   1HB   ASP  21          2HB       ASP  21   2.757  -3.694   9.525
  145   2HB   ASP  21          1HB       ASP  21   4.256  -2.782   9.349
  146    H    MET  22           H        MET  22   1.903  -5.411   8.474
  147    HA   MET  22           HA       MET  22  -0.126  -4.863   6.373
  148   1HB   MET  22          2HB       MET  22   1.558  -7.056   6.191
  149   2HB   MET  22          1HB       MET  22   0.125  -7.719   6.978
  150   1HG   MET  22          2HG       MET  22  -1.228  -6.498   5.159
  151   2HG   MET  22          1HG       MET  22   0.307  -6.317   4.311
  152   1HE   MET  22          1HE       MET  22   1.946  -8.035   4.468
  153   2HE   MET  22          2HE       MET  22   1.569  -9.072   3.094
  154   3HE   MET  22          3HE       MET  22   1.696  -9.772   4.706
  155    H    ALA  23           H        ALA  23  -1.902  -6.910   7.103
  156    HA   ALA  23           HA       ALA  23  -3.675  -7.153   8.636
  157   1HB   ALA  23          1HB       ALA  23  -1.211  -7.406  10.378
  158   2HB   ALA  23          2HB       ALA  23  -2.162  -8.710   9.664
  159   3HB   ALA  23          3HB       ALA  23  -2.841  -7.735  10.968
  160    H    ALA  24           H        ALA  24  -4.121  -4.762   8.175
  161    HA   ALA  24           HA       ALA  24  -3.787  -3.201  10.708
  162   1HB   ALA  24          1HB       ALA  24  -2.465  -2.110   9.022
  163   2HB   ALA  24          2HB       ALA  24  -3.938  -1.158   9.204
  164   3HB   ALA  24          3HB       ALA  24  -3.759  -2.252   7.831
  165    H    LYS  25           H        LYS  25  -5.913  -4.590  10.969
  166    HA   LYS  25           HA       LYS  25  -8.147  -2.755  10.368
  167   1HB   LYS  25          2HB       LYS  25  -7.698  -5.013   8.754
  168   2HB   LYS  25          1HB       LYS  25  -9.000  -5.479   9.850
  169   1HG   LYS  25          2HG       LYS  25  -9.095  -2.791   8.515
  170   2HG   LYS  25          1HG       LYS  25  -9.577  -4.226   7.609
  171   1HD   LYS  25          2HD       LYS  25 -11.513  -4.431   8.761
  172   2HD   LYS  25          1HD       LYS  25 -10.712  -4.158  10.309
  173   1HE   LYS  25          2HE       LYS  25 -11.940  -2.220  10.242
  174   2HE   LYS  25          1HE       LYS  25 -10.553  -1.665   9.305
  175   1HZ   LYS  25          1HZ       LYS  25 -13.201  -1.848   8.479
  176   2HZ   LYS  25          2HZ       LYS  25 -12.339  -3.028   7.612
  177   3HZ   LYS  25          3HZ       LYS  25 -11.853  -1.402   7.551
  178    H    MET  26           H        MET  26  -7.902  -2.540  12.732
  179    HA   MET  26           HA       MET  26  -9.565  -4.530  14.136
  180   1HB   MET  26          2HB       MET  26  -7.002  -5.118  14.269
  181   2HB   MET  26          1HB       MET  26  -6.954  -3.791  15.431
  182   1HG   MET  26          2HG       MET  26  -9.144  -5.779  15.767
  183   2HG   MET  26          1HG       MET  26  -7.512  -6.322  16.162
  184   1HE   MET  26          1HE       MET  26  -6.684  -5.546  19.166
  185   2HE   MET  26          2HE       MET  26  -7.351  -6.749  18.065
  186   3HE   MET  26          3HE       MET  26  -8.325  -6.159  19.410
  187    H    SER  27           H        SER  27 -11.054  -3.237  15.108
  188    HA   SER  27           HA       SER  27 -10.215  -1.103  16.898
  189   1HB   SER  27          2HB       SER  27 -10.586  -0.390  14.208
  190   2HB   SER  27          1HB       SER  27 -12.062   0.119  15.023
  191    HG   SER  27           HG       SER  27 -10.937   1.481  16.237
  192    H    LYS  28           H        LYS  28 -11.671  -1.144  18.533
  193    HA   LYS  28           HA       LYS  28 -14.450  -2.065  17.907
  194   1HB   LYS  28          2HB       LYS  28 -12.535  -2.825  20.034
  195   2HB   LYS  28          1HB       LYS  28 -14.190  -2.542  20.579
  196   1HG   LYS  28          2HG       LYS  28 -14.581  -4.010  18.281
  197   2HG   LYS  28          1HG       LYS  28 -13.109  -4.730  18.936
  198   1HD   LYS  28          2HD       LYS  28 -15.229  -4.188  20.926
  199   2HD   LYS  28          1HD       LYS  28 -15.619  -5.431  19.737
  200   1HE   LYS  28          2HE       LYS  28 -13.122  -6.212  20.318
  201   2HE   LYS  28          1HE       LYS  28 -13.507  -5.416  21.844
  202   1HZ   LYS  28          1HZ       LYS  28 -15.318  -6.825  22.201
  203   2HZ   LYS  28          2HZ       LYS  28 -14.093  -7.856  21.635
  204   3HZ   LYS  28          3HZ       LYS  28 -15.344  -7.367  20.594
  205    H    LYS  29           H        LYS  29 -16.130  -0.803  18.729
  206    HA   LYS  29           HA       LYS  29 -15.457   1.386  20.612
  207   1HB   LYS  29          2HB       LYS  29 -15.546   1.888  17.892
  208   2HB   LYS  29          1HB       LYS  29 -17.175   2.309  18.421
  209   1HG   LYS  29          2HG       LYS  29 -16.458   4.124  19.579
  210   2HG   LYS  29          1HG       LYS  29 -15.060   3.265  20.228
  211   1HD   LYS  29          2HD       LYS  29 -14.335   5.089  18.743
  212   2HD   LYS  29          1HD       LYS  29 -13.899   3.523  18.058
  213   1HE   LYS  29          2HE       LYS  29 -15.987   3.597  16.681
  214   2HE   LYS  29          1HE       LYS  29 -16.288   5.225  17.292
  215   1HZ   LYS  29          1HZ       LYS  29 -14.806   6.072  15.894
  216   2HZ   LYS  29          2HZ       LYS  29 -14.776   4.564  15.113
  217   3HZ   LYS  29          3HZ       LYS  29 -13.626   4.926  16.311
  218    H    LYS  30           H        LYS  30 -18.073  -0.041  18.627
  219    HA   LYS  30           HA       LYS  30 -19.694  -0.615  20.936
  220   1HB   LYS  30          2HB       LYS  30 -19.963   2.032  19.689
  221   2HB   LYS  30          1HB       LYS  30 -21.484   1.145  19.786
  222   1HG   LYS  30          2HG       LYS  30 -20.029   0.816  22.249
  223   2HG   LYS  30          1HG       LYS  30 -20.167   2.534  21.875
  224   1HD   LYS  30          2HD       LYS  30 -22.172   2.153  23.002
  225   2HD   LYS  30          1HD       LYS  30 -22.667   1.916  21.325
  226   1HE   LYS  30          2HE       LYS  30 -22.157  -0.554  21.646
  227   2HE   LYS  30          1HE       LYS  30 -21.996  -0.214  23.367
  228   1HZ   LYS  30          1HZ       LYS  30 -24.262  -0.952  22.516
  229   2HZ   LYS  30          2HZ       LYS  30 -24.396   0.605  21.851
  230   3HZ   LYS  30          3HZ       LYS  30 -24.219   0.407  23.529
  231    H    ALA  31           H        ALA  31 -19.444  -2.560  19.468
  232    HA   ALA  31           HA       ALA  31 -21.822  -3.248  18.179
  233   1HB   ALA  31          1HB       ALA  31 -21.644  -1.741  16.416
  234   2HB   ALA  31          2HB       ALA  31 -20.826  -3.143  15.730
  235   3HB   ALA  31          3HB       ALA  31 -19.882  -1.813  16.399
  236    H    GLY  32           H        GLY  32 -20.695  -4.965  19.587
  237   1HA   GLY  32          2HA       GLY  32 -18.406  -6.376  18.583
  238   2HA   GLY  32          1HA       GLY  32 -19.573  -7.022  19.738
  239    H    ARG  33           H        ARG  33 -18.404  -7.320  16.596
  240    HA   ARG  33           HA       ARG  33 -20.924  -8.575  15.616
  241   1HB   ARG  33          2HB       ARG  33 -18.855  -7.039  14.367
  242   2HB   ARG  33          1HB       ARG  33 -18.862  -8.650  13.645
  243   1HG   ARG  33          2HG       ARG  33 -21.274  -8.466  13.217
  244   2HG   ARG  33          1HG       ARG  33 -21.298  -6.872  13.974
  245   1HD   ARG  33          2HD       ARG  33 -20.821  -5.991  11.955
  246   2HD   ARG  33          1HD       ARG  33 -19.234  -6.752  12.069
  247    HE   ARG  33           HE       ARG  33 -21.302  -8.569  11.104
  248   1HH1  ARG  33          1HH1      ARG  33 -19.579  -5.784  10.124
  249   2HH1  ARG  33          2HH1      ARG  33 -19.158  -6.413   8.565
  250   1HH2  ARG  33          1HH2      ARG  33 -20.519  -9.544   9.168
  251   2HH2  ARG  33          2HH2      ARG  33 -19.689  -8.542   8.026
  252    H    GLY  34           H        GLY  34 -21.039 -10.778  15.324
  253   1HA   GLY  34          2HA       GLY  34 -20.117 -12.971  14.914
  254   2HA   GLY  34          1HA       GLY  34 -18.533 -12.366  15.402
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1 -19.806  18.132   2.725
    2   2H    MET   1          2HT       MET   1 -19.841  19.826   2.605
    3   3H    MET   1          3HT       MET   1 -18.804  18.922   1.608
    4    HA   MET   1           HA       MET   1 -21.599  18.207   1.407
    5   1HB   MET   1          2HB       MET   1 -22.098  20.183  -0.028
    6   2HB   MET   1          1HB       MET   1 -21.828  20.631   1.657
    7   1HG   MET   1          2HG       MET   1 -20.063  21.915   1.099
    8   2HG   MET   1          1HG       MET   1 -19.324  20.591   0.198
    9   1HE   MET   1          1HE       MET   1 -18.274  21.979  -1.032
   10   2HE   MET   1          2HE       MET   1 -18.853  23.404  -1.891
   11   3HE   MET   1          3HE       MET   1 -18.797  21.849  -2.717
   12    H    GLY   2           H        GLY   2 -19.373  16.755   0.728
   13   1HA   GLY   2          2HA       GLY   2 -19.663  15.895  -1.828
   14   2HA   GLY   2          1HA       GLY   2 -18.656  17.324  -2.070
   15    H    LYS   3           H        LYS   3 -16.720  16.329  -2.623
   16    HA   LYS   3           HA       LYS   3 -15.312  14.955  -0.422
   17   1HB   LYS   3          2HB       LYS   3 -16.361  13.582  -2.782
   18   2HB   LYS   3          1HB       LYS   3 -14.619  13.377  -2.603
   19   1HG   LYS   3          2HG       LYS   3 -15.061  12.788  -0.165
   20   2HG   LYS   3          1HG       LYS   3 -16.773  12.709  -0.588
   21   1HD   LYS   3          2HD       LYS   3 -16.437  10.590  -1.269
   22   2HD   LYS   3          1HD       LYS   3 -15.441  11.227  -2.578
   23   1HE   LYS   3          2HE       LYS   3 -14.214   9.550  -1.219
   24   2HE   LYS   3          1HE       LYS   3 -13.454  11.140  -1.142
   25   1HZ   LYS   3          1HZ       LYS   3 -14.037  11.418   1.009
   26   2HZ   LYS   3          2HZ       LYS   3 -14.014   9.719   1.009
   27   3HZ   LYS   3          3HZ       LYS   3 -15.488  10.552   0.861
   28    H    ALA   4           H        ALA   4 -13.003  15.014  -0.708
   29    HA   ALA   4           HA       ALA   4 -11.988  16.443  -3.100
   30   1HB   ALA   4          1HB       ALA   4 -12.133  17.546  -0.350
   31   2HB   ALA   4          2HB       ALA   4 -12.059  18.388  -1.899
   32   3HB   ALA   4          3HB       ALA   4 -10.585  17.749  -1.172
   33    H    GLU   5           H        GLU   5 -10.432  15.050  -3.786
   34    HA   GLU   5           HA       GLU   5  -9.053  13.258  -1.956
   35   1HB   GLU   5          2HB       GLU   5  -8.449  13.907  -4.857
   36   2HB   GLU   5          1HB       GLU   5  -7.821  12.531  -3.950
   37   1HG   GLU   5          2HG       GLU   5 -10.697  12.636  -3.708
   38   2HG   GLU   5          1HG       GLU   5 -10.236  12.648  -5.411
   39    H    ASN   6           H        ASN   6  -8.110  14.882  -0.509
   40    HA   ASN   6           HA       ASN   6  -5.767  16.298  -1.712
   41   1HB   ASN   6          2HB       ASN   6  -7.673  17.589  -0.475
   42   2HB   ASN   6          1HB       ASN   6  -6.924  16.951   0.990
   43   1HD2  ASN   6          1HD2      ASN   6  -5.857  18.545  -2.078
   44   2HD2  ASN   6          2HD2      ASN   6  -4.704  19.538  -1.326
   45    H    TYR   7           H        TYR   7  -6.851  14.441   1.131
   46    HA   TYR   7           HA       TYR   7  -4.108  14.143   2.107
   47   1HB   TYR   7          2HB       TYR   7  -6.182  12.313   3.151
   48   2HB   TYR   7          1HB       TYR   7  -5.051  13.344   4.019
   49    HD1  TYR   7           1HD      TYR   7  -5.531  15.802   4.257
   50    HD2  TYR   7           2HD      TYR   7  -8.408  13.036   2.673
   51    HE1  TYR   7           1HE      TYR   7  -7.334  17.458   4.644
   52    HE2  TYR   7           2HE      TYR   7 -10.212  14.689   3.060
   53    HH   TYR   7           HH       TYR   7 -10.482  17.087   3.331
   54    H    GLU   8           H        GLU   8  -6.573  11.711   1.264
   55    HA   GLU   8           HA       GLU   8  -6.275   9.528   0.425
   56   1HB   GLU   8          2HB       GLU   8  -4.654  11.342  -1.341
   57   2HB   GLU   8          1HB       GLU   8  -4.623   9.600  -1.620
   58   1HG   GLU   8          2HG       GLU   8  -7.322  10.139  -1.258
   59   2HG   GLU   8          1HG       GLU   8  -6.748  11.529  -2.181
   60    H    LEU   9           H        LEU   9  -5.150   9.061   2.568
   61    HA   LEU   9           HA       LEU   9  -2.213   8.708   2.304
   62   1HB   LEU   9          2HB       LEU   9  -3.642   9.606   4.400
   63   2HB   LEU   9          1HB       LEU   9  -3.664   7.883   4.773
   64    HG   LEU   9           HG       LEU   9  -1.021   8.419   3.991
   65   1HD1  LEU   9          1HD1      LEU   9  -2.277  10.809   5.016
   66   2HD1  LEU   9          2HD1      LEU   9  -0.619  10.585   4.456
   67   3HD1  LEU   9          3HD1      LEU   9  -1.033  10.256   6.139
   68   1HD2  LEU   9          1HD2      LEU   9  -2.359   7.167   6.038
   69   2HD2  LEU   9          2HD2      LEU   9  -1.581   8.503   6.884
   70   3HD2  LEU   9          3HD2      LEU   9  -0.607   7.357   5.961
   71    H    TYR  10           H        TYR  10  -2.626   6.412   4.375
   72    HA   TYR  10           HA       TYR  10  -2.452   4.278   2.471
   73   1HB   TYR  10          2HB       TYR  10  -2.109   2.869   4.321
   74   2HB   TYR  10          1HB       TYR  10  -1.429   4.414   4.803
   75    HD1  TYR  10           1HD      TYR  10  -4.318   5.695   5.131
   76    HD2  TYR  10           2HD      TYR  10  -2.410   2.157   6.644
   77    HE1  TYR  10           1HE      TYR  10  -5.817   5.731   7.105
   78    HE2  TYR  10           2HE      TYR  10  -3.912   2.192   8.618
   79    HH   TYR  10           HH       TYR  10  -5.384   4.522   9.767
   80    H    GLN  11           H        GLN  11  -5.134   5.960   3.468
   81    HA   GLN  11           HA       GLN  11  -6.958   3.626   3.467
   82   1HB   GLN  11          2HB       GLN  11  -7.157   5.892   4.865
   83   2HB   GLN  11          1HB       GLN  11  -7.944   6.456   3.391
   84   1HG   GLN  11          2HG       GLN  11  -9.267   4.182   3.587
   85   2HG   GLN  11          1HG       GLN  11  -8.802   4.295   5.285
   86   1HE2  GLN  11          1HE2      GLN  11  -9.885   6.732   2.839
   87   2HE2  GLN  11          2HE2      GLN  11 -11.092   7.398   3.829
   88    H    VAL  12           H        VAL  12  -5.338   4.215   1.157
   89    HA   VAL  12           HA       VAL  12  -7.283   5.220  -0.827
   90    HB   VAL  12           HB       VAL  12  -5.140   6.317  -0.909
   91   1HG1  VAL  12          1HG1      VAL  12  -3.864   4.557   0.278
   92   2HG1  VAL  12          2HG1      VAL  12  -3.050   5.070  -1.200
   93   3HG1  VAL  12          3HG1      VAL  12  -3.936   3.547  -1.167
   94   1HG2  VAL  12          1HG2      VAL  12  -5.834   4.397  -3.092
   95   2HG2  VAL  12          2HG2      VAL  12  -4.290   5.239  -3.201
   96   3HG2  VAL  12          3HG2      VAL  12  -5.791   6.158  -3.119
   97    H    GLU  13           H        GLU  13  -8.486   3.122  -0.611
   98    HA   GLU  13           HA       GLU  13  -8.996   0.963  -1.385
   99   1HB   GLU  13          2HB       GLU  13  -7.897   2.378  -3.512
  100   2HB   GLU  13          1HB       GLU  13  -6.952   0.888  -3.481
  101   1HG   GLU  13          2HG       GLU  13  -9.947   0.765  -3.237
  102   2HG   GLU  13          1HG       GLU  13  -9.200   0.937  -4.826
  103    H    LEU  14           H        LEU  14  -7.679   0.550   0.753
  104    HA   LEU  14           HA       LEU  14  -5.039  -0.325   0.843
  105   1HB   LEU  14          2HB       LEU  14  -7.467  -0.796   2.401
  106   2HB   LEU  14          1HB       LEU  14  -6.374  -2.181   2.433
  107    HG   LEU  14           HG       LEU  14  -5.237   0.566   2.817
  108   1HD1  LEU  14          1HD1      LEU  14  -6.693  -1.067   4.917
  109   2HD1  LEU  14          2HD1      LEU  14  -7.101   0.561   4.374
  110   3HD1  LEU  14          3HD1      LEU  14  -5.616   0.280   5.285
  111   1HD2  LEU  14          1HD2      LEU  14  -4.555  -2.278   3.454
  112   2HD2  LEU  14          2HD2      LEU  14  -3.930  -1.016   4.519
  113   3HD2  LEU  14          3HD2      LEU  14  -3.530  -0.998   2.801
  114    H    GLY  15           H        GLY  15  -4.556  -2.852   1.256
  115   1HA   GLY  15          2HA       GLY  15  -5.936  -4.730  -0.455
  116   2HA   GLY  15          1HA       GLY  15  -4.455  -4.146  -1.216
  117    HA   PRO  16           HA       PRO  16  -3.350  -6.654   2.750
  118   1HB   PRO  16          2HB       PRO  16  -5.240  -8.531   3.417
  119   2HB   PRO  16          1HB       PRO  16  -5.200  -6.896   4.099
  120   1HG   PRO  16          2HG       PRO  16  -7.051  -8.030   2.057
  121   2HG   PRO  16          1HG       PRO  16  -7.313  -6.693   3.188
  122   1HD   PRO  16          2HD       PRO  16  -6.696  -6.450   0.430
  123   2HD   PRO  16          1HD       PRO  16  -6.664  -5.142   1.632
  124    H    GLY  17           H        GLY  17  -1.969  -7.480   0.973
  125   1HA   GLY  17          2HA       GLY  17  -0.962  -9.564   0.273
  126   2HA   GLY  17          1HA       GLY  17  -2.539 -10.341   0.416
  127    HA   PRO  18           HA       PRO  18  -2.552  -7.903  -3.717
  128   1HB   PRO  18          2HB       PRO  18  -0.129  -6.870  -4.510
  129   2HB   PRO  18          1HB       PRO  18  -1.313  -5.966  -3.548
  130   1HG   PRO  18          2HG       PRO  18   1.259  -7.203  -2.681
  131   2HG   PRO  18          1HG       PRO  18   0.386  -5.827  -1.987
  132   1HD   PRO  18          2HD       PRO  18   0.408  -8.469  -0.963
  133   2HD   PRO  18          1HD       PRO  18  -0.698  -7.167  -0.477
  134    H    SER  19           H        SER  19   0.866  -8.981  -3.525
  135    HA   SER  19           HA       SER  19   0.653 -10.511  -5.975
  136   1HB   SER  19          2HB       SER  19   2.856  -9.974  -5.700
  137   2HB   SER  19          1HB       SER  19   2.734  -9.944  -3.943
  138    HG   SER  19           HG       SER  19   2.716 -12.287  -5.551
  139    H    GLY  20           H        GLY  20  -0.424 -12.412  -6.098
  140   1HA   GLY  20          2HA       GLY  20  -1.206 -14.548  -5.534
  141   2HA   GLY  20          1HA       GLY  20   0.185 -14.662  -4.458
  142    H    ASP  21           H        ASP  21  -1.874 -15.863  -3.396
  143    HA   ASP  21           HA       ASP  21  -2.988 -13.901  -1.435
  144   1HB   ASP  21          2HB       ASP  21  -4.535 -15.123  -3.303
  145   2HB   ASP  21          1HB       ASP  21  -4.593 -16.328  -2.016
  146    H    MET  22           H        MET  22  -0.690 -15.076  -0.741
  147    HA   MET  22           HA       MET  22  -1.534 -17.289   1.087
  148   1HB   MET  22          2HB       MET  22   0.048 -17.876  -0.900
  149   2HB   MET  22          1HB       MET  22   1.278 -17.027   0.036
  150   1HG   MET  22          2HG       MET  22  -0.283 -18.887   1.667
  151   2HG   MET  22          1HG       MET  22   0.565 -19.693   0.348
  152   1HE   MET  22          1HE       MET  22   1.970 -19.136   4.231
  153   2HE   MET  22          2HE       MET  22   0.368 -18.940   3.525
  154   3HE   MET  22          3HE       MET  22   1.358 -17.520   3.853
  155    H    ALA  23           H        ALA  23  -1.845 -14.904   2.160
  156    HA   ALA  23           HA       ALA  23  -0.160 -14.792   4.402
  157   1HB   ALA  23          1HB       ALA  23   1.032 -12.550   3.676
  158   2HB   ALA  23          2HB       ALA  23   0.813 -13.201   2.051
  159   3HB   ALA  23          3HB       ALA  23   1.742 -14.107   3.244
  160    H    ALA  24           H        ALA  24  -2.351 -14.394   5.165
  161    HA   ALA  24           HA       ALA  24  -4.066 -12.319   4.409
  162   1HB   ALA  24          1HB       ALA  24  -3.729 -14.018   6.722
  163   2HB   ALA  24          2HB       ALA  24  -5.199 -13.253   6.119
  164   3HB   ALA  24          3HB       ALA  24  -4.149 -12.383   7.236
  165    H    LYS  25           H        LYS  25  -1.654 -12.115   7.057
  166    HA   LYS  25           HA       LYS  25  -0.608 -10.226   7.987
  167   1HB   LYS  25          2HB       LYS  25   0.107 -10.398   5.387
  168   2HB   LYS  25          1HB       LYS  25  -0.670  -8.814   5.371
  169   1HG   LYS  25          2HG       LYS  25   0.746  -8.185   7.358
  170   2HG   LYS  25          1HG       LYS  25   1.615  -9.705   7.148
  171   1HD   LYS  25          2HD       LYS  25   1.295  -7.845   4.811
  172   2HD   LYS  25          1HD       LYS  25   2.544  -7.526   6.014
  173   1HE   LYS  25          2HE       LYS  25   3.803  -8.942   4.756
  174   2HE   LYS  25          1HE       LYS  25   2.895 -10.204   5.586
  175   1HZ   LYS  25          1HZ       LYS  25   1.368  -9.228   3.438
  176   2HZ   LYS  25          2HZ       LYS  25   1.987 -10.793   3.674
  177   3HZ   LYS  25          3HZ       LYS  25   2.915  -9.622   2.864
  178    H    MET  26           H        MET  26  -2.668  -9.697   9.111
  179    HA   MET  26           HA       MET  26  -3.746  -7.099   8.112
  180   1HB   MET  26          2HB       MET  26  -5.318  -9.461   9.174
  181   2HB   MET  26          1HB       MET  26  -5.989  -7.834   9.050
  182   1HG   MET  26          2HG       MET  26  -4.933  -8.111   6.563
  183   2HG   MET  26          1HG       MET  26  -5.364  -9.785   6.910
  184   1HE   MET  26          1HE       MET  26  -7.642  -8.435   4.454
  185   2HE   MET  26          2HE       MET  26  -8.148  -9.939   5.219
  186   3HE   MET  26          3HE       MET  26  -6.434  -9.620   4.969
  187    H    SER  27           H        SER  27  -4.905  -5.923   9.975
  188    HA   SER  27           HA       SER  27  -4.871  -5.080  12.171
  189   1HB   SER  27          2HB       SER  27  -5.016  -7.742  12.556
  190   2HB   SER  27          1HB       SER  27  -3.417  -7.451  13.235
  191    HG   SER  27           HG       SER  27  -4.888  -7.135  14.861
  192    H    LYS  28           H        LYS  28  -3.072  -4.838  14.063
  193    HA   LYS  28           HA       LYS  28  -0.923  -4.066  14.622
  194   1HB   LYS  28          2HB       LYS  28  -0.001  -5.307  12.016
  195   2HB   LYS  28          1HB       LYS  28   0.976  -4.941  13.438
  196   1HG   LYS  28          2HG       LYS  28  -1.198  -6.589  14.276
  197   2HG   LYS  28          1HG       LYS  28  -0.463  -7.341  12.862
  198   1HD   LYS  28          2HD       LYS  28   1.056  -6.393  15.308
  199   2HD   LYS  28          1HD       LYS  28   0.632  -8.070  14.969
  200   1HE   LYS  28          2HE       LYS  28   2.263  -8.296  13.400
  201   2HE   LYS  28          1HE       LYS  28   1.987  -6.682  12.746
  202   1HZ   LYS  28          1HZ       LYS  28   3.374  -7.239  15.311
  203   2HZ   LYS  28          2HZ       LYS  28   3.207  -5.728  14.553
  204   3HZ   LYS  28          3HZ       LYS  28   4.165  -6.937  13.840
  205    H    LYS  29           H        LYS  29   0.687  -2.417  13.843
  206    HA   LYS  29           HA       LYS  29  -0.333  -0.864  11.504
  207   1HB   LYS  29          2HB       LYS  29  -0.058   1.216  12.763
  208   2HB   LYS  29          1HB       LYS  29  -1.159   0.144  13.630
  209   1HG   LYS  29          2HG       LYS  29   0.184   0.255  15.429
  210   2HG   LYS  29          1HG       LYS  29   1.472  -0.500  14.489
  211   1HD   LYS  29          2HD       LYS  29   2.070   1.764  13.594
  212   2HD   LYS  29          1HD       LYS  29   0.878   2.466  14.689
  213   1HE   LYS  29          2HE       LYS  29   2.747   0.603  15.995
  214   2HE   LYS  29          1HE       LYS  29   3.518   2.040  15.325
  215   1HZ   LYS  29          1HZ       LYS  29   2.159   1.876  17.696
  216   2HZ   LYS  29          2HZ       LYS  29   1.080   2.672  16.655
  217   3HZ   LYS  29          3HZ       LYS  29   2.638   3.299  16.908
  218    H    LYS  30           H        LYS  30   1.347   0.771  10.766
  219    HA   LYS  30           HA       LYS  30   4.089   0.518  11.608
  220   1HB   LYS  30          2HB       LYS  30   3.084  -1.420   9.663
  221   2HB   LYS  30          1HB       LYS  30   4.440  -0.485   9.033
  222   1HG   LYS  30          2HG       LYS  30   5.916  -1.497  10.418
  223   2HG   LYS  30          1HG       LYS  30   4.843  -1.328  11.809
  224   1HD   LYS  30          2HD       LYS  30   4.198  -3.479  11.638
  225   2HD   LYS  30          1HD       LYS  30   3.749  -3.249   9.949
  226   1HE   LYS  30          2HE       LYS  30   5.441  -4.840   9.756
  227   2HE   LYS  30          1HE       LYS  30   6.349  -3.344   9.545
  228   1HZ   LYS  30          1HZ       LYS  30   5.975  -4.616  12.191
  229   2HZ   LYS  30          2HZ       LYS  30   7.090  -3.409  11.754
  230   3HZ   LYS  30          3HZ       LYS  30   7.282  -4.996  11.179
  231    H    ALA  31           H        ALA  31   3.148   2.850  11.388
  232    HA   ALA  31           HA       ALA  31   2.678   4.080   8.893
  233   1HB   ALA  31          1HB       ALA  31   2.296   5.288  10.966
  234   2HB   ALA  31          2HB       ALA  31   3.481   6.181  10.013
  235   3HB   ALA  31          3HB       ALA  31   4.009   5.199  11.379
  236    H    GLY  32           H        GLY  32   3.988   4.339   7.155
  237   1HA   GLY  32          2HA       GLY  32   6.891   4.748   7.569
  238   2HA   GLY  32          1HA       GLY  32   6.413   3.360   6.588
  239    H    ARG  33           H        ARG  33   6.002   6.897   6.816
  240    HA   ARG  33           HA       ARG  33   4.884   7.243   4.208
  241   1HB   ARG  33          2HB       ARG  33   6.534   9.119   5.925
  242   2HB   ARG  33          1HB       ARG  33   5.707   9.606   4.445
  243   1HG   ARG  33          2HG       ARG  33   3.583   8.610   5.527
  244   2HG   ARG  33          1HG       ARG  33   4.494   8.649   7.037
  245   1HD   ARG  33          2HD       ARG  33   5.001  11.130   6.361
  246   2HD   ARG  33          1HD       ARG  33   3.589  10.943   5.318
  247    HE   ARG  33           HE       ARG  33   2.406  10.208   7.514
  248   1HH1  ARG  33          1HH1      ARG  33   5.098  10.873   8.946
  249   2HH1  ARG  33          2HH1      ARG  33   4.682  12.392   9.668
  250   1HH2  ARG  33          1HH2      ARG  33   1.836  12.831   7.734
  251   2HH2  ARG  33          2HH2      ARG  33   2.836  13.500   8.980
  252    H    GLY  34           H        GLY  34   8.259   7.840   5.276
  253   1HA   GLY  34          2HA       GLY  34   9.129   6.993   2.548
  254   2HA   GLY  34          1HA       GLY  34   9.776   8.465   3.273
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1   0.710  18.696   4.143
    2   2H    MET   1          2HT       MET   1   0.008  19.249   2.700
    3   3H    MET   1          3HT       MET   1  -0.875  19.299   4.150
    4    HA   MET   1           HA       MET   1   0.616  20.943   5.062
    5   1HB   MET   1          2HB       MET   1   2.172  20.114   2.701
    6   2HB   MET   1          1HB       MET   1   2.113  21.860   2.945
    7   1HG   MET   1          2HG       MET   1   2.824  21.528   5.307
    8   2HG   MET   1          1HG       MET   1   2.955  19.796   5.001
    9   1HE   MET   1          1HE       MET   1   6.375  19.318   4.001
   10   2HE   MET   1          2HE       MET   1   4.784  18.636   3.673
   11   3HE   MET   1          3HE       MET   1   5.191  19.152   5.307
   12    H    GLY   2           H        GLY   2  -0.348  22.938   4.962
   13   1HA   GLY   2          2HA       GLY   2  -1.584  24.746   4.100
   14   2HA   GLY   2          1HA       GLY   2  -1.180  24.172   2.481
   15    H    LYS   3           H        LYS   3  -3.643  25.017   2.513
   16    HA   LYS   3           HA       LYS   3  -5.430  22.734   3.210
   17   1HB   LYS   3          2HB       LYS   3  -5.810  25.310   3.806
   18   2HB   LYS   3          1HB       LYS   3  -6.492  25.332   2.180
   19   1HG   LYS   3          2HG       LYS   3  -7.617  23.054   3.182
   20   2HG   LYS   3          1HG       LYS   3  -7.519  24.049   4.636
   21   1HD   LYS   3          2HD       LYS   3  -9.511  24.865   3.852
   22   2HD   LYS   3          1HD       LYS   3  -8.447  25.894   2.894
   23   1HE   LYS   3          2HE       LYS   3  -8.604  24.411   0.995
   24   2HE   LYS   3          1HE       LYS   3  -9.469  23.205   1.949
   25   1HZ   LYS   3          1HZ       LYS   3 -11.346  24.571   2.093
   26   2HZ   LYS   3          2HZ       LYS   3 -10.851  24.698   0.473
   27   3HZ   LYS   3          3HZ       LYS   3 -10.507  25.949   1.569
   28    H    ALA   4           H        ALA   4  -4.329  21.671   1.244
   29    HA   ALA   4           HA       ALA   4  -5.709  22.548  -1.262
   30   1HB   ALA   4          1HB       ALA   4  -3.825  21.186  -2.379
   31   2HB   ALA   4          2HB       ALA   4  -3.025  21.239  -0.808
   32   3HB   ALA   4          3HB       ALA   4  -3.378  22.737  -1.668
   33    H    GLU   5           H        GLU   5  -7.036  20.921   0.628
   34    HA   GLU   5           HA       GLU   5  -8.299  18.944   0.668
   35   1HB   GLU   5          2HB       GLU   5  -7.412  19.207  -2.142
   36   2HB   GLU   5          1HB       GLU   5  -7.851  17.571  -1.649
   37   1HG   GLU   5          2HG       GLU   5  -9.870  19.065  -0.527
   38   2HG   GLU   5          1HG       GLU   5  -9.562  19.935  -2.030
   39    H    ASN   6           H        ASN   6  -7.933  16.809   1.352
   40    HA   ASN   6           HA       ASN   6  -5.080  16.085   1.669
   41   1HB   ASN   6          2HB       ASN   6  -7.043  15.988   3.472
   42   2HB   ASN   6          1HB       ASN   6  -7.293  14.395   2.759
   43   1HD2  ASN   6          1HD2      ASN   6  -5.689  15.846   5.262
   44   2HD2  ASN   6          2HD2      ASN   6  -4.367  14.791   5.408
   45    H    TYR   7           H        TYR   7  -4.273  14.016   0.989
   46    HA   TYR   7           HA       TYR   7  -5.697  12.947  -1.373
   47   1HB   TYR   7          2HB       TYR   7  -3.188  11.615  -0.748
   48   2HB   TYR   7          1HB       TYR   7  -3.645  12.507  -2.193
   49    HD1  TYR   7           1HD      TYR   7  -1.224  12.415   0.206
   50    HD2  TYR   7           2HD      TYR   7  -4.005  15.205  -1.506
   51    HE1  TYR   7           1HE      TYR   7   0.237  14.295   0.898
   52    HE2  TYR   7           2HE      TYR   7  -2.544  17.086  -0.813
   53    HH   TYR   7           HH       TYR   7  -0.399  17.024   1.406
   54    H    GLU   8           H        GLU   8  -4.731  12.020   1.872
   55    HA   GLU   8           HA       GLU   8  -5.409  10.189   3.176
   56   1HB   GLU   8          2HB       GLU   8  -7.472  10.508   1.175
   57   2HB   GLU   8          1HB       GLU   8  -7.222   8.798   1.522
   58   1HG   GLU   8          2HG       GLU   8  -7.680   9.076   3.825
   59   2HG   GLU   8          1HG       GLU   8  -7.468  10.825   3.742
   60    H    LEU   9           H        LEU   9  -3.068   9.734   2.105
   61    HA   LEU   9           HA       LEU   9  -2.951   7.551   0.208
   62   1HB   LEU   9          2HB       LEU   9  -1.067   9.124   0.546
   63   2HB   LEU   9          1HB       LEU   9  -0.859   8.509   2.186
   64    HG   LEU   9           HG       LEU   9  -0.944   6.341   0.248
   65   1HD1  LEU   9          1HD1      LEU   9   1.000   8.612  -0.167
   66   2HD1  LEU   9          2HD1      LEU   9   0.046   7.747  -1.373
   67   3HD1  LEU   9          3HD1      LEU   9   1.425   6.957  -0.607
   68   1HD2  LEU   9          1HD2      LEU   9  -0.025   6.566   2.705
   69   2HD2  LEU   9          2HD2      LEU   9   1.435   7.145   1.901
   70   3HD2  LEU   9          3HD2      LEU   9   0.819   5.531   1.553
   71    H    TYR  10           H        TYR  10  -3.879   7.664   3.437
   72    HA   TYR  10           HA       TYR  10  -2.821   5.005   4.135
   73   1HB   TYR  10          2HB       TYR  10  -4.896   6.116   5.879
   74   2HB   TYR  10          1HB       TYR  10  -3.278   5.563   6.279
   75    HD1  TYR  10           1HD      TYR  10  -1.509   7.233   4.728
   76    HD2  TYR  10           2HD      TYR  10  -5.168   8.288   6.715
   77    HE1  TYR  10           1HE      TYR  10  -0.739   9.586   4.898
   78    HE2  TYR  10           2HE      TYR  10  -4.400  10.639   6.885
   79    HH   TYR  10           HH       TYR  10  -2.849  12.115   6.235
   80    H    GLN  11           H        GLN  11  -5.393   6.162   2.347
   81    HA   GLN  11           HA       GLN  11  -7.305   4.069   3.191
   82   1HB   GLN  11          2HB       GLN  11  -7.372   6.443   1.369
   83   2HB   GLN  11          1HB       GLN  11  -8.480   5.114   1.026
   84   1HG   GLN  11          2HG       GLN  11  -8.429   5.739   3.867
   85   2HG   GLN  11          1HG       GLN  11  -8.868   7.151   2.904
   86   1HE2  GLN  11          1HE2      GLN  11 -10.410   6.255   0.879
   87   2HE2  GLN  11          2HE2      GLN  11 -11.740   5.359   1.436
   88    H    VAL  12           H        VAL  12  -4.828   3.140   2.266
   89    HA   VAL  12           HA       VAL  12  -5.444   2.063  -0.427
   90    HB   VAL  12           HB       VAL  12  -3.416   3.330  -0.427
   91   1HG1  VAL  12          1HG1      VAL  12  -3.091   3.315   2.031
   92   2HG1  VAL  12          2HG1      VAL  12  -1.606   2.935   1.159
   93   3HG1  VAL  12          3HG1      VAL  12  -2.530   1.646   1.928
   94   1HG2  VAL  12          1HG2      VAL  12  -2.857   0.355  -0.243
   95   2HG2  VAL  12          2HG2      VAL  12  -1.718   1.535  -0.893
   96   3HG2  VAL  12          3HG2      VAL  12  -3.263   1.264  -1.701
   97    H    GLU  13           H        GLU  13  -6.666   0.236   0.242
   98    HA   GLU  13           HA       GLU  13  -7.048  -1.866   1.251
   99   1HB   GLU  13          2HB       GLU  13  -5.249  -2.233  -0.558
  100   2HB   GLU  13          1HB       GLU  13  -4.093  -2.284   0.774
  101   1HG   GLU  13          2HG       GLU  13  -4.638  -4.534   0.608
  102   2HG   GLU  13          1HG       GLU  13  -5.835  -4.004   1.790
  103    H    LEU  14           H        LEU  14  -6.802  -0.042   3.239
  104    HA   LEU  14           HA       LEU  14  -4.687  -0.333   5.088
  105   1HB   LEU  14          2HB       LEU  14  -7.434   0.675   5.133
  106   2HB   LEU  14          1HB       LEU  14  -6.945  -0.026   6.676
  107    HG   LEU  14           HG       LEU  14  -5.140   1.886   5.201
  108   1HD1  LEU  14          1HD1      LEU  14  -7.537   2.479   6.924
  109   2HD1  LEU  14          2HD1      LEU  14  -7.034   3.254   5.420
  110   3HD1  LEU  14          3HD1      LEU  14  -6.155   3.575   6.915
  111   1HD2  LEU  14          1HD2      LEU  14  -4.193   0.570   7.056
  112   2HD2  LEU  14          2HD2      LEU  14  -5.489   1.119   8.120
  113   3HD2  LEU  14          3HD2      LEU  14  -4.303   2.272   7.507
  114    H    GLY  15           H        GLY  15  -5.297  -1.357   7.413
  115   1HA   GLY  15          2HA       GLY  15  -6.848  -3.669   7.683
  116   2HA   GLY  15          1HA       GLY  15  -5.317  -4.216   6.998
  117    HA   PRO  16           HA       PRO  16  -3.365  -3.914  10.914
  118   1HB   PRO  16          2HB       PRO  16  -0.963  -2.709  10.328
  119   2HB   PRO  16          1HB       PRO  16  -1.349  -4.385   9.897
  120   1HG   PRO  16          2HG       PRO  16  -1.222  -1.975   8.142
  121   2HG   PRO  16          1HG       PRO  16  -0.968  -3.680   7.728
  122   1HD   PRO  16          2HD       PRO  16  -3.314  -2.186   7.213
  123   2HD   PRO  16          1HD       PRO  16  -3.165  -3.956   7.131
  124    H    GLY  17           H        GLY  17  -4.979  -2.271  11.692
  125   1HA   GLY  17          2HA       GLY  17  -4.455   0.553  11.495
  126   2HA   GLY  17          1HA       GLY  17  -5.537  -0.206  12.663
  127    HA   PRO  18           HA       PRO  18  -1.755   1.305  14.889
  128   1HB   PRO  18          2HB       PRO  18  -3.079   3.096  16.500
  129   2HB   PRO  18          1HB       PRO  18  -2.397   3.520  14.921
  130   1HG   PRO  18          2HG       PRO  18  -5.250   3.103  15.681
  131   2HG   PRO  18          1HG       PRO  18  -4.568   4.088  14.376
  132   1HD   PRO  18          2HD       PRO  18  -5.749   1.531  14.082
  133   2HD   PRO  18          1HD       PRO  18  -4.783   2.383  12.860
  134    H    SER  19           H        SER  19  -4.918   1.335  16.587
  135    HA   SER  19           HA       SER  19  -3.830  -0.783  18.399
  136   1HB   SER  19          2HB       SER  19  -4.895   0.282  20.276
  137   2HB   SER  19          1HB       SER  19  -3.975   1.526  19.435
  138    HG   SER  19           HG       SER  19  -6.107   2.206  19.924
  139    H    GLY  20           H        GLY  20  -5.642  -0.831  15.956
  140   1HA   GLY  20          2HA       GLY  20  -7.347  -2.916  16.624
  141   2HA   GLY  20          1HA       GLY  20  -8.298  -1.465  16.949
  142    H    ASP  21           H        ASP  21  -9.757  -1.852  15.220
  143    HA   ASP  21           HA       ASP  21  -8.590  -1.300  12.528
  144   1HB   ASP  21          2HB       ASP  21 -10.569  -2.870  11.748
  145   2HB   ASP  21          1HB       ASP  21  -9.029  -3.570  12.249
  146    H    MET  22           H        MET  22 -11.829  -1.797  13.987
  147    HA   MET  22           HA       MET  22 -12.896   0.434  12.416
  148   1HB   MET  22          2HB       MET  22 -14.077  -1.449  14.465
  149   2HB   MET  22          1HB       MET  22 -14.994  -0.095  13.802
  150   1HG   MET  22          2HG       MET  22 -14.588  -0.956  11.514
  151   2HG   MET  22          1HG       MET  22 -13.719  -2.330  12.198
  152   1HE   MET  22          1HE       MET  22 -15.867  -2.111  10.247
  153   2HE   MET  22          2HE       MET  22 -17.386  -1.475  10.872
  154   3HE   MET  22          3HE       MET  22 -17.204  -3.208  10.618
  155    H    ALA  23           H        ALA  23 -13.722   2.395  13.322
  156    HA   ALA  23           HA       ALA  23 -13.777   3.112  16.044
  157   1HB   ALA  23          1HB       ALA  23 -11.123   2.763  15.170
  158   2HB   ALA  23          2HB       ALA  23 -11.651   3.535  16.664
  159   3HB   ALA  23          3HB       ALA  23 -11.374   4.507  15.219
  160    H    ALA  24           H        ALA  24 -15.580   3.962  14.524
  161    HA   ALA  24           HA       ALA  24 -16.647   5.857  13.643
  162   1HB   ALA  24          1HB       ALA  24 -15.183   6.883  15.580
  163   2HB   ALA  24          2HB       ALA  24 -15.928   7.946  14.387
  164   3HB   ALA  24          3HB       ALA  24 -14.222   7.520  14.245
  165    H    LYS  25           H        LYS  25 -16.763   5.686  11.446
  166    HA   LYS  25           HA       LYS  25 -14.825   7.026   9.777
  167   1HB   LYS  25          2HB       LYS  25 -13.587   4.911  10.267
  168   2HB   LYS  25          1HB       LYS  25 -14.926   4.000   9.566
  169   1HG   LYS  25          2HG       LYS  25 -12.987   4.456   7.986
  170   2HG   LYS  25          1HG       LYS  25 -14.568   4.976   7.402
  171   1HD   LYS  25          2HD       LYS  25 -14.124   7.257   7.911
  172   2HD   LYS  25          1HD       LYS  25 -12.724   6.842   8.900
  173   1HE   LYS  25          2HE       LYS  25 -11.548   6.017   6.893
  174   2HE   LYS  25          1HE       LYS  25 -12.946   6.435   5.903
  175   1HZ   LYS  25          1HZ       LYS  25 -11.998   8.419   5.686
  176   2HZ   LYS  25          2HZ       LYS  25 -10.870   8.118   6.921
  177   3HZ   LYS  25          3HZ       LYS  25 -12.415   8.711   7.304
  178    H    MET  26           H        MET  26 -17.346   7.656   9.761
  179    HA   MET  26           HA       MET  26 -18.348   6.644   7.180
  180   1HB   MET  26          2HB       MET  26 -19.324   5.151   8.982
  181   2HB   MET  26          1HB       MET  26 -20.137   6.579   9.625
  182   1HG   MET  26          2HG       MET  26 -21.786   6.283   8.126
  183   2HG   MET  26          1HG       MET  26 -20.621   6.552   6.830
  184   1HE   MET  26          1HE       MET  26 -20.405   3.576   9.461
  185   2HE   MET  26          2HE       MET  26 -21.656   2.531   8.790
  186   3HE   MET  26          3HE       MET  26 -22.077   4.146   9.353
  187    H    SER  27           H        SER  27 -18.950   8.438   6.063
  188    HA   SER  27           HA       SER  27 -20.324  10.631   7.515
  189   1HB   SER  27          2HB       SER  27 -17.727  10.962   7.259
  190   2HB   SER  27          1HB       SER  27 -18.131  11.343   5.589
  191    HG   SER  27           HG       SER  27 -18.483  12.807   7.848
  192    H    LYS  28           H        LYS  28 -21.781  11.758   6.208
  193    HA   LYS  28           HA       LYS  28 -21.839  11.064   3.310
  194   1HB   LYS  28          2HB       LYS  28 -24.096  10.786   5.306
  195   2HB   LYS  28          1HB       LYS  28 -24.389  10.920   3.571
  196   1HG   LYS  28          2HG       LYS  28 -22.896   8.959   3.199
  197   2HG   LYS  28          1HG       LYS  28 -22.720   8.795   4.947
  198   1HD   LYS  28          2HD       LYS  28 -25.211   8.575   5.123
  199   2HD   LYS  28          1HD       LYS  28 -25.292   8.574   3.361
  200   1HE   LYS  28          2HE       LYS  28 -23.323   6.681   3.977
  201   2HE   LYS  28          1HE       LYS  28 -24.595   6.404   5.167
  202   1HZ   LYS  28          1HZ       LYS  28 -25.133   6.692   2.267
  203   2HZ   LYS  28          2HZ       LYS  28 -26.189   6.128   3.471
  204   3HZ   LYS  28          3HZ       LYS  28 -24.851   5.193   3.005
  205    H    LYS  29           H        LYS  29 -21.815  12.970   2.221
  206    HA   LYS  29           HA       LYS  29 -22.223  15.510   3.459
  207   1HB   LYS  29          2HB       LYS  29 -21.241  14.655   1.032
  208   2HB   LYS  29          1HB       LYS  29 -22.762  15.418   0.566
  209   1HG   LYS  29          2HG       LYS  29 -21.920  17.305   2.248
  210   2HG   LYS  29          1HG       LYS  29 -20.342  16.634   1.835
  211   1HD   LYS  29          2HD       LYS  29 -20.846  16.935  -0.568
  212   2HD   LYS  29          1HD       LYS  29 -22.414  17.626  -0.146
  213   1HE   LYS  29          2HE       LYS  29 -21.330  19.618  -0.162
  214   2HE   LYS  29          1HE       LYS  29 -20.693  19.116   1.404
  215   1HZ   LYS  29          1HZ       LYS  29 -19.383  19.225  -1.184
  216   2HZ   LYS  29          2HZ       LYS  29 -19.012  17.871  -0.228
  217   3HZ   LYS  29          3HZ       LYS  29 -18.738  19.437   0.369
  218    H    LYS  30           H        LYS  30 -23.948  17.041   2.135
  219    HA   LYS  30           HA       LYS  30 -26.455  16.623   3.228
  220   1HB   LYS  30          2HB       LYS  30 -25.355  18.298   1.154
  221   2HB   LYS  30          1HB       LYS  30 -26.961  17.745   0.678
  222   1HG   LYS  30          2HG       LYS  30 -26.694  18.608   3.501
  223   2HG   LYS  30          1HG       LYS  30 -26.542  19.887   2.296
  224   1HD   LYS  30          2HD       LYS  30 -28.827  19.902   2.458
  225   2HD   LYS  30          1HD       LYS  30 -28.685  18.586   1.291
  226   1HE   LYS  30          2HE       LYS  30 -28.730  16.941   3.120
  227   2HE   LYS  30          1HE       LYS  30 -28.834  18.245   4.303
  228   1HZ   LYS  30          1HZ       LYS  30 -30.999  17.210   3.694
  229   2HZ   LYS  30          2HZ       LYS  30 -30.812  17.844   2.129
  230   3HZ   LYS  30          3HZ       LYS  30 -30.939  18.890   3.463
  231    H    ALA  31           H        ALA  31 -27.892  14.991   3.002
  232    HA   ALA  31           HA       ALA  31 -28.072  13.637   0.340
  233   1HB   ALA  31          1HB       ALA  31 -27.925  11.560   1.282
  234   2HB   ALA  31          2HB       ALA  31 -28.775  12.053   2.745
  235   3HB   ALA  31          3HB       ALA  31 -27.062  12.425   2.553
  236    H    GLY  32           H        GLY  32 -30.062  14.005  -0.499
  237   1HA   GLY  32          2HA       GLY  32 -32.239  15.075   1.050
  238   2HA   GLY  32          1HA       GLY  32 -32.360  14.490  -0.609
  239    H    ARG  33           H        ARG  33 -33.708  12.783  -0.828
  240    HA   ARG  33           HA       ARG  33 -34.900  11.387   1.326
  241   1HB   ARG  33          2HB       ARG  33 -35.355  11.462  -1.339
  242   2HB   ARG  33          1HB       ARG  33 -34.552   9.896  -1.222
  243   1HG   ARG  33          2HG       ARG  33 -36.893  10.732   0.511
  244   2HG   ARG  33          1HG       ARG  33 -37.046   9.762  -0.955
  245   1HD   ARG  33          2HD       ARG  33 -35.004   8.540   0.559
  246   2HD   ARG  33          1HD       ARG  33 -36.289   8.919   1.707
  247    HE   ARG  33           HE       ARG  33 -37.282   7.674  -0.736
  248   1HH1  ARG  33          1HH2      ARG  33 -38.167   7.403   2.229
  249   2HH1  ARG  33          2HH2      ARG  33 -37.818   5.727   2.498
  250   1HH2  ARG  33          1HH1      ARG  33 -35.843   5.412  -0.335
  251   2HH2  ARG  33          2HH1      ARG  33 -36.504   4.600   1.045
  252    H    GLY  34           H        GLY  34 -32.069  10.534  -0.660
  253   1HA   GLY  34          2HA       GLY  34 -30.739   9.163   1.448
  254   2HA   GLY  34          1HA       GLY  34 -31.596   7.966   0.475
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1   2.633  26.540  -6.820
    2   2H    MET   1          2HT       MET   1   1.531  25.479  -6.081
    3   3H    MET   1          3HT       MET   1   1.079  26.346  -7.471
    4    HA   MET   1           HA       MET   1   2.622  25.131  -8.820
    5   1HB   MET   1          2HB       MET   1   3.799  23.164  -7.655
    6   2HB   MET   1          1HB       MET   1   4.446  24.772  -7.334
    7   1HG   MET   1          2HG       MET   1   3.137  24.883  -5.244
    8   2HG   MET   1          1HG       MET   1   2.499  23.269  -5.560
    9   1HE   MET   1          1HE       MET   1   5.569  20.998  -5.509
   10   2HE   MET   1          2HE       MET   1   5.267  21.976  -6.943
   11   3HE   MET   1          3HE       MET   1   3.911  21.282  -6.055
   12    H    GLY   2           H        GLY   2   1.423  23.690  -9.970
   13   1HA   GLY   2          2HA       GLY   2   0.043  21.801 -10.369
   14   2HA   GLY   2          1HA       GLY   2  -0.032  21.526  -8.628
   15    H    LYS   3           H        LYS   3  -2.262  21.403  -8.364
   16    HA   LYS   3           HA       LYS   3  -3.720  23.941  -8.504
   17   1HB   LYS   3          2HB       LYS   3  -5.589  22.845  -9.866
   18   2HB   LYS   3          1HB       LYS   3  -4.135  23.285 -10.761
   19   1HG   LYS   3          2HG       LYS   3  -3.474  21.093 -11.045
   20   2HG   LYS   3          1HG       LYS   3  -4.241  20.558  -9.549
   21   1HD   LYS   3          2HD       LYS   3  -6.470  21.165 -10.793
   22   2HD   LYS   3          1HD       LYS   3  -5.482  21.023 -12.247
   23   1HE   LYS   3          2HE       LYS   3  -4.756  18.781 -10.802
   24   2HE   LYS   3          1HE       LYS   3  -6.481  18.922 -10.460
   25   1HZ   LYS   3          1HZ       LYS   3  -6.827  18.023 -12.441
   26   2HZ   LYS   3          2HZ       LYS   3  -5.185  18.128 -12.860
   27   3HZ   LYS   3          3HZ       LYS   3  -6.223  19.442 -13.144
   28    H    ALA   4           H        ALA   4  -3.422  23.079  -6.165
   29    HA   ALA   4           HA       ALA   4  -4.553  22.339  -4.243
   30   1HB   ALA   4          1HB       ALA   4  -6.845  22.306  -4.324
   31   2HB   ALA   4          2HB       ALA   4  -6.881  21.304  -5.776
   32   3HB   ALA   4          3HB       ALA   4  -6.566  23.035  -5.906
   33    H    GLU   5           H        GLU   5  -5.854  20.158  -3.546
   34    HA   GLU   5           HA       GLU   5  -5.414  17.753  -4.988
   35   1HB   GLU   5          2HB       GLU   5  -2.994  18.778  -4.198
   36   2HB   GLU   5          1HB       GLU   5  -3.388  17.719  -2.842
   37   1HG   GLU   5          2HG       GLU   5  -4.034  16.034  -4.793
   38   2HG   GLU   5          1HG       GLU   5  -2.897  17.023  -5.711
   39    H    ASN   6           H        ASN   6  -4.683  16.096  -2.723
   40    HA   ASN   6           HA       ASN   6  -6.630  16.794  -0.612
   41   1HB   ASN   6          2HB       ASN   6  -7.320  15.067  -2.770
   42   2HB   ASN   6          1HB       ASN   6  -7.125  14.062  -1.333
   43   1HD2  ASN   6          1HD2      ASN   6  -9.451  13.736  -1.096
   44   2HD2  ASN   6          2HD2      ASN   6 -10.473  14.993  -0.590
   45    H    TYR   7           H        TYR   7  -6.681  14.564   0.869
   46    HA   TYR   7           HA       TYR   7  -3.893  14.284   1.718
   47   1HB   TYR   7          2HB       TYR   7  -5.921  12.551   2.987
   48   2HB   TYR   7          1HB       TYR   7  -4.741  13.627   3.725
   49    HD1  TYR   7           1HD      TYR   7  -8.168  13.248   2.615
   50    HD2  TYR   7           2HD      TYR   7  -5.190  16.110   3.795
   51    HE1  TYR   7           1HE      TYR   7  -9.942  14.939   2.988
   52    HE2  TYR   7           2HE      TYR   7  -6.964  17.802   4.168
   53    HH   TYR   7           HH       TYR   7  -9.220  18.068   4.436
   54    H    GLU   8           H        GLU   8  -6.421  11.828   1.186
   55    HA   GLU   8           HA       GLU   8  -6.227   9.628   0.371
   56   1HB   GLU   8          2HB       GLU   8  -5.021  11.428  -1.503
   57   2HB   GLU   8          1HB       GLU   8  -4.065   9.947  -1.464
   58   1HG   GLU   8          2HG       GLU   8  -6.232   8.657  -1.688
   59   2HG   GLU   8          1HG       GLU   8  -7.036  10.199  -1.988
   60    H    LEU   9           H        LEU   9  -5.232   9.142   2.561
   61    HA   LEU   9           HA       LEU   9  -2.307   8.782   2.534
   62   1HB   LEU   9          2HB       LEU   9  -4.114   9.436   4.504
   63   2HB   LEU   9          1HB       LEU   9  -3.847   7.728   4.811
   64    HG   LEU   9           HG       LEU   9  -2.121   8.634   6.066
   65   1HD1  LEU   9          1HD1      LEU   9  -0.389   8.964   3.717
   66   2HD1  LEU   9          2HD1      LEU   9  -1.294   7.454   3.708
   67   3HD1  LEU   9          3HD1      LEU   9  -0.247   7.843   5.070
   68   1HD2  LEU   9          1HD2      LEU   9  -2.477  10.891   4.197
   69   2HD2  LEU   9          2HD2      LEU   9  -0.829  10.673   4.786
   70   3HD2  LEU   9          3HD2      LEU   9  -2.153  10.902   5.930
   71    H    TYR  10           H        TYR  10  -2.664   6.395   4.378
   72    HA   TYR  10           HA       TYR  10  -2.439   4.374   2.334
   73   1HB   TYR  10          2HB       TYR  10  -2.620   2.833   4.459
   74   2HB   TYR  10          1HB       TYR  10  -1.182   3.812   4.193
   75    HD1  TYR  10           1HD      TYR  10  -4.512   5.070   5.253
   76    HD2  TYR  10           2HD      TYR  10  -0.493   4.162   6.452
   77    HE1  TYR  10           1HE      TYR  10  -4.904   6.213   7.418
   78    HE2  TYR  10           2HE      TYR  10  -0.882   5.309   8.618
   79    HH   TYR  10           HH       TYR  10  -2.551   6.078  10.016
   80    H    GLN  11           H        GLN  11  -5.158   5.869   3.505
   81    HA   GLN  11           HA       GLN  11  -6.859   3.437   3.411
   82   1HB   GLN  11          2HB       GLN  11  -7.046   6.013   4.687
   83   2HB   GLN  11          1HB       GLN  11  -8.437   5.795   3.624
   84   1HG   GLN  11          2HG       GLN  11  -7.767   3.382   5.155
   85   2HG   GLN  11          1HG       GLN  11  -8.204   4.752   6.175
   86   1HE2  GLN  11          1HE2      GLN  11  -9.423   2.482   3.771
   87   2HE2  GLN  11          2HE2      GLN  11 -11.049   2.958   3.876
   88    H    VAL  12           H        VAL  12  -5.411   4.424   1.103
   89    HA   VAL  12           HA       VAL  12  -7.504   5.529  -0.655
   90    HB   VAL  12           HB       VAL  12  -5.376   6.621  -0.852
   91   1HG1  VAL  12          1HG1      VAL  12  -4.011   4.882   0.181
   92   2HG1  VAL  12          2HG1      VAL  12  -3.323   5.327  -1.380
   93   3HG1  VAL  12          3HG1      VAL  12  -4.244   3.833  -1.216
   94   1HG2  VAL  12          1HG2      VAL  12  -5.649   6.664  -3.090
   95   2HG2  VAL  12          2HG2      VAL  12  -6.563   5.157  -3.008
   96   3HG2  VAL  12          3HG2      VAL  12  -4.812   5.118  -3.223
   97    H    GLU  13           H        GLU  13  -8.697   3.404  -0.467
   98    HA   GLU  13           HA       GLU  13  -9.220   1.245  -1.246
   99   1HB   GLU  13          2HB       GLU  13  -7.977   2.683  -3.575
  100   2HB   GLU  13          1HB       GLU  13  -8.427   0.985  -3.742
  101   1HG   GLU  13          2HG       GLU  13 -10.581   2.332  -2.440
  102   2HG   GLU  13          1HG       GLU  13 -10.130   3.280  -3.858
  103    H    LEU  14           H        LEU  14  -7.129   1.013   0.427
  104    HA   LEU  14           HA       LEU  14  -4.652   0.123  -0.459
  105   1HB   LEU  14          2HB       LEU  14  -4.403  -0.943   1.628
  106   2HB   LEU  14          1HB       LEU  14  -5.567   0.336   1.950
  107    HG   LEU  14           HG       LEU  14  -6.132  -2.607   1.519
  108   1HD1  LEU  14          1HD1      LEU  14  -6.388  -0.648   3.797
  109   2HD1  LEU  14          2HD1      LEU  14  -5.630  -2.242   3.790
  110   3HD1  LEU  14          3HD1      LEU  14  -7.387  -2.101   3.746
  111   1HD2  LEU  14          1HD2      LEU  14  -7.770  -1.227   0.274
  112   2HD2  LEU  14          2HD2      LEU  14  -8.100  -0.304   1.739
  113   3HD2  LEU  14          3HD2      LEU  14  -8.518  -2.016   1.661
  114    H    GLY  15           H        GLY  15  -3.994  -2.373  -0.220
  115   1HA   GLY  15          2HA       GLY  15  -5.747  -4.445  -0.945
  116   2HA   GLY  15          1HA       GLY  15  -5.212  -3.714  -2.458
  117    HA   PRO  16           HA       PRO  16  -1.491  -6.025  -2.184
  118   1HB   PRO  16          2HB       PRO  16   0.187  -4.385  -3.595
  119   2HB   PRO  16          1HB       PRO  16  -1.090  -5.354  -4.351
  120   1HG   PRO  16          2HG       PRO  16  -1.003  -2.419  -3.878
  121   2HG   PRO  16          1HG       PRO  16  -1.918  -3.334  -5.087
  122   1HD   PRO  16          2HD       PRO  16  -2.931  -2.255  -2.657
  123   2HD   PRO  16          1HD       PRO  16  -3.774  -3.371  -3.752
  124    H    GLY  17           H        GLY  17   1.060  -5.221  -2.082
  125   1HA   GLY  17          2HA       GLY  17   1.590  -3.182  -0.082
  126   2HA   GLY  17          1HA       GLY  17   1.680  -4.809   0.596
  127    HA   PRO  18           HA       PRO  18   5.822  -3.973  -1.169
  128   1HB   PRO  18          2HB       PRO  18   7.175  -4.911   1.032
  129   2HB   PRO  18          1HB       PRO  18   6.624  -3.235   0.862
  130   1HG   PRO  18          2HG       PRO  18   5.503  -5.413   2.560
  131   2HG   PRO  18          1HG       PRO  18   5.425  -3.659   2.790
  132   1HD   PRO  18          2HD       PRO  18   3.342  -5.301   1.789
  133   2HD   PRO  18          1HD       PRO  18   3.395  -3.525   1.732
  134    H    SER  19           H        SER  19   4.067  -6.702  -0.113
  135    HA   SER  19           HA       SER  19   5.963  -8.797  -0.310
  136   1HB   SER  19          2HB       SER  19   3.025  -8.557  -0.506
  137   2HB   SER  19          1HB       SER  19   3.707  -9.948  -1.340
  138    HG   SER  19           HG       SER  19   4.976 -10.050   0.809
  139    H    GLY  20           H        GLY  20   3.538  -8.829  -2.837
  140   1HA   GLY  20          2HA       GLY  20   5.752  -9.018  -4.828
  141   2HA   GLY  20          1HA       GLY  20   4.142  -9.705  -5.043
  142    H    ASP  21           H        ASP  21   4.100  -8.514  -7.109
  143    HA   ASP  21           HA       ASP  21   3.229  -6.735  -8.375
  144   1HB   ASP  21          2HB       ASP  21   2.750  -5.196  -5.831
  145   2HB   ASP  21          1HB       ASP  21   1.815  -5.179  -7.327
  146    H    MET  22           H        MET  22   4.480  -5.273  -9.445
  147    HA   MET  22           HA       MET  22   6.717  -4.011  -7.923
  148   1HB   MET  22          2HB       MET  22   7.223  -5.463  -9.945
  149   2HB   MET  22          1HB       MET  22   6.427  -4.235 -10.930
  150   1HG   MET  22          2HG       MET  22   8.015  -2.547 -10.210
  151   2HG   MET  22          1HG       MET  22   8.747  -3.669  -9.064
  152   1HE   MET  22          1HE       MET  22   7.665  -5.239 -12.646
  153   2HE   MET  22          2HE       MET  22   8.624  -4.109 -13.599
  154   3HE   MET  22          3HE       MET  22   7.393  -3.498 -12.496
  155    H    ALA  23           H        ALA  23   4.199  -3.299 -10.345
  156    HA   ALA  23           HA       ALA  23   3.124  -1.278 -10.854
  157   1HB   ALA  23          1HB       ALA  23   3.034   0.421  -9.037
  158   2HB   ALA  23          2HB       ALA  23   4.229  -0.512  -8.135
  159   3HB   ALA  23          3HB       ALA  23   2.635  -1.196  -8.456
  160    H    ALA  24           H        ALA  24   5.274  -1.439 -12.316
  161    HA   ALA  24           HA       ALA  24   6.879   1.035 -11.828
  162   1HB   ALA  24          1HB       ALA  24   8.428  -0.714 -12.015
  163   2HB   ALA  24          2HB       ALA  24   8.360  -0.100 -13.668
  164   3HB   ALA  24          3HB       ALA  24   7.471  -1.560 -13.232
  165    H    LYS  25           H        LYS  25   6.275   2.732 -13.070
  166    HA   LYS  25           HA       LYS  25   5.538   3.953 -14.936
  167   1HB   LYS  25          2HB       LYS  25   5.903   1.357 -16.457
  168   2HB   LYS  25          1HB       LYS  25   5.843   2.984 -17.135
  169   1HG   LYS  25          2HG       LYS  25   7.906   2.246 -15.064
  170   2HG   LYS  25          1HG       LYS  25   8.177   1.915 -16.776
  171   1HD   LYS  25          2HD       LYS  25   7.413   4.446 -17.036
  172   2HD   LYS  25          1HD       LYS  25   7.969   4.545 -15.364
  173   1HE   LYS  25          2HE       LYS  25  10.031   4.851 -16.258
  174   2HE   LYS  25          1HE       LYS  25   9.995   3.117 -16.575
  175   1HZ   LYS  25          1HZ       LYS  25  10.453   4.737 -18.506
  176   2HZ   LYS  25          2HZ       LYS  25   8.773   4.997 -18.484
  177   3HZ   LYS  25          3HZ       LYS  25   9.390   3.438 -18.761
  178    H    MET  26           H        MET  26   3.453   3.747 -13.636
  179    HA   MET  26           HA       MET  26   1.331   2.834 -15.434
  180   1HB   MET  26          2HB       MET  26   2.245   1.029 -13.489
  181   2HB   MET  26          1HB       MET  26   0.771   1.719 -12.809
  182   1HG   MET  26          2HG       MET  26  -0.499   1.117 -14.774
  183   2HG   MET  26          1HG       MET  26   0.963   0.614 -15.623
  184   1HE   MET  26          1HE       MET  26  -2.020  -1.465 -13.693
  185   2HE   MET  26          2HE       MET  26  -1.673   0.241 -13.419
  186   3HE   MET  26          3HE       MET  26  -1.281  -0.941 -12.173
  187    H    SER  27           H        SER  27  -0.280   4.332 -15.269
  188    HA   SER  27           HA       SER  27  -0.595   5.750 -12.657
  189   1HB   SER  27          2HB       SER  27  -0.904   7.087 -15.351
  190   2HB   SER  27          1HB       SER  27  -0.840   7.854 -13.767
  191    HG   SER  27           HG       SER  27   1.216   7.998 -14.190
  192    H    LYS  28           H        LYS  28  -2.785   7.069 -12.793
  193    HA   LYS  28           HA       LYS  28  -4.858   5.653 -14.353
  194   1HB   LYS  28          2HB       LYS  28  -4.464   5.400 -11.412
  195   2HB   LYS  28          1HB       LYS  28  -6.122   5.632 -11.968
  196   1HG   LYS  28          2HG       LYS  28  -6.237   3.529 -12.778
  197   2HG   LYS  28          1HG       LYS  28  -4.695   3.700 -13.620
  198   1HD   LYS  28          2HD       LYS  28  -3.452   3.088 -11.676
  199   2HD   LYS  28          1HD       LYS  28  -4.864   3.256 -10.633
  200   1HE   LYS  28          2HE       LYS  28  -5.801   1.427 -12.403
  201   2HE   LYS  28          1HE       LYS  28  -4.086   1.014 -12.411
  202   1HZ   LYS  28          1HZ       LYS  28  -4.280   1.103  -9.892
  203   2HZ   LYS  28          2HZ       LYS  28  -4.985  -0.229 -10.677
  204   3HZ   LYS  28          3HZ       LYS  28  -5.959   1.049 -10.124
  205    H    LYS  29           H        LYS  29  -7.091   6.742 -13.716
  206    HA   LYS  29           HA       LYS  29  -8.350   8.723 -13.677
  207   1HB   LYS  29          2HB       LYS  29  -6.068   9.293 -11.820
  208   2HB   LYS  29          1HB       LYS  29  -7.120  10.626 -12.298
  209   1HG   LYS  29          2HG       LYS  29  -9.037   9.603 -11.367
  210   2HG   LYS  29          1HG       LYS  29  -8.261   8.019 -11.295
  211   1HD   LYS  29          2HD       LYS  29  -8.210   8.792  -9.058
  212   2HD   LYS  29          1HD       LYS  29  -6.587   9.121  -9.668
  213   1HE   LYS  29          2HE       LYS  29  -8.223  11.362 -10.326
  214   2HE   LYS  29          1HE       LYS  29  -8.492  10.984  -8.625
  215   1HZ   LYS  29          1HZ       LYS  29  -6.642  12.294  -8.496
  216   2HZ   LYS  29          2HZ       LYS  29  -6.015  11.771  -9.986
  217   3HZ   LYS  29          3HZ       LYS  29  -5.911  10.768  -8.620
  218    H    LYS  30           H        LYS  30  -8.570  10.076 -15.395
  219    HA   LYS  30           HA       LYS  30  -6.163  10.848 -16.918
  220   1HB   LYS  30          2HB       LYS  30  -9.136  11.055 -17.417
  221   2HB   LYS  30          1HB       LYS  30  -7.967  11.871 -18.457
  222   1HG   LYS  30          2HG       LYS  30  -7.748   9.931 -19.583
  223   2HG   LYS  30          1HG       LYS  30  -6.965   9.269 -18.149
  224   1HD   LYS  30          2HD       LYS  30  -9.867   9.328 -17.870
  225   2HD   LYS  30          1HD       LYS  30  -9.356   8.375 -19.265
  226   1HE   LYS  30          2HE       LYS  30  -7.878   8.000 -16.693
  227   2HE   LYS  30          1HE       LYS  30  -9.487   7.290 -16.836
  228   1HZ   LYS  30          1HZ       LYS  30  -7.073   6.363 -17.916
  229   2HZ   LYS  30          2HZ       LYS  30  -8.103   6.774 -19.203
  230   3HZ   LYS  30          3HZ       LYS  30  -8.613   5.661 -18.025
  231    H    ALA  31           H        ALA  31  -6.431  12.072 -14.333
  232    HA   ALA  31           HA       ALA  31  -7.091  14.890 -15.084
  233   1HB   ALA  31          1HB       ALA  31  -6.667  14.210 -12.229
  234   2HB   ALA  31          2HB       ALA  31  -8.088  13.483 -12.980
  235   3HB   ALA  31          3HB       ALA  31  -7.894  15.236 -12.973
  236    H    GLY  32           H        GLY  32  -4.528  13.222 -15.427
  237   1HA   GLY  32          2HA       GLY  32  -2.713  15.361 -14.575
  238   2HA   GLY  32          1HA       GLY  32  -2.432  13.812 -13.780
  239    H    ARG  33           H        ARG  33  -2.852  11.992 -15.780
  240    HA   ARG  33           HA       ARG  33  -0.666  12.685 -17.686
  241   1HB   ARG  33          2HB       ARG  33  -0.714  10.573 -16.084
  242   2HB   ARG  33          1HB       ARG  33  -1.725   9.899 -17.363
  243   1HG   ARG  33          2HG       ARG  33   0.354  11.088 -18.763
  244   2HG   ARG  33          1HG       ARG  33   1.158  10.408 -17.348
  245   1HD   ARG  33          2HD       ARG  33  -0.767   8.511 -18.318
  246   2HD   ARG  33          1HD       ARG  33   0.251   9.027 -19.662
  247    HE   ARG  33           HE       ARG  33   1.982   8.498 -17.500
  248   1HH1  ARG  33          1HH1      ARG  33   2.040   7.162 -20.229
  249   2HH1  ARG  33          2HH1      ARG  33   1.798   5.501 -19.800
  250   1HH2  ARG  33          1HH2      ARG  33   0.655   6.219 -16.604
  251   2HH2  ARG  33          2HH2      ARG  33   1.014   4.968 -17.747
  252    H    GLY  34           H        GLY  34  -3.699  13.259 -17.837
  253   1HA   GLY  34          2HA       GLY  34  -4.399  11.715 -20.268
  254   2HA   GLY  34          1HA       GLY  34  -5.484  12.789 -19.382
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1   6.567   9.320 -10.681
    2   2H    MET   1          2HT       MET   1   6.325  10.627  -9.622
    3   3H    MET   1          3HT       MET   1   7.752   9.711  -9.531
    4    HA   MET   1           HA       MET   1   8.746  11.044 -10.968
    5   1HB   MET   1          2HB       MET   1   7.643   9.449 -12.621
    6   2HB   MET   1          1HB       MET   1   6.391  10.673 -12.833
    7   1HG   MET   1          2HG       MET   1   7.794  12.114 -13.948
    8   2HG   MET   1          1HG       MET   1   9.218  11.589 -13.050
    9   1HE   MET   1          1HE       MET   1  10.249  10.834 -16.688
   10   2HE   MET   1          2HE       MET   1  10.645  11.638 -15.171
   11   3HE   MET   1          3HE       MET   1   9.257  12.181 -16.110
   12    H    GLY   2           H        GLY   2   7.821  12.604  -9.160
   13   1HA   GLY   2          2HA       GLY   2   7.229  14.854  -8.793
   14   2HA   GLY   2          1HA       GLY   2   6.972  15.018 -10.530
   15    H    LYS   3           H        LYS   3   5.319  15.627  -7.942
   16    HA   LYS   3           HA       LYS   3   3.032  15.706  -7.430
   17   1HB   LYS   3          2HB       LYS   3   3.185  16.039 -10.131
   18   2HB   LYS   3          1HB       LYS   3   2.188  14.587 -10.036
   19   1HG   LYS   3          2HG       LYS   3   0.408  15.827  -9.446
   20   2HG   LYS   3          1HG       LYS   3   1.286  16.436  -8.042
   21   1HD   LYS   3          2HD       LYS   3   2.119  18.303  -9.217
   22   2HD   LYS   3          1HD       LYS   3   1.780  17.575 -10.788
   23   1HE   LYS   3          2HE       LYS   3  -0.610  17.851  -9.110
   24   2HE   LYS   3          1HE       LYS   3   0.150  19.395  -9.494
   25   1HZ   LYS   3          1HZ       LYS   3  -1.246  17.558 -11.212
   26   2HZ   LYS   3          2HZ       LYS   3   0.243  18.075 -11.848
   27   3HZ   LYS   3          3HZ       LYS   3  -0.941  19.215 -11.415
   28    H    ALA   4           H        ALA   4   4.421  13.386  -6.661
   29    HA   ALA   4           HA       ALA   4   2.397  11.241  -7.170
   30   1HB   ALA   4          1HB       ALA   4   5.161  10.730  -6.083
   31   2HB   ALA   4          2HB       ALA   4   4.903  10.915  -7.818
   32   3HB   ALA   4          3HB       ALA   4   4.088   9.622  -6.939
   33    H    GLU   5           H        GLU   5   1.983  13.299  -5.223
   34    HA   GLU   5           HA       GLU   5   2.220  11.691  -2.710
   35   1HB   GLU   5          2HB       GLU   5   2.975  14.465  -3.286
   36   2HB   GLU   5          1HB       GLU   5   1.909  14.319  -1.889
   37   1HG   GLU   5          2HG       GLU   5   4.130  14.084  -1.037
   38   2HG   GLU   5          1HG       GLU   5   3.454  12.455  -1.074
   39    H    ASN   6           H        ASN   6   0.329  11.468  -1.527
   40    HA   ASN   6           HA       ASN   6  -2.078  12.882  -2.606
   41   1HB   ASN   6          2HB       ASN   6  -1.560  10.030  -2.028
   42   2HB   ASN   6          1HB       ASN   6  -3.091  10.642  -1.403
   43   1HD2  ASN   6          1HD2      ASN   6  -4.745  10.342  -2.896
   44   2HD2  ASN   6          2HD2      ASN   6  -4.575  10.450  -4.581
   45    H    TYR   7           H        TYR   7  -3.820  13.160  -0.948
   46    HA   TYR   7           HA       TYR   7  -2.637  14.004   1.607
   47   1HB   TYR   7          2HB       TYR   7  -5.567  14.174   1.310
   48   2HB   TYR   7          1HB       TYR   7  -4.410  15.417   1.773
   49    HD1  TYR   7           1HD      TYR   7  -6.672  14.466  -0.714
   50    HD2  TYR   7           2HD      TYR   7  -2.734  16.108  -0.228
   51    HE1  TYR   7           1HE      TYR   7  -6.794  15.431  -2.994
   52    HE2  TYR   7           2HE      TYR   7  -2.855  17.074  -2.507
   53    HH   TYR   7           HH       TYR   7  -4.172  17.471  -4.267
   54    H    GLU   8           H        GLU   8  -5.206  11.810   0.502
   55    HA   GLU   8           HA       GLU   8  -5.130  10.498   3.183
   56   1HB   GLU   8          2HB       GLU   8  -7.207  10.165   0.997
   57   2HB   GLU   8          1HB       GLU   8  -7.325   9.615   2.670
   58   1HG   GLU   8          2HG       GLU   8  -7.086  12.516   1.816
   59   2HG   GLU   8          1HG       GLU   8  -8.590  11.722   2.290
   60    H    LEU   9           H        LEU   9  -2.979   9.654   2.116
   61    HA   LEU   9           HA       LEU   9  -3.391   7.472   0.182
   62   1HB   LEU   9          2HB       LEU   9  -1.357   8.966   0.160
   63   2HB   LEU   9          1HB       LEU   9  -0.866   8.224   1.683
   64    HG   LEU   9           HG       LEU   9  -1.570   6.178  -0.234
   65   1HD1  LEU   9          1HD1      LEU   9  -0.272   8.484  -1.351
   66   2HD1  LEU   9          2HD1      LEU   9  -0.675   6.961  -2.144
   67   3HD1  LEU   9          3HD1      LEU   9   0.875   7.146  -1.322
   68   1HD2  LEU   9          1HD2      LEU   9  -0.039   6.228   1.891
   69   2HD2  LEU   9          2HD2      LEU   9   1.200   6.796   0.773
   70   3HD2  LEU   9          3HD2      LEU   9   0.439   5.225   0.522
   71    H    TYR  10           H        TYR  10  -4.157   7.657   3.294
   72    HA   TYR  10           HA       TYR  10  -2.855   5.197   4.246
   73   1HB   TYR  10          2HB       TYR  10  -5.135   6.313   5.755
   74   2HB   TYR  10          1HB       TYR  10  -3.547   5.822   6.323
   75    HD1  TYR  10           1HD      TYR  10  -1.671   7.391   4.802
   76    HD2  TYR  10           2HD      TYR  10  -5.498   8.547   6.374
   77    HE1  TYR  10           1HE      TYR  10  -0.938   9.760   4.842
   78    HE2  TYR  10           2HE      TYR  10  -4.766  10.916   6.413
   79    HH   TYR  10           HH       TYR  10  -1.925  11.987   4.833
   80    H    GLN  11           H        GLN  11  -5.537   5.947   2.342
   81    HA   GLN  11           HA       GLN  11  -7.172   3.673   3.280
   82   1HB   GLN  11          2HB       GLN  11  -8.623   4.403   1.308
   83   2HB   GLN  11          1HB       GLN  11  -8.451   5.585   2.601
   84   1HG   GLN  11          2HG       GLN  11  -7.391   7.050   1.246
   85   2HG   GLN  11          1HG       GLN  11  -6.325   5.797   0.607
   86   1HE2  GLN  11          1HE2      GLN  11  -8.715   7.925  -0.350
   87   2HE2  GLN  11          2HE2      GLN  11  -9.300   7.087  -1.706
   88    H    VAL  12           H        VAL  12  -4.575   3.054   2.369
   89    HA   VAL  12           HA       VAL  12  -5.000   1.860  -0.305
   90    HB   VAL  12           HB       VAL  12  -3.060   3.222  -0.241
   91   1HG1  VAL  12          1HG1      VAL  12  -2.866   3.477   2.161
   92   2HG1  VAL  12          2HG1      VAL  12  -1.319   2.917   1.520
   93   3HG1  VAL  12          3HG1      VAL  12  -2.398   1.784   2.337
   94   1HG2  VAL  12          1HG2      VAL  12  -1.862   0.524   0.339
   95   2HG2  VAL  12          2HG2      VAL  12  -1.406   1.694  -0.899
   96   3HG2  VAL  12          3HG2      VAL  12  -2.881   0.744  -1.082
   97    H    GLU  13           H        GLU  13  -6.367   0.182   0.838
   98    HA   GLU  13           HA       GLU  13  -6.633  -1.894   1.928
   99   1HB   GLU  13          2HB       GLU  13  -4.130  -2.130   0.269
  100   2HB   GLU  13          1HB       GLU  13  -4.686  -3.491   1.243
  101   1HG   GLU  13          2HG       GLU  13  -6.925  -3.301   0.137
  102   2HG   GLU  13          1HG       GLU  13  -6.254  -2.054  -0.916
  103    H    LEU  14           H        LEU  14  -5.614   0.021   3.702
  104    HA   LEU  14           HA       LEU  14  -3.218  -0.497   5.032
  105   1HB   LEU  14          2HB       LEU  14  -5.120   1.215   5.568
  106   2HB   LEU  14          1HB       LEU  14  -5.745  -0.062   6.612
  107    HG   LEU  14           HG       LEU  14  -2.853   0.769   6.769
  108   1HD1  LEU  14          1HD1      LEU  14  -4.942   2.548   7.201
  109   2HD1  LEU  14          2HD1      LEU  14  -3.320   2.682   7.881
  110   3HD1  LEU  14          3HD1      LEU  14  -4.606   1.916   8.812
  111   1HD2  LEU  14          1HD2      LEU  14  -4.588  -1.102   8.088
  112   2HD2  LEU  14          2HD2      LEU  14  -4.062   0.104   9.261
  113   3HD2  LEU  14          3HD2      LEU  14  -2.868  -0.827   8.358
  114    H    GLY  15           H        GLY  15  -2.673  -1.889   6.830
  115   1HA   GLY  15          2HA       GLY  15  -4.244  -3.792   8.102
  116   2HA   GLY  15          1HA       GLY  15  -3.783  -4.563   6.583
  117    HA   PRO  16           HA       PRO  16  -0.328  -4.859   9.769
  118   1HB   PRO  16          2HB       PRO  16  -0.769  -7.441  10.605
  119   2HB   PRO  16          1HB       PRO  16  -1.450  -6.020  11.417
  120   1HG   PRO  16          2HG       PRO  16  -2.809  -8.004   9.653
  121   2HG   PRO  16          1HG       PRO  16  -3.488  -6.999  10.943
  122   1HD   PRO  16          2HD       PRO  16  -3.704  -6.499   8.164
  123   2HD   PRO  16          1HD       PRO  16  -4.084  -5.350   9.466
  124    H    GLY  17           H        GLY  17   0.725  -4.849   7.566
  125   1HA   GLY  17          2HA       GLY  17   0.932  -7.157   5.918
  126   2HA   GLY  17          1HA       GLY  17   2.125  -5.859   5.974
  127    HA   PRO  18           HA       PRO  18   3.827  -9.746   7.967
  128   1HB   PRO  18          2HB       PRO  18   5.569 -10.441   5.956
  129   2HB   PRO  18          1HB       PRO  18   3.912 -11.060   6.074
  130   1HG   PRO  18          2HG       PRO  18   5.021  -9.010   4.213
  131   2HG   PRO  18          1HG       PRO  18   3.637 -10.092   3.993
  132   1HD   PRO  18          2HD       PRO  18   3.502  -7.349   4.676
  133   2HD   PRO  18          1HD       PRO  18   2.168  -8.517   4.781
  134    H    SER  19           H        SER  19   4.820  -6.741   6.848
  135    HA   SER  19           HA       SER  19   7.383  -6.975   8.357
  136   1HB   SER  19          2HB       SER  19   6.956  -5.850   5.592
  137   2HB   SER  19          1HB       SER  19   8.288  -5.294   6.601
  138    HG   SER  19           HG       SER  19   7.751  -7.889   5.616
  139    H    GLY  20           H        GLY  20   8.174  -4.787   9.059
  140   1HA   GLY  20          2HA       GLY  20   7.032  -2.332   8.924
  141   2HA   GLY  20          1HA       GLY  20   5.889  -3.172   9.972
  142    H    ASP  21           H        ASP  21   6.460  -1.822  11.774
  143    HA   ASP  21           HA       ASP  21   9.260  -1.992  12.736
  144   1HB   ASP  21          2HB       ASP  21   7.863   0.172  12.735
  145   2HB   ASP  21          1HB       ASP  21   6.981  -0.539  14.089
  146    H    MET  22           H        MET  22   9.587  -2.552  15.077
  147    HA   MET  22           HA       MET  22   7.497  -4.396  16.134
  148   1HB   MET  22          2HB       MET  22   9.454  -5.547  14.834
  149   2HB   MET  22          1HB       MET  22  10.407  -5.156  16.267
  150   1HG   MET  22          2HG       MET  22   8.850  -6.373  17.690
  151   2HG   MET  22          1HG       MET  22   7.783  -6.675  16.319
  152   1HE   MET  22          1HE       MET  22   8.528  -9.141  14.483
  153   2HE   MET  22          2HE       MET  22   7.457  -8.475  15.713
  154   3HE   MET  22          3HE       MET  22   8.346  -9.960  16.041
  155    H    ALA  23           H        ALA  23   8.215  -1.707  16.938
  156    HA   ALA  23           HA       ALA  23   9.123  -2.318  19.712
  157   1HB   ALA  23          1HB       ALA  23  11.000  -1.118  19.377
  158   2HB   ALA  23          2HB       ALA  23   9.983   0.305  19.146
  159   3HB   ALA  23          3HB       ALA  23  10.476  -0.663  17.756
  160    H    ALA  24           H        ALA  24   6.534  -2.246  19.445
  161    HA   ALA  24           HA       ALA  24   5.755   0.452  20.430
  162   1HB   ALA  24          1HB       ALA  24   3.513  -0.379  19.032
  163   2HB   ALA  24          2HB       ALA  24   4.837  -0.845  17.965
  164   3HB   ALA  24          3HB       ALA  24   4.669   0.832  18.478
  165    H    LYS  25           H        LYS  25   4.855  -2.965  20.022
  166    HA   LYS  25           HA       LYS  25   3.445  -4.324  21.335
  167   1HB   LYS  25          2HB       LYS  25   5.598  -3.676  22.752
  168   2HB   LYS  25          1HB       LYS  25   4.410  -2.827  23.742
  169   1HG   LYS  25          2HG       LYS  25   3.135  -4.869  24.061
  170   2HG   LYS  25          1HG       LYS  25   4.184  -5.743  22.943
  171   1HD   LYS  25          2HD       LYS  25   5.208  -6.355  24.907
  172   2HD   LYS  25          1HD       LYS  25   6.059  -4.833  24.639
  173   1HE   LYS  25          2HE       LYS  25   3.560  -5.173  26.324
  174   2HE   LYS  25          1HE       LYS  25   5.196  -4.973  26.950
  175   1HZ   LYS  25          1HZ       LYS  25   3.582  -3.024  25.413
  176   2HZ   LYS  25          2HZ       LYS  25   5.258  -2.849  25.632
  177   3HZ   LYS  25          3HZ       LYS  25   4.219  -2.851  26.976
  178    H    MET  26           H        MET  26   1.546  -3.062  20.462
  179    HA   MET  26           HA       MET  26  -0.501  -1.974  20.821
  180   1HB   MET  26          2HB       MET  26  -0.649  -3.660  22.638
  181   2HB   MET  26          1HB       MET  26   0.165  -2.536  23.727
  182   1HG   MET  26          2HG       MET  26  -1.729  -1.353  24.079
  183   2HG   MET  26          1HG       MET  26  -2.106  -1.307  22.357
  184   1HE   MET  26          1HE       MET  26  -2.928  -2.581  25.732
  185   2HE   MET  26          2HE       MET  26  -4.515  -3.246  25.354
  186   3HE   MET  26          3HE       MET  26  -4.119  -1.599  24.870
  187    H    SER  27           H        SER  27  -0.449   0.177  20.363
  188    HA   SER  27           HA       SER  27   0.870   1.988  22.347
  189   1HB   SER  27          2HB       SER  27   1.381   3.490  20.553
  190   2HB   SER  27          1HB       SER  27   1.840   1.887  19.987
  191    HG   SER  27           HG       SER  27  -0.087   3.596  19.078
  192    H    LYS  28           H        LYS  28  -1.040   2.247  23.612
  193    HA   LYS  28           HA       LYS  28  -3.573   2.988  22.405
  194   1HB   LYS  28          2HB       LYS  28  -3.066   1.915  24.750
  195   2HB   LYS  28          1HB       LYS  28  -2.881   3.592  25.264
  196   1HG   LYS  28          2HG       LYS  28  -5.116   4.139  24.631
  197   2HG   LYS  28          1HG       LYS  28  -5.306   2.630  23.737
  198   1HD   LYS  28          2HD       LYS  28  -5.494   1.345  25.682
  199   2HD   LYS  28          1HD       LYS  28  -4.686   2.557  26.678
  200   1HE   LYS  28          2HE       LYS  28  -6.654   4.074  26.319
  201   2HE   LYS  28          1HE       LYS  28  -7.469   2.746  25.491
  202   1HZ   LYS  28          1HZ       LYS  28  -7.436   1.447  27.449
  203   2HZ   LYS  28          2HZ       LYS  28  -8.000   2.983  27.906
  204   3HZ   LYS  28          3HZ       LYS  28  -6.399   2.525  28.246
  205    H    LYS  29           H        LYS  29  -4.358   5.018  21.993
  206    HA   LYS  29           HA       LYS  29  -4.195   7.317  21.507
  207   1HB   LYS  29          2HB       LYS  29  -3.195   7.304  24.372
  208   2HB   LYS  29          1HB       LYS  29  -3.850   8.699  23.515
  209   1HG   LYS  29          2HG       LYS  29  -5.432   6.145  23.810
  210   2HG   LYS  29          1HG       LYS  29  -5.468   7.403  25.046
  211   1HD   LYS  29          2HD       LYS  29  -6.657   8.851  23.733
  212   2HD   LYS  29          1HD       LYS  29  -5.860   8.320  22.251
  213   1HE   LYS  29          2HE       LYS  29  -8.244   7.658  22.271
  214   2HE   LYS  29          1HE       LYS  29  -7.185   6.246  22.265
  215   1HZ   LYS  29          1HZ       LYS  29  -7.473   6.741  24.893
  216   2HZ   LYS  29          2HZ       LYS  29  -8.393   5.614  24.016
  217   3HZ   LYS  29          3HZ       LYS  29  -9.002   7.175  24.303
  218    H    LYS  30           H        LYS  30  -2.401   6.986  19.977
  219    HA   LYS  30           HA       LYS  30   0.349   7.269  20.891
  220   1HB   LYS  30          2HB       LYS  30  -0.596   6.190  18.681
  221   2HB   LYS  30          1HB       LYS  30  -0.519   7.844  18.070
  222   1HG   LYS  30          2HG       LYS  30   1.850   7.979  18.565
  223   2HG   LYS  30          1HG       LYS  30   1.814   6.409  19.368
  224   1HD   LYS  30          2HD       LYS  30   2.699   6.152  17.100
  225   2HD   LYS  30          1HD       LYS  30   1.130   5.354  17.222
  226   1HE   LYS  30          2HE       LYS  30   0.642   8.066  16.510
  227   2HE   LYS  30          1HE       LYS  30   1.917   7.469  15.450
  228   1HZ   LYS  30          1HZ       LYS  30  -0.529   7.076  14.808
  229   2HZ   LYS  30          2HZ       LYS  30  -0.475   5.828  15.962
  230   3HZ   LYS  30          3HZ       LYS  30   0.576   5.802  14.628
  231    H    ALA  31           H        ALA  31   1.045   9.198  21.698
  232    HA   ALA  31           HA       ALA  31   0.156  11.679  20.283
  233   1HB   ALA  31          1HB       ALA  31   0.888  12.157  23.049
  234   2HB   ALA  31          2HB       ALA  31  -0.410  10.969  22.944
  235   3HB   ALA  31          3HB       ALA  31  -0.610  12.561  22.210
  236    H    GLY  32           H        GLY  32   1.732  13.482  20.496
  237   1HA   GLY  32          2HA       GLY  32   4.252  13.513  21.573
  238   2HA   GLY  32          1HA       GLY  32   4.464  12.491  20.150
  239    H    ARG  33           H        ARG  33   5.907  14.263  19.390
  240    HA   ARG  33           HA       ARG  33   4.301  16.436  18.107
  241   1HB   ARG  33          2HB       ARG  33   6.079  16.915  20.106
  242   2HB   ARG  33          1HB       ARG  33   7.149  17.006  18.706
  243   1HG   ARG  33          2HG       ARG  33   6.275  18.981  18.053
  244   2HG   ARG  33          1HG       ARG  33   4.623  18.387  18.233
  245   1HD   ARG  33          2HD       ARG  33   4.625  19.984  19.900
  246   2HD   ARG  33          1HD       ARG  33   5.220  18.605  20.825
  247    HE   ARG  33           HE       ARG  33   7.423  20.013  19.626
  248   1HH1  ARG  33          1HH1      ARG  33   5.305  19.743  22.311
  249   2HH1  ARG  33          2HH1      ARG  33   6.150  20.909  23.275
  250   1HH2  ARG  33          1HH2      ARG  33   8.425  21.710  20.784
  251   2HH2  ARG  33          2HH2      ARG  33   7.917  22.020  22.411
  252    H    GLY  34           H        GLY  34   4.231  15.125  16.177
  253   1HA   GLY  34          2HA       GLY  34   5.268  15.240  13.940
  254   2HA   GLY  34          1HA       GLY  34   6.841  15.093  14.724
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1   7.269   5.159  -0.146
    2   2H    MET   1          2HT       MET   1   7.231   6.831  -0.449
    3   3H    MET   1          3HT       MET   1   6.320   6.175   0.826
    4    HA   MET   1           HA       MET   1   8.000   6.372   2.232
    5   1HB   MET   1          2HB       MET   1   9.017   4.484   0.269
    6   2HB   MET   1          1HB       MET   1  10.321   5.463   0.942
    7   1HG   MET   1          2HG       MET   1   9.966   4.695   3.106
    8   2HG   MET   1          1HG       MET   1   8.270   4.320   2.804
    9   1HE   MET   1          1HE       MET   1  11.678   2.280   3.371
   10   2HE   MET   1          2HE       MET   1  11.765   3.746   2.399
   11   3HE   MET   1          3HE       MET   1  12.044   2.180   1.643
   12    H    GLY   2           H        GLY   2   8.929   8.306   2.682
   13   1HA   GLY   2          2HA       GLY   2  10.805   9.870   2.174
   14   2HA   GLY   2          1HA       GLY   2  10.374   9.709   0.471
   15    H    LYS   3           H        LYS   3   9.308  11.044   3.568
   16    HA   LYS   3           HA       LYS   3   8.052  12.997   3.968
   17   1HB   LYS   3          2HB       LYS   3   9.232  13.622   1.669
   18   2HB   LYS   3          1HB       LYS   3   7.598  13.420   1.039
   19   1HG   LYS   3          2HG       LYS   3   7.975  15.042   3.527
   20   2HG   LYS   3          1HG       LYS   3   8.399  15.767   1.975
   21   1HD   LYS   3          2HD       LYS   3   6.062  14.879   1.208
   22   2HD   LYS   3          1HD       LYS   3   5.717  14.805   2.937
   23   1HE   LYS   3          2HE       LYS   3   5.124  16.985   2.688
   24   2HE   LYS   3          1HE       LYS   3   6.861  17.284   2.725
   25   1HZ   LYS   3          1HZ       LYS   3   5.023  17.253   0.450
   26   2HZ   LYS   3          2HZ       LYS   3   6.611  16.709   0.187
   27   3HZ   LYS   3          3HZ       LYS   3   6.335  18.281   0.769
   28    H    ALA   4           H        ALA   4   6.819  10.467   3.947
   29    HA   ALA   4           HA       ALA   4   4.370  10.604   2.352
   30   1HB   ALA   4          1HB       ALA   4   4.145   8.761   4.540
   31   2HB   ALA   4          2HB       ALA   4   5.756   8.610   3.838
   32   3HB   ALA   4          3HB       ALA   4   4.330   8.404   2.823
   33    H    GLU   5           H        GLU   5   2.905  12.155   2.918
   34    HA   GLU   5           HA       GLU   5   1.751  12.088   5.600
   35   1HB   GLU   5          2HB       GLU   5   3.683  14.182   4.803
   36   2HB   GLU   5          1HB       GLU   5   2.182  14.781   5.513
   37   1HG   GLU   5          2HG       GLU   5   2.560  13.012   7.352
   38   2HG   GLU   5          1HG       GLU   5   4.207  12.903   6.730
   39    H    ASN   6           H        ASN   6   0.508  11.494   3.247
   40    HA   ASN   6           HA       ASN   6  -0.911  13.936   2.342
   41   1HB   ASN   6          2HB       ASN   6  -0.165  11.505   1.095
   42   2HB   ASN   6          1HB       ASN   6  -1.927  11.502   1.179
   43   1HD2  ASN   6          1HD2      ASN   6  -2.047  11.882  -1.179
   44   2HD2  ASN   6          2HD2      ASN   6  -1.710  13.416  -1.822
   45    H    TYR   7           H        TYR   7  -3.428  13.248   1.892
   46    HA   TYR   7           HA       TYR   7  -4.461  12.632   4.592
   47   1HB   TYR   7          2HB       TYR   7  -6.457  13.283   2.562
   48   2HB   TYR   7          1HB       TYR   7  -6.137  14.060   4.106
   49    HD1  TYR   7           1HD      TYR   7  -3.960  15.536   4.225
   50    HD2  TYR   7           2HD      TYR   7  -5.948  14.425   0.582
   51    HE1  TYR   7           1HE      TYR   7  -2.870  17.429   3.052
   52    HE2  TYR   7           2HE      TYR   7  -4.857  16.318  -0.591
   53    HH   TYR   7           HH       TYR   7  -2.263  18.069   0.767
   54    H    GLU   8           H        GLU   8  -5.104  11.662   1.218
   55    HA   GLU   8           HA       GLU   8  -6.552   9.280   2.221
   56   1HB   GLU   8          2HB       GLU   8  -6.123  10.273  -0.614
   57   2HB   GLU   8          1HB       GLU   8  -7.173   8.938  -0.138
   58   1HG   GLU   8          2HG       GLU   8  -8.494  10.496   1.267
   59   2HG   GLU   8          1HG       GLU   8  -7.471  11.827   0.730
   60    H    LEU   9           H        LEU   9  -3.543   9.628   2.390
   61    HA   LEU   9           HA       LEU   9  -2.405   7.791   0.453
   62   1HB   LEU   9          2HB       LEU   9  -1.245   9.615   1.982
   63   2HB   LEU   9          1HB       LEU   9  -1.132   8.277   3.126
   64    HG   LEU   9           HG       LEU   9  -0.347   7.660   0.331
   65   1HD1  LEU   9          1HD1      LEU   9   0.739   9.774   0.421
   66   2HD1  LEU   9          2HD1      LEU   9   1.980   8.603   0.875
   67   3HD1  LEU   9          3HD1      LEU   9   1.177   9.563   2.119
   68   1HD2  LEU   9          1HD2      LEU   9  -0.247   6.230   2.542
   69   2HD2  LEU   9          2HD2      LEU   9   1.240   7.135   2.830
   70   3HD2  LEU   9          3HD2      LEU   9   1.079   6.138   1.384
   71    H    TYR  10           H        TYR  10  -3.282   7.490   3.913
   72    HA   TYR  10           HA       TYR  10  -2.713   4.640   3.945
   73   1HB   TYR  10          2HB       TYR  10  -4.518   5.934   5.941
   74   2HB   TYR  10          1HB       TYR  10  -3.268   4.723   6.191
   75    HD1  TYR  10           1HD      TYR  10  -1.042   6.035   4.630
   76    HD2  TYR  10           2HD      TYR  10  -3.823   7.619   7.495
   77    HE1  TYR  10           1HE      TYR  10   0.583   7.814   5.223
   78    HE2  TYR  10           2HE      TYR  10  -2.200   9.399   8.088
   79    HH   TYR  10           HH       TYR  10   0.872   9.323   7.591
   80    H    GLN  11           H        GLN  11  -5.212   6.423   2.606
   81    HA   GLN  11           HA       GLN  11  -7.325   4.435   3.176
   82   1HB   GLN  11          2HB       GLN  11  -7.553   7.069   2.778
   83   2HB   GLN  11          1HB       GLN  11  -7.648   6.559   1.090
   84   1HG   GLN  11          2HG       GLN  11  -9.684   5.568   1.368
   85   2HG   GLN  11          1HG       GLN  11  -9.286   4.977   2.982
   86   1HE2  GLN  11          1HE2      GLN  11  -8.632   7.402   4.288
   87   2HE2  GLN  11          2HE2      GLN  11 -10.009   8.393   4.345
   88    H    VAL  12           H        VAL  12  -5.085   3.355   1.982
   89    HA   VAL  12           HA       VAL  12  -5.923   2.870  -0.822
   90    HB   VAL  12           HB       VAL  12  -3.766   3.928  -0.701
   91   1HG1  VAL  12          1HG1      VAL  12  -3.336   3.353   1.675
   92   2HG1  VAL  12          2HG1      VAL  12  -1.942   3.031   0.642
   93   3HG1  VAL  12          3HG1      VAL  12  -2.961   1.700   1.185
   94   1HG2  VAL  12          1HG2      VAL  12  -3.792   2.277  -2.415
   95   2HG2  VAL  12          2HG2      VAL  12  -3.690   0.957  -1.252
   96   3HG2  VAL  12          3HG2      VAL  12  -2.289   1.989  -1.539
   97    H    GLU  13           H        GLU  13  -7.421   1.212   0.117
   98    HA   GLU  13           HA       GLU  13  -7.936  -0.990   0.772
   99   1HB   GLU  13          2HB       GLU  13  -5.868  -1.043  -1.223
  100   2HB   GLU  13          1HB       GLU  13  -5.590  -2.357  -0.078
  101   1HG   GLU  13          2HG       GLU  13  -8.204  -2.708  -0.353
  102   2HG   GLU  13          1HG       GLU  13  -7.927  -1.886  -1.890
  103    H    LEU  14           H        LEU  14  -7.518  -0.196   3.053
  104    HA   LEU  14           HA       LEU  14  -5.115  -0.431   4.452
  105   1HB   LEU  14          2HB       LEU  14  -7.995  -0.729   5.181
  106   2HB   LEU  14          1HB       LEU  14  -6.800  -1.282   6.351
  107    HG   LEU  14           HG       LEU  14  -7.497   1.142   6.607
  108   1HD1  LEU  14          1HD1      LEU  14  -5.070   1.948   6.730
  109   2HD1  LEU  14          2HD1      LEU  14  -4.620   0.373   6.078
  110   3HD1  LEU  14          3HD1      LEU  14  -5.445   0.481   7.634
  111   1HD2  LEU  14          1HD2      LEU  14  -5.748   1.626   4.197
  112   2HD2  LEU  14          2HD2      LEU  14  -6.858   2.742   4.992
  113   3HD2  LEU  14          3HD2      LEU  14  -7.490   1.411   4.024
  114    H    GLY  15           H        GLY  15  -3.955  -2.149   5.331
  115   1HA   GLY  15          2HA       GLY  15  -4.124  -4.554   6.143
  116   2HA   GLY  15          1HA       GLY  15  -4.946  -4.881   4.619
  117    HA   PRO  16           HA       PRO  16  -0.972  -5.755   2.941
  118   1HB   PRO  16          2HB       PRO  16  -1.700  -5.736   0.289
  119   2HB   PRO  16          1HB       PRO  16  -2.077  -7.065   1.398
  120   1HG   PRO  16          2HG       PRO  16  -3.889  -4.969   0.300
  121   2HG   PRO  16          1HG       PRO  16  -4.276  -6.601   0.872
  122   1HD   PRO  16          2HD       PRO  16  -4.687  -4.191   2.308
  123   2HD   PRO  16          1HD       PRO  16  -4.779  -5.836   2.973
  124    H    GLY  17           H        GLY  17  -0.328  -3.458   3.676
  125   1HA   GLY  17          2HA       GLY  17  -0.302  -1.472   1.472
  126   2HA   GLY  17          1HA       GLY  17   0.173  -1.161   3.142
  127    HA   PRO  18           HA       PRO  18   4.081  -1.692   0.807
  128   1HB   PRO  18          2HB       PRO  18   5.277   0.528   1.899
  129   2HB   PRO  18          1HB       PRO  18   4.269   0.578   0.442
  130   1HG   PRO  18          2HG       PRO  18   3.616   1.484   3.207
  131   2HG   PRO  18          1HG       PRO  18   2.964   2.047   1.658
  132   1HD   PRO  18          2HD       PRO  18   1.679   0.275   3.458
  133   2HD   PRO  18          1HD       PRO  18   1.196   0.591   1.777
  134    H    SER  19           H        SER  19   3.217  -1.350   4.155
  135    HA   SER  19           HA       SER  19   5.880  -2.365   5.021
  136   1HB   SER  19          2HB       SER  19   5.033  -1.835   7.322
  137   2HB   SER  19          1HB       SER  19   5.098  -0.428   6.263
  138    HG   SER  19           HG       SER  19   3.044  -0.237   6.610
  139    H    GLY  20           H        GLY  20   5.365  -4.522   4.116
  140   1HA   GLY  20          2HA       GLY  20   4.052  -6.199   6.137
  141   2HA   GLY  20          1HA       GLY  20   3.267  -6.203   4.557
  142    H    ASP  21           H        ASP  21   4.980  -6.495   2.684
  143    HA   ASP  21           HA       ASP  21   6.164  -9.081   3.024
  144   1HB   ASP  21          2HB       ASP  21   7.224  -8.619   0.801
  145   2HB   ASP  21          1HB       ASP  21   5.487  -8.310   0.814
  146    H    MET  22           H        MET  22   7.713  -9.156   4.657
  147    HA   MET  22           HA       MET  22   9.687  -7.144   5.132
  148   1HB   MET  22          2HB       MET  22   8.929  -9.539   6.340
  149   2HB   MET  22          1HB       MET  22  10.577  -9.849   5.789
  150   1HG   MET  22          2HG       MET  22  10.755  -8.900   7.988
  151   2HG   MET  22          1HG       MET  22  11.232  -7.637   6.852
  152   1HE   MET  22          1HE       MET  22   9.218  -4.784   7.686
  153   2HE   MET  22          2HE       MET  22   9.723  -5.559   6.186
  154   3HE   MET  22          3HE       MET  22  10.819  -5.528   7.564
  155    H    ALA  23           H        ALA  23  12.067  -7.436   4.752
  156    HA   ALA  23           HA       ALA  23  13.150  -9.273   2.883
  157   1HB   ALA  23          1HB       ALA  23  11.646  -7.044   1.708
  158   2HB   ALA  23          2HB       ALA  23  12.230  -8.526   0.950
  159   3HB   ALA  23          3HB       ALA  23  13.307  -7.139   1.123
  160    H    ALA  24           H        ALA  24  14.981  -9.124   4.196
  161    HA   ALA  24           HA       ALA  24  16.172  -6.529   4.832
  162   1HB   ALA  24          1HB       ALA  24  16.892  -7.849   6.522
  163   2HB   ALA  24          2HB       ALA  24  18.087  -8.463   5.379
  164   3HB   ALA  24          3HB       ALA  24  16.565  -9.324   5.610
  165    H    LYS  25           H        LYS  25  16.579  -5.692   2.686
  166    HA   LYS  25           HA       LYS  25  17.879  -5.353   0.763
  167   1HB   LYS  25          2HB       LYS  25  19.949  -6.917   2.334
  168   2HB   LYS  25          1HB       LYS  25  20.258  -5.790   1.014
  169   1HG   LYS  25          2HG       LYS  25  18.932  -4.099   2.541
  170   2HG   LYS  25          1HG       LYS  25  19.390  -5.214   3.828
  171   1HD   LYS  25          2HD       LYS  25  21.181  -3.693   3.793
  172   2HD   LYS  25          1HD       LYS  25  21.784  -5.035   2.819
  173   1HE   LYS  25          2HE       LYS  25  20.771  -3.741   0.807
  174   2HE   LYS  25          1HE       LYS  25  20.757  -2.356   1.899
  175   1HZ   LYS  25          1HZ       LYS  25  22.865  -3.122   0.409
  176   2HZ   LYS  25          2HZ       LYS  25  23.228  -3.838   1.906
  177   3HZ   LYS  25          3HZ       LYS  25  22.964  -2.163   1.804
  178    H    MET  26           H        MET  26  16.366  -6.934  -0.305
  179    HA   MET  26           HA       MET  26  17.709  -9.534  -0.904
  180   1HB   MET  26          2HB       MET  26  14.811  -8.680  -1.176
  181   2HB   MET  26          1HB       MET  26  15.440 -10.233  -1.726
  182   1HG   MET  26          2HG       MET  26  16.331 -10.518   0.678
  183   2HG   MET  26          1HG       MET  26  15.251  -9.188   1.099
  184   1HE   MET  26          1HE       MET  26  15.396 -12.902  -0.436
  185   2HE   MET  26          2HE       MET  26  14.363 -13.487   0.867
  186   3HE   MET  26          3HE       MET  26  15.806 -12.550   1.248
  187    H    SER  27           H        SER  27  16.520 -10.160  -3.299
  188    HA   SER  27           HA       SER  27  16.909  -9.825  -5.594
  189   1HB   SER  27          2HB       SER  27  15.691  -7.306  -4.548
  190   2HB   SER  27          1HB       SER  27  16.338  -7.281  -6.188
  191    HG   SER  27           HG       SER  27  14.566  -9.265  -5.194
  192    H    LYS  28           H        LYS  28  19.286 -10.106  -5.070
  193    HA   LYS  28           HA       LYS  28  20.794  -7.544  -5.366
  194   1HB   LYS  28          2HB       LYS  28  21.268  -9.148  -3.407
  195   2HB   LYS  28          1HB       LYS  28  21.980 -10.219  -4.614
  196   1HG   LYS  28          2HG       LYS  28  23.777  -8.842  -4.980
  197   2HG   LYS  28          1HG       LYS  28  22.839  -7.374  -4.702
  198   1HD   LYS  28          2HD       LYS  28  24.079  -7.363  -2.762
  199   2HD   LYS  28          1HD       LYS  28  22.740  -8.375  -2.219
  200   1HE   LYS  28          2HE       LYS  28  24.133 -10.365  -3.096
  201   2HE   LYS  28          1HE       LYS  28  25.488  -9.235  -3.129
  202   1HZ   LYS  28          1HZ       LYS  28  24.739 -10.661  -0.980
  203   2HZ   LYS  28          2HZ       LYS  28  23.947  -9.186  -0.689
  204   3HZ   LYS  28          3HZ       LYS  28  25.631  -9.219  -0.912
  205    H    LYS  29           H        LYS  29  20.360  -7.514  -7.691
  206    HA   LYS  29           HA       LYS  29  21.000  -9.641  -9.465
  207   1HB   LYS  29          2HB       LYS  29  20.970  -6.639  -9.837
  208   2HB   LYS  29          1HB       LYS  29  21.282  -7.758 -11.165
  209   1HG   LYS  29          2HG       LYS  29  19.048  -7.922 -11.423
  210   2HG   LYS  29          1HG       LYS  29  19.015  -8.796  -9.891
  211   1HD   LYS  29          2HD       LYS  29  17.469  -6.946  -9.713
  212   2HD   LYS  29          1HD       LYS  29  18.874  -6.569  -8.715
  213   1HE   LYS  29          2HE       LYS  29  19.741  -5.460 -10.975
  214   2HE   LYS  29          1HE       LYS  29  18.013  -5.361 -11.313
  215   1HZ   LYS  29          1HZ       LYS  29  18.530  -3.392 -10.200
  216   2HZ   LYS  29          2HZ       LYS  29  19.511  -4.176  -9.055
  217   3HZ   LYS  29          3HZ       LYS  29  17.822  -4.368  -9.007
  218    H    LYS  30           H        LYS  30  22.938  -6.778  -9.964
  219    HA   LYS  30           HA       LYS  30  25.396  -8.089  -9.007
  220   1HB   LYS  30          2HB       LYS  30  24.875  -8.946 -11.374
  221   2HB   LYS  30          1HB       LYS  30  25.212  -7.301 -11.920
  222   1HG   LYS  30          2HG       LYS  30  27.275  -8.500 -12.120
  223   2HG   LYS  30          1HG       LYS  30  27.436  -7.482 -10.688
  224   1HD   LYS  30          2HD       LYS  30  27.816  -9.304  -9.429
  225   2HD   LYS  30          1HD       LYS  30  26.237  -9.947  -9.882
  226   1HE   LYS  30          2HE       LYS  30  27.137 -11.408 -11.361
  227   2HE   LYS  30          1HE       LYS  30  28.240 -10.196 -12.013
  228   1HZ   LYS  30          1HZ       LYS  30  28.837 -11.070  -9.323
  229   2HZ   LYS  30          2HZ       LYS  30  29.876 -10.826 -10.644
  230   3HZ   LYS  30          3HZ       LYS  30  28.999 -12.275 -10.507
  231    H    ALA  31           H        ALA  31  24.510  -5.499 -11.327
  232    HA   ALA  31           HA       ALA  31  25.863  -3.567  -9.495
  233   1HB   ALA  31          1HB       ALA  31  27.398  -2.999 -11.047
  234   2HB   ALA  31          2HB       ALA  31  26.164  -2.849 -12.297
  235   3HB   ALA  31          3HB       ALA  31  26.891  -4.420 -11.960
  236    H    GLY  32           H        GLY  32  24.286  -3.289 -12.690
  237   1HA   GLY  32          2HA       GLY  32  22.130  -2.339 -13.139
  238   2HA   GLY  32          1HA       GLY  32  22.021  -1.849 -11.448
  239    H    ARG  33           H        ARG  33  24.501  -1.236 -13.953
  240    HA   ARG  33           HA       ARG  33  24.331   1.653 -13.233
  241   1HB   ARG  33          2HB       ARG  33  26.510  -0.146 -13.868
  242   2HB   ARG  33          1HB       ARG  33  26.509   1.230 -14.973
  243   1HG   ARG  33          2HG       ARG  33  27.060   2.705 -13.333
  244   2HG   ARG  33          1HG       ARG  33  25.996   1.934 -12.155
  245   1HD   ARG  33          2HD       ARG  33  27.784   0.001 -12.246
  246   2HD   ARG  33          1HD       ARG  33  28.841   1.277 -12.849
  247    HE   ARG  33           HE       ARG  33  28.566   2.439 -10.726
  248   1HH1  ARG  33          1HH2      ARG  33  28.403  -0.872 -10.616
  249   2HH1  ARG  33          2HH2      ARG  33  27.621  -0.979  -9.073
  250   1HH2  ARG  33          1HH1      ARG  33  26.956   2.418  -8.881
  251   2HH2  ARG  33          2HH1      ARG  33  26.801   0.885  -8.093
  252    H    GLY  34           H        GLY  34  22.481   2.133 -14.549
  253   1HA   GLY  34          2HA       GLY  34  23.161   2.550 -17.383
  254   2HA   GLY  34          1HA       GLY  34  21.789   1.481 -17.088
  Start of MODEL   13
    1   1H    MET   1          1HT       MET   1  -0.080  15.319  -7.043
    2   2H    MET   1          2HT       MET   1  -0.752  15.406  -8.599
    3   3H    MET   1          3HT       MET   1  -1.070  14.065  -7.608
    4    HA   MET   1           HA       MET   1  -2.905  15.768  -7.795
    5   1HB   MET   1          2HB       MET   1  -3.363  15.637  -5.329
    6   2HB   MET   1          1HB       MET   1  -2.923  14.083  -6.041
    7   1HG   MET   1          2HG       MET   1  -0.688  14.226  -5.191
    8   2HG   MET   1          1HG       MET   1  -0.900  15.915  -4.734
    9   1HE   MET   1          1HE       MET   1  -1.673  12.073  -3.364
   10   2HE   MET   1          2HE       MET   1  -0.717  12.767  -2.058
   11   3HE   MET   1          3HE       MET   1  -0.188  12.965  -3.726
   12    H    GLY   2           H        GLY   2  -3.519  17.566  -5.905
   13   1HA   GLY   2          2HA       GLY   2  -1.330  19.602  -6.035
   14   2HA   GLY   2          1HA       GLY   2  -3.015  20.025  -6.341
   15    H    LYS   3           H        LYS   3  -2.146  21.525  -4.423
   16    HA   LYS   3           HA       LYS   3  -1.854  20.551  -1.799
   17   1HB   LYS   3          2HB       LYS   3  -2.660  22.771  -1.062
   18   2HB   LYS   3          1HB       LYS   3  -1.519  22.918  -2.398
   19   1HG   LYS   3          2HG       LYS   3  -4.204  22.593  -3.421
   20   2HG   LYS   3          1HG       LYS   3  -4.145  23.943  -2.287
   21   1HD   LYS   3          2HD       LYS   3  -2.509  25.086  -3.538
   22   2HD   LYS   3          1HD       LYS   3  -2.038  23.633  -4.419
   23   1HE   LYS   3          2HE       LYS   3  -4.750  24.961  -4.666
   24   2HE   LYS   3          1HE       LYS   3  -3.415  25.224  -5.787
   25   1HZ   LYS   3          1HZ       LYS   3  -4.908  22.725  -5.267
   26   2HZ   LYS   3          2HZ       LYS   3  -3.385  22.716  -6.021
   27   3HZ   LYS   3          3HZ       LYS   3  -4.688  23.535  -6.742
   28    H    ALA   4           H        ALA   4  -3.309  19.899  -0.211
   29    HA   ALA   4           HA       ALA   4  -6.167  20.274  -0.434
   30   1HB   ALA   4          1HB       ALA   4  -5.056  17.518  -1.049
   31   2HB   ALA   4          2HB       ALA   4  -5.945  18.554  -2.165
   32   3HB   ALA   4          3HB       ALA   4  -6.757  17.877  -0.754
   33    H    GLU   5           H        GLU   5  -7.295  19.201   1.404
   34    HA   GLU   5           HA       GLU   5  -5.449  18.941   3.707
   35   1HB   GLU   5          2HB       GLU   5  -8.455  19.251   3.500
   36   2HB   GLU   5          1HB       GLU   5  -7.613  18.991   5.029
   37   1HG   GLU   5          2HG       GLU   5  -6.516  21.141   3.304
   38   2HG   GLU   5          1HG       GLU   5  -8.103  21.455   4.008
   39    H    ASN   6           H        ASN   6  -7.442  17.006   1.643
   40    HA   ASN   6           HA       ASN   6  -7.799  14.789   3.480
   41   1HB   ASN   6          2HB       ASN   6  -9.226  15.202   1.447
   42   2HB   ASN   6          1HB       ASN   6  -7.849  14.740   0.448
   43   1HD2  ASN   6          1HD2      ASN   6 -10.510  13.511   2.278
   44   2HD2  ASN   6          2HD2      ASN   6 -10.107  11.866   2.169
   45    H    TYR   7           H        TYR   7  -6.340  13.190   3.953
   46    HA   TYR   7           HA       TYR   7  -3.648  13.369   2.840
   47   1HB   TYR   7          2HB       TYR   7  -4.313  10.926   4.351
   48   2HB   TYR   7          1HB       TYR   7  -3.014  12.086   4.606
   49    HD1  TYR   7           1HD      TYR   7  -3.425  14.178   5.889
   50    HD2  TYR   7           2HD      TYR   7  -6.416  11.120   5.499
   51    HE1  TYR   7           1HE      TYR   7  -4.689  15.172   7.776
   52    HE2  TYR   7           2HE      TYR   7  -7.680  12.114   7.385
   53    HH   TYR   7           HH       TYR   7  -7.553  14.936   8.400
   54    H    GLU   8           H        GLU   8  -6.307  11.021   2.706
   55    HA   GLU   8           HA       GLU   8  -6.615   9.170   1.272
   56   1HB   GLU   8          2HB       GLU   8  -6.028  11.571  -0.285
   57   2HB   GLU   8          1HB       GLU   8  -5.598  10.095  -1.151
   58   1HG   GLU   8          2HG       GLU   8  -8.264  10.423   0.234
   59   2HG   GLU   8          1HG       GLU   8  -8.009  10.914  -1.441
   60    H    LEU   9           H        LEU   9  -4.105   9.156   2.727
   61    HA   LEU   9           HA       LEU   9  -2.224   8.030   0.710
   62   1HB   LEU   9          2HB       LEU   9  -1.674   9.815   2.642
   63   2HB   LEU   9          1HB       LEU   9  -1.434   8.333   3.568
   64    HG   LEU   9           HG       LEU   9   0.692   8.843   2.605
   65   1HD1  LEU   9          1HD1      LEU   9  -0.165   6.464   2.360
   66   2HD1  LEU   9          2HD1      LEU   9   1.112   6.916   1.233
   67   3HD1  LEU   9          3HD1      LEU   9  -0.565   6.863   0.690
   68   1HD2  LEU   9          1HD2      LEU   9  -0.920   9.989   0.540
   69   2HD2  LEU   9          2HD2      LEU   9   0.160   8.811  -0.206
   70   3HD2  LEU   9          3HD2      LEU   9   0.824  10.129   0.759
   71    H    TYR  10           H        TYR  10  -3.309   7.285   4.051
   72    HA   TYR  10           HA       TYR  10  -2.630   4.458   3.644
   73   1HB   TYR  10          2HB       TYR  10  -4.220   5.174   6.014
   74   2HB   TYR  10          1HB       TYR  10  -2.713   4.278   5.904
   75    HD1  TYR  10           1HD      TYR  10  -0.862   6.090   4.622
   76    HD2  TYR  10           2HD      TYR  10  -3.916   6.944   7.519
   77    HE1  TYR  10           1HE      TYR  10   0.393   8.100   5.354
   78    HE2  TYR  10           2HE      TYR  10  -2.661   8.953   8.251
   79    HH   TYR  10           HH       TYR  10  -0.832  10.548   6.949
   80    H    GLN  11           H        GLN  11  -5.218   6.362   2.791
   81    HA   GLN  11           HA       GLN  11  -7.293   4.321   3.336
   82   1HB   GLN  11          2HB       GLN  11  -7.245   7.161   2.589
   83   2HB   GLN  11          1HB       GLN  11  -8.421   6.226   1.665
   84   1HG   GLN  11          2HG       GLN  11  -9.698   5.745   3.513
   85   2HG   GLN  11          1HG       GLN  11  -8.307   5.710   4.595
   86   1HE2  GLN  11          1HE2      GLN  11  -8.837   8.429   2.394
   87   2HE2  GLN  11          2HE2      GLN  11  -9.240   9.556   3.597
   88    H    VAL  12           H        VAL  12  -5.176   3.439   1.761
   89    HA   VAL  12           HA       VAL  12  -6.312   3.341  -0.980
   90    HB   VAL  12           HB       VAL  12  -4.117   4.320  -0.937
   91   1HG1  VAL  12          1HG1      VAL  12  -3.459   3.462   1.272
   92   2HG1  VAL  12          2HG1      VAL  12  -2.206   3.144   0.072
   93   3HG1  VAL  12          3HG1      VAL  12  -3.279   1.844   0.594
   94   1HG2  VAL  12          1HG2      VAL  12  -3.503   1.486  -1.713
   95   2HG2  VAL  12          2HG2      VAL  12  -3.112   2.981  -2.562
   96   3HG2  VAL  12          3HG2      VAL  12  -4.761   2.358  -2.589
   97    H    GLU  13           H        GLU  13  -7.744   1.605   0.144
   98    HA   GLU  13           HA       GLU  13  -8.248  -0.665   0.488
   99   1HB   GLU  13          2HB       GLU  13  -6.050  -0.732  -1.578
  100   2HB   GLU  13          1HB       GLU  13  -6.775  -2.222  -0.975
  101   1HG   GLU  13          2HG       GLU  13  -8.999  -1.446  -1.653
  102   2HG   GLU  13          1HG       GLU  13  -8.316   0.086  -2.199
  103    H    LEU  14           H        LEU  14  -7.092   0.070   2.696
  104    HA   LEU  14           HA       LEU  14  -4.499  -1.022   3.273
  105   1HB   LEU  14          2HB       LEU  14  -6.801   0.009   4.876
  106   2HB   LEU  14          1HB       LEU  14  -5.586  -0.959   5.709
  107    HG   LEU  14           HG       LEU  14  -4.817   1.348   3.923
  108   1HD1  LEU  14          1HD1      LEU  14  -5.376   1.396   6.905
  109   2HD1  LEU  14          2HD1      LEU  14  -6.323   2.217   5.665
  110   3HD1  LEU  14          3HD1      LEU  14  -4.662   2.718   5.982
  111   1HD2  LEU  14          1HD2      LEU  14  -3.479  -0.245   6.122
  112   2HD2  LEU  14          2HD2      LEU  14  -2.817   1.269   5.506
  113   3HD2  LEU  14          3HD2      LEU  14  -2.990  -0.119   4.432
  114    H    GLY  15           H        GLY  15  -4.366  -2.785   5.126
  115   1HA   GLY  15          2HA       GLY  15  -5.264  -5.256   4.039
  116   2HA   GLY  15          1HA       GLY  15  -4.657  -5.048   5.682
  117    HA   PRO  16           HA       PRO  16  -9.394  -5.510   5.521
  118   1HB   PRO  16          2HB       PRO  16  -9.664  -8.247   5.499
  119   2HB   PRO  16          1HB       PRO  16  -9.675  -7.250   4.035
  120   1HG   PRO  16          2HG       PRO  16  -7.515  -9.021   5.083
  121   2HG   PRO  16          1HG       PRO  16  -7.858  -8.535   3.415
  122   1HD   PRO  16          2HD       PRO  16  -5.830  -7.457   5.064
  123   2HD   PRO  16          1HD       PRO  16  -6.416  -6.756   3.539
  124    H    GLY  17           H        GLY  17  -8.677  -4.740   7.731
  125   1HA   GLY  17          2HA       GLY  17  -7.973  -6.709   9.751
  126   2HA   GLY  17          1HA       GLY  17  -8.398  -5.023  10.056
  127    HA   PRO  18           HA       PRO  18 -11.973  -7.892  11.109
  128   1HB   PRO  18          2HB       PRO  18 -11.661  -7.916  13.841
  129   2HB   PRO  18          1HB       PRO  18 -10.954  -9.134  12.764
  130   1HG   PRO  18          2HG       PRO  18  -9.614  -6.878  14.184
  131   2HG   PRO  18          1HG       PRO  18  -8.940  -8.427  13.650
  132   1HD   PRO  18          2HD       PRO  18  -8.608  -5.937  12.346
  133   2HD   PRO  18          1HD       PRO  18  -8.233  -7.533  11.659
  134    H    SER  19           H        SER  19 -10.965  -5.537  13.617
  135    HA   SER  19           HA       SER  19 -13.274  -3.823  12.873
  136   1HB   SER  19          2HB       SER  19 -12.743  -4.659  15.734
  137   2HB   SER  19          1HB       SER  19 -14.108  -3.722  15.130
  138    HG   SER  19           HG       SER  19 -14.470  -6.039  15.487
  139    H    GLY  20           H        GLY  20 -12.846  -1.643  13.183
  140   1HA   GLY  20          2HA       GLY  20 -11.642   0.087  14.550
  141   2HA   GLY  20          1HA       GLY  20 -10.240  -0.983  14.499
  142    H    ASP  21           H        ASP  21  -8.907   0.557  13.437
  143    HA   ASP  21           HA       ASP  21  -7.971   1.609  11.561
  144   1HB   ASP  21          2HB       ASP  21  -8.978  -0.798  10.666
  145   2HB   ASP  21          1HB       ASP  21  -9.765   0.361   9.593
  146    H    MET  22           H        MET  22 -10.341   2.739  12.909
  147    HA   MET  22           HA       MET  22 -10.856   4.969  11.286
  148   1HB   MET  22          2HB       MET  22 -12.480   2.610  10.603
  149   2HB   MET  22          1HB       MET  22 -13.432   4.060  10.926
  150   1HG   MET  22          2HG       MET  22 -12.775   5.022   8.993
  151   2HG   MET  22          1HG       MET  22 -11.080   4.654   9.310
  152   1HE   MET  22          1HE       MET  22 -14.468   3.323   8.428
  153   2HE   MET  22          2HE       MET  22 -13.934   1.837   9.210
  154   3HE   MET  22          3HE       MET  22 -14.211   1.858   7.470
  155    H    ALA  23           H        ALA  23 -12.556   6.360  12.230
  156    HA   ALA  23           HA       ALA  23 -13.595   7.281  14.123
  157   1HB   ALA  23          1HB       ALA  23 -14.386   4.368  14.366
  158   2HB   ALA  23          2HB       ALA  23 -15.339   5.680  13.674
  159   3HB   ALA  23          3HB       ALA  23 -15.032   5.633  15.410
  160    H    ALA  24           H        ALA  24 -11.471   7.760  15.067
  161    HA   ALA  24           HA       ALA  24 -10.297   5.836  16.935
  162   1HB   ALA  24          1HB       ALA  24  -9.057   7.644  15.560
  163   2HB   ALA  24          2HB       ALA  24  -8.576   7.428  17.244
  164   3HB   ALA  24          3HB       ALA  24  -9.624   8.773  16.791
  165    H    LYS  25           H        LYS  25  -9.593   7.657  19.028
  166    HA   LYS  25           HA       LYS  25 -12.128   7.609  20.531
  167   1HB   LYS  25          2HB       LYS  25  -9.284   7.553  21.164
  168   2HB   LYS  25          1HB       LYS  25 -10.146   8.731  22.157
  169   1HG   LYS  25          2HG       LYS  25 -11.601   6.201  21.844
  170   2HG   LYS  25          1HG       LYS  25 -10.043   6.012  22.647
  171   1HD   LYS  25          2HD       LYS  25 -10.689   7.213  24.482
  172   2HD   LYS  25          1HD       LYS  25 -11.678   8.324  23.532
  173   1HE   LYS  25          2HE       LYS  25 -12.791   5.662  23.399
  174   2HE   LYS  25          1HE       LYS  25 -12.579   6.141  25.084
  175   1HZ   LYS  25          1HZ       LYS  25 -13.564   8.349  23.707
  176   2HZ   LYS  25          2HZ       LYS  25 -14.357   7.416  24.886
  177   3HZ   LYS  25          3HZ       LYS  25 -14.512   7.021  23.241
  178    H    MET  26           H        MET  26 -12.624   9.420  18.712
  179    HA   MET  26           HA       MET  26 -13.030  11.860  20.125
  180   1HB   MET  26          2HB       MET  26 -11.487  13.306  18.716
  181   2HB   MET  26          1HB       MET  26 -10.673  12.293  19.910
  182   1HG   MET  26          2HG       MET  26  -9.463  11.365  18.259
  183   2HG   MET  26          1HG       MET  26 -10.950  10.729  17.557
  184   1HE   MET  26          1HE       MET  26  -9.825  10.974  14.972
  185   2HE   MET  26          2HE       MET  26 -10.965  12.131  14.290
  186   3HE   MET  26          3HE       MET  26 -11.514  10.974  15.500
  187    H    SER  27           H        SER  27 -13.277  13.703  18.130
  188    HA   SER  27           HA       SER  27 -14.588  14.291  16.275
  189   1HB   SER  27          2HB       SER  27 -13.677  13.111  14.570
  190   2HB   SER  27          1HB       SER  27 -13.393  11.711  15.599
  191    HG   SER  27           HG       SER  27 -15.000  10.863  14.550
  192    H    LYS  28           H        LYS  28 -16.765  14.583  16.316
  193    HA   LYS  28           HA       LYS  28 -19.044  14.154  16.673
  194   1HB   LYS  28          2HB       LYS  28 -18.141  11.901  15.446
  195   2HB   LYS  28          1HB       LYS  28 -18.681  11.229  16.986
  196   1HG   LYS  28          2HG       LYS  28 -20.897  12.028  16.681
  197   2HG   LYS  28          1HG       LYS  28 -20.412  13.107  15.374
  198   1HD   LYS  28          2HD       LYS  28 -20.703  11.482  13.843
  199   2HD   LYS  28          1HD       LYS  28 -19.664  10.383  14.751
  200   1HE   LYS  28          2HE       LYS  28 -21.547   9.183  15.127
  201   2HE   LYS  28          1HE       LYS  28 -21.959  10.446  16.286
  202   1HZ   LYS  28          1HZ       LYS  28 -23.729  10.827  15.023
  203   2HZ   LYS  28          2HZ       LYS  28 -23.150   9.843  13.764
  204   3HZ   LYS  28          3HZ       LYS  28 -22.679  11.473  13.858
  205    H    LYS  29           H        LYS  29 -17.925  15.035  18.865
  206    HA   LYS  29           HA       LYS  29 -17.834  13.211  21.095
  207   1HB   LYS  29          2HB       LYS  29 -17.522  16.066  20.648
  208   2HB   LYS  29          1HB       LYS  29 -18.457  15.754  22.109
  209   1HG   LYS  29          2HG       LYS  29 -16.304  13.885  22.048
  210   2HG   LYS  29          1HG       LYS  29 -15.633  15.485  21.729
  211   1HD   LYS  29          2HD       LYS  29 -17.631  15.148  23.944
  212   2HD   LYS  29          1HD       LYS  29 -15.953  14.677  24.215
  213   1HE   LYS  29          2HE       LYS  29 -15.215  16.932  23.503
  214   2HE   LYS  29          1HE       LYS  29 -16.900  17.402  23.277
  215   1HZ   LYS  29          1HZ       LYS  29 -17.051  16.506  25.736
  216   2HZ   LYS  29          2HZ       LYS  29 -16.595  18.108  25.395
  217   3HZ   LYS  29          3HZ       LYS  29 -15.411  16.941  25.749
  218    H    LYS  30           H        LYS  30 -19.415  13.012  22.811
  219    HA   LYS  30           HA       LYS  30 -22.195  13.658  21.908
  220   1HB   LYS  30          2HB       LYS  30 -21.653  11.459  23.868
  221   2HB   LYS  30          1HB       LYS  30 -22.942  11.600  22.673
  222   1HG   LYS  30          2HG       LYS  30 -20.760  11.534  21.045
  223   2HG   LYS  30          1HG       LYS  30 -20.203  10.518  22.376
  224   1HD   LYS  30          2HD       LYS  30 -22.974  10.025  21.423
  225   2HD   LYS  30          1HD       LYS  30 -21.676   9.558  20.323
  226   1HE   LYS  30          2HE       LYS  30 -22.353   7.728  21.904
  227   2HE   LYS  30          1HE       LYS  30 -20.651   8.173  22.032
  228   1HZ   LYS  30          1HZ       LYS  30 -22.242   8.000  24.129
  229   2HZ   LYS  30          2HZ       LYS  30 -22.518   9.627  23.728
  230   3HZ   LYS  30          3HZ       LYS  30 -20.942   9.086  24.059
  231    H    ALA  31           H        ALA  31 -23.704  14.235  23.610
  232    HA   ALA  31           HA       ALA  31 -22.485  15.867  25.687
  233   1HB   ALA  31          1HB       ALA  31 -25.249  15.519  26.226
  234   2HB   ALA  31          2HB       ALA  31 -25.081  15.577  24.471
  235   3HB   ALA  31          3HB       ALA  31 -24.471  16.905  25.458
  236    H    GLY  32           H        GLY  32 -21.607  14.871  27.446
  237   1HA   GLY  32          2HA       GLY  32 -23.063  12.518  28.582
  238   2HA   GLY  32          1HA       GLY  32 -21.327  12.785  28.760
  239    H    ARG  33           H        ARG  33 -21.501  12.733  31.076
  240    HA   ARG  33           HA       ARG  33 -22.493  15.302  32.201
  241   1HB   ARG  33          2HB       ARG  33 -23.442  12.562  32.862
  242   2HB   ARG  33          1HB       ARG  33 -23.140  13.634  34.231
  243   1HG   ARG  33          2HG       ARG  33 -24.566  14.948  32.029
  244   2HG   ARG  33          1HG       ARG  33 -25.457  13.595  32.727
  245   1HD   ARG  33          2HD       ARG  33 -25.710  14.629  34.757
  246   2HD   ARG  33          1HD       ARG  33 -24.149  15.443  34.653
  247    HE   ARG  33           HE       ARG  33 -26.637  16.381  33.289
  248   1HH1  ARG  33          1HH1      ARG  33 -24.293  17.414  31.891
  249   2HH1  ARG  33          2HH1      ARG  33 -23.903  18.858  32.763
  250   1HH2  ARG  33          1HH2      ARG  33 -25.774  17.998  35.552
  251   2HH2  ARG  33          2HH2      ARG  33 -24.740  19.188  34.836
  252    H    GLY  34           H        GLY  34 -21.165  12.283  33.585
  253   1HA   GLY  34          2HA       GLY  34 -19.334  13.741  35.282
  254   2HA   GLY  34          1HA       GLY  34 -19.334  11.994  35.033
  Start of MODEL   14
    1   1H    MET   1          1HT       MET   1   3.166  22.034   3.355
    2   2H    MET   1          2HT       MET   1   1.863  22.640   4.260
    3   3H    MET   1          3HT       MET   1   2.619  23.617   3.094
    4    HA   MET   1           HA       MET   1   0.797  21.333   2.704
    5   1HB   MET   1          2HB       MET   1   0.836  24.224   2.222
    6   2HB   MET   1          1HB       MET   1   0.354  23.299   0.800
    7   1HG   MET   1          2HG       MET   1  -0.918  22.184   3.128
    8   2HG   MET   1          1HG       MET   1  -1.228  23.919   3.070
    9   1HE   MET   1          1HE       MET   1  -3.677  21.394   2.378
   10   2HE   MET   1          2HE       MET   1  -4.477  22.837   1.760
   11   3HE   MET   1          3HE       MET   1  -3.444  22.954   3.183
   12    H    GLY   2           H        GLY   2   3.739  22.764   1.552
   13   1HA   GLY   2          2HA       GLY   2   3.567  21.094  -0.923
   14   2HA   GLY   2          1HA       GLY   2   4.551  22.550  -0.786
   15    H    LYS   3           H        LYS   3   4.206  19.769   1.427
   16    HA   LYS   3           HA       LYS   3   7.152  19.335   1.123
   17   1HB   LYS   3          2HB       LYS   3   5.662  18.638   3.643
   18   2HB   LYS   3          1HB       LYS   3   7.376  18.999   3.430
   19   1HG   LYS   3          2HG       LYS   3   6.321  21.346   2.603
   20   2HG   LYS   3          1HG       LYS   3   5.078  20.855   3.753
   21   1HD   LYS   3          2HD       LYS   3   7.248  20.297   5.236
   22   2HD   LYS   3          1HD       LYS   3   7.926  21.584   4.236
   23   1HE   LYS   3          2HE       LYS   3   5.258  22.270   5.166
   24   2HE   LYS   3          1HE       LYS   3   6.334  21.916   6.517
   25   1HZ   LYS   3          1HZ       LYS   3   7.967  23.439   5.483
   26   2HZ   LYS   3          2HZ       LYS   3   6.534  24.212   5.972
   27   3HZ   LYS   3          3HZ       LYS   3   6.800  23.866   4.330
   28    H    ALA   4           H        ALA   4   5.347  18.004  -0.534
   29    HA   ALA   4           HA       ALA   4   4.546  15.864  -1.117
   30   1HB   ALA   4          1HB       ALA   4   6.408  14.179   0.114
   31   2HB   ALA   4          2HB       ALA   4   7.281  15.694  -0.127
   32   3HB   ALA   4          3HB       ALA   4   6.539  14.875  -1.501
   33    H    GLU   5           H        GLU   5   2.625  15.882   0.198
   34    HA   GLU   5           HA       GLU   5   2.652  13.826   2.288
   35   1HB   GLU   5          2HB       GLU   5   3.190  16.252   3.257
   36   2HB   GLU   5          1HB       GLU   5   1.437  16.419   3.150
   37   1HG   GLU   5          2HG       GLU   5   1.534  13.993   4.285
   38   2HG   GLU   5          1HG       GLU   5   3.066  14.625   4.886
   39    H    ASN   6           H        ASN   6   0.575  12.934   2.580
   40    HA   ASN   6           HA       ASN   6  -1.707  14.272   1.238
   41   1HB   ASN   6          2HB       ASN   6  -0.675  12.749  -0.445
   42   2HB   ASN   6          1HB       ASN   6  -0.904  11.403   0.670
   43   1HD2  ASN   6          1HD2      ASN   6  -3.065  14.147  -0.257
   44   2HD2  ASN   6          2HD2      ASN   6  -4.370  13.155  -0.701
   45    H    TYR   7           H        TYR   7  -3.779  13.435   1.987
   46    HA   TYR   7           HA       TYR   7  -3.537  12.168   4.661
   47   1HB   TYR   7          2HB       TYR   7  -6.227  12.965   4.093
   48   2HB   TYR   7          1HB       TYR   7  -5.122  13.624   5.291
   49    HD1  TYR   7           1HD      TYR   7  -3.556  15.478   4.666
   50    HD2  TYR   7           2HD      TYR   7  -6.674  14.113   2.047
   51    HE1  TYR   7           1HE      TYR   7  -3.351  17.560   3.338
   52    HE2  TYR   7           2HE      TYR   7  -6.471  16.194   0.720
   53    HH   TYR   7           HH       TYR   7  -5.630  18.631   1.238
   54    H    GLU   8           H        GLU   8  -4.960  11.712   1.482
   55    HA   GLU   8           HA       GLU   8  -6.517   9.380   2.361
   56   1HB   GLU   8          2HB       GLU   8  -6.381  11.079   0.001
   57   2HB   GLU   8          1HB       GLU   8  -6.410   9.369  -0.434
   58   1HG   GLU   8          2HG       GLU   8  -8.284   9.668   1.660
   59   2HG   GLU   8          1HG       GLU   8  -8.565  11.016   0.557
   60    H    LEU   9           H        LEU   9  -3.330   9.731   2.092
   61    HA   LEU   9           HA       LEU   9  -2.553   7.628   0.287
   62   1HB   LEU   9          2HB       LEU   9  -1.147   9.522   1.527
   63   2HB   LEU   9          1HB       LEU   9  -0.913   8.238   2.713
   64    HG   LEU   9           HG       LEU   9  -0.535   7.537  -0.164
   65   1HD1  LEU   9          1HD1      LEU   9   0.650   9.698   0.066
   66   2HD1  LEU   9          2HD1      LEU   9   1.784   8.360  -0.119
   67   3HD1  LEU   9          3HD1      LEU   9   1.511   9.071   1.473
   68   1HD2  LEU   9          1HD2      LEU   9   0.074   6.487   2.462
   69   2HD2  LEU   9          2HD2      LEU   9   1.553   6.634   1.514
   70   3HD2  LEU   9          3HD2      LEU   9   0.199   5.687   0.896
   71    H    TYR  10           H        TYR  10  -3.565   7.687   3.658
   72    HA   TYR  10           HA       TYR  10  -2.842   4.873   4.070
   73   1HB   TYR  10          2HB       TYR  10  -4.706   6.179   5.956
   74   2HB   TYR  10          1HB       TYR  10  -3.243   5.259   6.279
   75    HD1  TYR  10           1HD      TYR  10  -1.058   6.507   5.126
   76    HD2  TYR  10           2HD      TYR  10  -4.597   8.400   6.656
   77    HE1  TYR  10           1HE      TYR  10   0.208   8.615   5.447
   78    HE2  TYR  10           2HE      TYR  10  -3.330  10.510   6.977
   79    HH   TYR  10           HH       TYR  10   0.046  10.802   5.913
   80    H    GLN  11           H        GLN  11  -5.139   6.221   2.243
   81    HA   GLN  11           HA       GLN  11  -7.393   4.515   3.132
   82   1HB   GLN  11          2HB       GLN  11  -7.695   6.913   2.282
   83   2HB   GLN  11          1HB       GLN  11  -7.282   6.294   0.683
   84   1HG   GLN  11          2HG       GLN  11  -9.677   6.251   0.834
   85   2HG   GLN  11          1HG       GLN  11  -9.131   4.580   0.990
   86   1HE2  GLN  11          1HE2      GLN  11 -11.644   5.268   2.052
   87   2HE2  GLN  11          2HE2      GLN  11 -11.570   5.245   3.747
   88    H    VAL  12           H        VAL  12  -5.009   3.236   2.308
   89    HA   VAL  12           HA       VAL  12  -5.640   2.166  -0.377
   90    HB   VAL  12           HB       VAL  12  -3.395   2.950  -0.204
   91   1HG1  VAL  12          1HG1      VAL  12  -3.249   3.052   2.228
   92   2HG1  VAL  12          2HG1      VAL  12  -1.880   2.142   1.589
   93   3HG1  VAL  12          3HG1      VAL  12  -3.238   1.292   2.326
   94   1HG2  VAL  12          1HG2      VAL  12  -3.950   0.497  -1.061
   95   2HG2  VAL  12          2HG2      VAL  12  -2.964   0.034   0.325
   96   3HG2  VAL  12          3HG2      VAL  12  -2.280   1.050  -0.943
   97    H    GLU  13           H        GLU  13  -7.408   0.818   0.475
   98    HA   GLU  13           HA       GLU  13  -8.280  -1.172   1.369
   99   1HB   GLU  13          2HB       GLU  13  -5.593  -1.810   0.279
  100   2HB   GLU  13          1HB       GLU  13  -6.293  -3.013   1.363
  101   1HG   GLU  13          2HG       GLU  13  -7.921  -1.828  -0.879
  102   2HG   GLU  13          1HG       GLU  13  -6.840  -3.191  -1.171
  103    H    LEU  14           H        LEU  14  -6.976   0.776   3.236
  104    HA   LEU  14           HA       LEU  14  -5.391  -0.394   5.203
  105   1HB   LEU  14          2HB       LEU  14  -6.059   1.340   6.617
  106   2HB   LEU  14          1HB       LEU  14  -6.425   2.009   5.029
  107    HG   LEU  14           HG       LEU  14  -8.373   0.712   6.954
  108   1HD1  LEU  14          1HD1      LEU  14  -7.510   3.405   6.489
  109   2HD1  LEU  14          2HD1      LEU  14  -8.733   2.828   7.621
  110   3HD1  LEU  14          3HD1      LEU  14  -9.189   3.259   5.972
  111   1HD2  LEU  14          1HD2      LEU  14  -8.761   0.089   4.546
  112   2HD2  LEU  14          2HD2      LEU  14  -8.913   1.806   4.178
  113   3HD2  LEU  14          3HD2      LEU  14 -10.074   1.029   5.255
  114    H    GLY  15           H        GLY  15  -6.363  -0.936   7.538
  115   1HA   GLY  15          2HA       GLY  15  -8.776  -2.023   8.146
  116   2HA   GLY  15          1HA       GLY  15  -8.092  -3.280   7.116
  117    HA   PRO  16           HA       PRO  16  -6.357  -3.412  11.540
  118   1HB   PRO  16          2HB       PRO  16  -8.264  -4.930  12.809
  119   2HB   PRO  16          1HB       PRO  16  -8.261  -3.159  12.815
  120   1HG   PRO  16          2HG       PRO  16 -10.018  -5.026  11.293
  121   2HG   PRO  16          1HG       PRO  16 -10.338  -3.369  11.826
  122   1HD   PRO  16          2HD       PRO  16  -9.620  -4.159   9.203
  123   2HD   PRO  16          1HD       PRO  16  -9.627  -2.496   9.830
  124    H    GLY  17           H        GLY  17  -5.023  -4.804  10.021
  125   1HA   GLY  17          2HA       GLY  17  -5.156  -7.600  10.871
  126   2HA   GLY  17          1HA       GLY  17  -5.464  -7.367   9.150
  127    HA   PRO  18           HA       PRO  18  -1.113  -7.269   8.546
  128   1HB   PRO  18          2HB       PRO  18  -1.089  -6.030   6.090
  129   2HB   PRO  18          1HB       PRO  18  -1.557  -7.722   6.327
  130   1HG   PRO  18          2HG       PRO  18  -3.286  -5.357   5.769
  131   2HG   PRO  18          1HG       PRO  18  -3.572  -7.067   5.407
  132   1HD   PRO  18          2HD       PRO  18  -4.709  -5.610   7.554
  133   2HD   PRO  18          1HD       PRO  18  -4.728  -7.377   7.363
  134    H    SER  19           H        SER  19  -2.950  -4.551   9.196
  135    HA   SER  19           HA       SER  19  -0.500  -2.845   9.313
  136   1HB   SER  19          2HB       SER  19  -2.644  -1.083   8.973
  137   2HB   SER  19          1HB       SER  19  -1.429  -1.492   7.766
  138    HG   SER  19           HG       SER  19  -4.041  -2.104   7.826
  139    H    GLY  20           H        GLY  20  -1.115  -0.817  10.777
  140   1HA   GLY  20          2HA       GLY  20  -2.928  -1.638  12.982
  141   2HA   GLY  20          1HA       GLY  20  -1.245  -1.291  13.378
  142    H    ASP  21           H        ASP  21  -2.190   0.462  14.737
  143    HA   ASP  21           HA       ASP  21  -2.400   2.951  13.146
  144   1HB   ASP  21          2HB       ASP  21  -4.616   1.706  14.629
  145   2HB   ASP  21          1HB       ASP  21  -4.331   3.392  15.060
  146    H    MET  22           H        MET  22  -2.404   1.528  16.423
  147    HA   MET  22           HA       MET  22  -1.607   3.808  17.870
  148   1HB   MET  22          2HB       MET  22  -1.008   0.870  18.251
  149   2HB   MET  22          1HB       MET  22  -0.440   2.090  19.393
  150   1HG   MET  22          2HG       MET  22  -3.251   2.469  18.728
  151   2HG   MET  22          1HG       MET  22  -2.952   0.867  19.402
  152   1HE   MET  22          1HE       MET  22  -2.308   0.355  21.813
  153   2HE   MET  22          2HE       MET  22  -3.973   0.839  21.506
  154   3HE   MET  22          3HE       MET  22  -3.144   1.428  22.944
  155    H    ALA  23           H        ALA  23  -0.037   5.093  16.886
  156    HA   ALA  23           HA       ALA  23   2.717   4.264  17.164
  157   1HB   ALA  23          1HB       ALA  23   2.771   4.860  14.437
  158   2HB   ALA  23          2HB       ALA  23   1.388   3.781  14.615
  159   3HB   ALA  23          3HB       ALA  23   2.984   3.264  15.157
  160    H    ALA  24           H        ALA  24   2.756   6.274  18.317
  161    HA   ALA  24           HA       ALA  24   3.100   8.586  18.519
  162   1HB   ALA  24          1HB       ALA  24   4.748   7.970  16.650
  163   2HB   ALA  24          2HB       ALA  24   4.250   9.659  16.732
  164   3HB   ALA  24          3HB       ALA  24   3.534   8.587  15.528
  165    H    LYS  25           H        LYS  25   1.160   9.546  18.999
  166    HA   LYS  25           HA       LYS  25  -0.342  10.769  16.798
  167   1HB   LYS  25          2HB       LYS  25  -1.178   8.264  17.640
  168   2HB   LYS  25          1HB       LYS  25  -2.192   9.358  18.581
  169   1HG   LYS  25          2HG       LYS  25  -2.298  10.560  16.139
  170   2HG   LYS  25          1HG       LYS  25  -2.153   8.867  15.664
  171   1HD   LYS  25          2HD       LYS  25  -4.100   8.254  16.918
  172   2HD   LYS  25          1HD       LYS  25  -4.153   9.825  17.722
  173   1HE   LYS  25          2HE       LYS  25  -4.399  10.815  15.344
  174   2HE   LYS  25          1HE       LYS  25  -4.795   9.170  14.848
  175   1HZ   LYS  25          1HZ       LYS  25  -6.462   9.221  16.742
  176   2HZ   LYS  25          2HZ       LYS  25  -6.831  10.149  15.366
  177   3HZ   LYS  25          3HZ       LYS  25  -6.230  10.903  16.766
  178    H    MET  26           H        MET  26   0.613  12.575  18.090
  179    HA   MET  26           HA       MET  26  -1.318  13.799  19.789
  180   1HB   MET  26          2HB       MET  26  -0.095  11.847  21.200
  181   2HB   MET  26          1HB       MET  26   1.049  13.161  21.475
  182   1HG   MET  26          2HG       MET  26  -0.431  14.361  22.733
  183   2HG   MET  26          1HG       MET  26  -1.813  13.884  21.745
  184   1HE   MET  26          1HE       MET  26  -3.756  12.126  23.504
  185   2HE   MET  26          2HE       MET  26  -3.219  13.784  23.255
  186   3HE   MET  26          3HE       MET  26  -3.145  13.073  24.865
  187    H    SER  27           H        SER  27  -0.547  15.323  18.073
  188    HA   SER  27           HA       SER  27   1.776  16.883  19.093
  189   1HB   SER  27          2HB       SER  27   1.426  15.695  16.371
  190   2HB   SER  27          1HB       SER  27   2.168  17.289  16.487
  191    HG   SER  27           HG       SER  27   3.199  14.864  17.063
  192    H    LYS  28           H        LYS  28  -0.560  17.804  19.806
  193    HA   LYS  28           HA       LYS  28  -2.104  19.562  19.597
  194   1HB   LYS  28          2HB       LYS  28   0.456  20.463  18.721
  195   2HB   LYS  28          1HB       LYS  28  -0.753  21.170  17.648
  196   1HG   LYS  28          2HG       LYS  28  -2.051  21.736  19.818
  197   2HG   LYS  28          1HG       LYS  28  -0.523  21.427  20.644
  198   1HD   LYS  28          2HD       LYS  28   0.597  23.143  19.376
  199   2HD   LYS  28          1HD       LYS  28  -0.799  23.347  18.317
  200   1HE   LYS  28          2HE       LYS  28  -2.136  24.023  20.346
  201   2HE   LYS  28          1HE       LYS  28  -0.632  24.014  21.267
  202   1HZ   LYS  28          1HZ       LYS  28   0.168  25.824  20.163
  203   2HZ   LYS  28          2HZ       LYS  28  -1.492  26.181  20.116
  204   3HZ   LYS  28          3HZ       LYS  28  -0.725  25.518  18.753
  205    H    LYS  29           H        LYS  29  -3.350  20.898  17.846
  206    HA   LYS  29           HA       LYS  29  -3.963  19.015  15.618
  207   1HB   LYS  29          2HB       LYS  29  -5.597  20.463  17.421
  208   2HB   LYS  29          1HB       LYS  29  -5.829  21.203  15.838
  209   1HG   LYS  29          2HG       LYS  29  -5.907  18.615  15.105
  210   2HG   LYS  29          1HG       LYS  29  -6.501  18.455  16.758
  211   1HD   LYS  29          2HD       LYS  29  -7.717  20.719  15.375
  212   2HD   LYS  29          1HD       LYS  29  -8.020  19.192  14.543
  213   1HE   LYS  29          2HE       LYS  29  -8.360  18.599  17.260
  214   2HE   LYS  29          1HE       LYS  29  -9.136  20.168  17.042
  215   1HZ   LYS  29          1HZ       LYS  29  -9.928  18.798  14.855
  216   2HZ   LYS  29          2HZ       LYS  29 -10.844  18.982  16.274
  217   3HZ   LYS  29          3HZ       LYS  29  -9.908  17.583  16.038
  218    H    LYS  30           H        LYS  30  -2.483  22.023  16.273
  219    HA   LYS  30           HA       LYS  30  -1.656  23.703  14.859
  220   1HB   LYS  30          2HB       LYS  30  -1.096  21.294  13.668
  221   2HB   LYS  30          1HB       LYS  30  -1.993  22.121  12.393
  222   1HG   LYS  30          2HG       LYS  30  -0.352  23.665  12.062
  223   2HG   LYS  30          1HG       LYS  30   0.010  23.792  13.784
  224   1HD   LYS  30          2HD       LYS  30   0.784  21.393  12.105
  225   2HD   LYS  30          1HD       LYS  30   1.857  22.766  12.379
  226   1HE   LYS  30          2HE       LYS  30   0.966  22.163  14.930
  227   2HE   LYS  30          1HE       LYS  30   1.147  20.573  14.187
  228   1HZ   LYS  30          1HZ       LYS  30   3.352  21.992  13.387
  229   2HZ   LYS  30          2HZ       LYS  30   3.306  20.779  14.576
  230   3HZ   LYS  30          3HZ       LYS  30   3.154  22.412  15.019
  231    H    ALA  31           H        ALA  31  -3.114  25.350  14.652
  232    HA   ALA  31           HA       ALA  31  -4.857  26.634  13.748
  233   1HB   ALA  31          1HB       ALA  31  -3.937  26.403  11.586
  234   2HB   ALA  31          2HB       ALA  31  -5.602  25.857  11.387
  235   3HB   ALA  31          3HB       ALA  31  -4.297  24.678  11.522
  236    H    GLY  32           H        GLY  32  -7.063  26.631  14.085
  237   1HA   GLY  32          2HA       GLY  32  -8.351  23.947  14.395
  238   2HA   GLY  32          1HA       GLY  32  -8.750  25.333  15.411
  239    H    ARG  33           H        ARG  33  -8.245  25.391  11.903
  240    HA   ARG  33           HA       ARG  33 -11.165  25.813  11.517
  241   1HB   ARG  33          2HB       ARG  33  -8.958  27.759  10.954
  242   2HB   ARG  33          1HB       ARG  33 -10.322  27.690   9.836
  243   1HG   ARG  33          2HG       ARG  33 -11.777  28.578  11.347
  244   2HG   ARG  33          1HG       ARG  33 -11.052  27.712  12.702
  245   1HD   ARG  33          2HD       ARG  33 -10.074  29.649  13.306
  246   2HD   ARG  33          1HD       ARG  33  -9.072  29.509  11.860
  247    HE   ARG  33           HE       ARG  33 -11.086  31.473  12.235
  248   1HH1  ARG  33          1HH2      ARG  33  -8.949  30.828   9.962
  249   2HH1  ARG  33          2HH2      ARG  33  -9.987  30.961   8.582
  250   1HH2  ARG  33          1HH1      ARG  33 -12.911  30.918  10.444
  251   2HH2  ARG  33          2HH1      ARG  33 -12.229  31.011   8.855
  252    H    GLY  34           H        GLY  34  -9.175  23.661  10.861
  253   1HA   GLY  34          2HA       GLY  34  -9.024  23.817   7.910
  254   2HA   GLY  34          1HA       GLY  34  -8.308  22.556   8.914
  Start of MODEL   15
    1   1H    MET   1          1HT       MET   1   1.390  24.743  10.044
    2   2H    MET   1          2HT       MET   1   0.296  24.809   8.745
    3   3H    MET   1          3HT       MET   1  -0.169  24.100  10.218
    4    HA   MET   1           HA       MET   1   0.064  26.261  11.325
    5   1HB   MET   1          2HB       MET   1   1.694  27.017   9.434
    6   2HB   MET   1          1HB       MET   1   0.223  27.458   8.566
    7   1HG   MET   1          2HG       MET   1  -0.221  28.488  11.098
    8   2HG   MET   1          1HG       MET   1   1.502  28.775  10.851
    9   1HE   MET   1          1HE       MET   1   1.911  31.584   9.591
   10   2HE   MET   1          2HE       MET   1   1.415  30.843  11.110
   11   3HE   MET   1          3HE       MET   1   0.403  32.081  10.370
   12    H    GLY   2           H        GLY   2  -1.620  24.612   8.932
   13   1HA   GLY   2          2HA       GLY   2  -4.170  24.908   9.698
   14   2HA   GLY   2          1HA       GLY   2  -3.925  26.468   8.911
   15    H    LYS   3           H        LYS   3  -4.636  23.160   8.403
   16    HA   LYS   3           HA       LYS   3  -4.806  23.672   5.486
   17   1HB   LYS   3          2HB       LYS   3  -3.814  21.341   5.108
   18   2HB   LYS   3          1HB       LYS   3  -2.674  22.599   5.589
   19   1HG   LYS   3          2HG       LYS   3  -3.318  21.755   8.032
   20   2HG   LYS   3          1HG       LYS   3  -3.705  20.271   7.160
   21   1HD   LYS   3          2HD       LYS   3  -1.461  20.184   6.218
   22   2HD   LYS   3          1HD       LYS   3  -1.061  21.739   6.950
   23   1HE   LYS   3          2HE       LYS   3  -1.111  20.845   9.146
   24   2HE   LYS   3          1HE       LYS   3  -1.966  19.393   8.623
   25   1HZ   LYS   3          1HZ       LYS   3   0.624  19.413   9.024
   26   2HZ   LYS   3          2HZ       LYS   3   0.634  19.944   7.409
   27   3HZ   LYS   3          3HZ       LYS   3  -0.084  18.458   7.814
   28    H    ALA   4           H        ALA   4  -6.546  22.591   4.543
   29    HA   ALA   4           HA       ALA   4  -8.017  20.643   6.261
   30   1HB   ALA   4          1HB       ALA   4  -8.883  23.282   5.429
   31   2HB   ALA   4          2HB       ALA   4  -9.678  22.145   6.518
   32   3HB   ALA   4          3HB       ALA   4  -9.957  22.044   4.779
   33    H    GLU   5           H        GLU   5  -6.765  19.218   4.676
   34    HA   GLU   5           HA       GLU   5  -8.516  18.685   2.346
   35   1HB   GLU   5          2HB       GLU   5  -6.062  20.023   2.056
   36   2HB   GLU   5          1HB       GLU   5  -5.735  18.354   1.583
   37   1HG   GLU   5          2HG       GLU   5  -8.277  19.449   0.553
   38   2HG   GLU   5          1HG       GLU   5  -6.829  20.231  -0.080
   39    H    ASN   6           H        ASN   6  -8.655  16.483   1.898
   40    HA   ASN   6           HA       ASN   6  -7.680  14.646   3.896
   41   1HB   ASN   6          2HB       ASN   6  -8.735  12.937   2.516
   42   2HB   ASN   6          1HB       ASN   6  -9.800  14.336   2.614
   43   1HD2  ASN   6          1HD2      ASN   6  -9.222  12.162   0.415
   44   2HD2  ASN   6          2HD2      ASN   6  -9.048  13.093  -0.995
   45    H    TYR   7           H        TYR   7  -6.036  13.073   3.684
   46    HA   TYR   7           HA       TYR   7  -3.977  13.731   1.661
   47   1HB   TYR   7          2HB       TYR   7  -3.251  11.565   3.451
   48   2HB   TYR   7          1HB       TYR   7  -2.488  13.137   3.243
   49    HD1  TYR   7           1HD      TYR   7  -3.341  15.123   4.518
   50    HD2  TYR   7           2HD      TYR   7  -4.732  11.132   5.279
   51    HE1  TYR   7           1HE      TYR   7  -4.252  15.857   6.704
   52    HE2  TYR   7           2HE      TYR   7  -5.644  11.865   7.465
   53    HH   TYR   7           HH       TYR   7  -6.378  13.915   8.554
   54    H    GLU   8           H        GLU   8  -6.161  11.146   2.602
   55    HA   GLU   8           HA       GLU   8  -6.661   9.100   1.564
   56   1HB   GLU   8          2HB       GLU   8  -6.434  11.122  -0.449
   57   2HB   GLU   8          1HB       GLU   8  -5.751   9.628  -1.093
   58   1HG   GLU   8          2HG       GLU   8  -7.881   8.501  -0.104
   59   2HG   GLU   8          1HG       GLU   8  -8.539  10.137  -0.074
   60    H    LEU   9           H        LEU   9  -3.962   9.456   2.692
   61    HA   LEU   9           HA       LEU   9  -2.135   8.117   0.831
   62   1HB   LEU   9          2HB       LEU   9  -1.652   9.780   2.874
   63   2HB   LEU   9          1HB       LEU   9  -1.543   8.254   3.752
   64    HG   LEU   9           HG       LEU   9   0.669   8.758   2.947
   65   1HD1  LEU   9          1HD1      LEU   9  -0.429   6.400   2.565
   66   2HD1  LEU   9          2HD1      LEU   9   1.141   6.753   1.842
   67   3HD1  LEU   9          3HD1      LEU   9  -0.323   6.836   0.860
   68   1HD2  LEU   9          1HD2      LEU   9  -0.580  10.172   0.980
   69   2HD2  LEU   9          2HD2      LEU   9  -0.075   8.744   0.078
   70   3HD2  LEU   9          3HD2      LEU   9   1.124   9.722   0.924
   71    H    TYR  10           H        TYR  10  -3.065   7.182   4.164
   72    HA   TYR  10           HA       TYR  10  -2.657   4.370   3.500
   73   1HB   TYR  10          2HB       TYR  10  -4.089   5.079   5.992
   74   2HB   TYR  10          1HB       TYR  10  -2.731   3.990   5.748
   75    HD1  TYR  10           1HD      TYR  10  -0.797   5.752   4.359
   76    HD2  TYR  10           2HD      TYR  10  -3.368   6.539   7.709
   77    HE1  TYR  10           1HE      TYR  10   0.766   7.509   5.146
   78    HE2  TYR  10           2HE      TYR  10  -1.804   8.297   8.495
   79    HH   TYR  10           HH       TYR  10   0.887   9.370   6.540
   80    H    GLN  11           H        GLN  11  -5.076   6.384   2.676
   81    HA   GLN  11           HA       GLN  11  -7.332   4.594   3.341
   82   1HB   GLN  11          2HB       GLN  11  -7.183   7.305   2.966
   83   2HB   GLN  11          1HB       GLN  11  -7.748   6.772   1.383
   84   1HG   GLN  11          2HG       GLN  11  -9.448   5.331   2.730
   85   2HG   GLN  11          1HG       GLN  11  -9.064   6.415   4.067
   86   1HE2  GLN  11          1HE2      GLN  11 -10.080   8.454   4.072
   87   2HE2  GLN  11          2HE2      GLN  11 -11.000   9.063   2.782
   88    H    VAL  12           H        VAL  12  -5.271   3.431   1.797
   89    HA   VAL  12           HA       VAL  12  -6.543   3.151  -0.870
   90    HB   VAL  12           HB       VAL  12  -4.361   4.133  -1.055
   91   1HG1  VAL  12          1HG1      VAL  12  -3.597   3.378   1.211
   92   2HG1  VAL  12          2HG1      VAL  12  -2.383   3.184  -0.054
   93   3HG1  VAL  12          3HG1      VAL  12  -3.288   1.783   0.519
   94   1HG2  VAL  12          1HG2      VAL  12  -5.028   1.568  -2.127
   95   2HG2  VAL  12          2HG2      VAL  12  -3.298   1.578  -1.782
   96   3HG2  VAL  12          3HG2      VAL  12  -3.993   2.806  -2.840
   97    H    GLU  13           H        GLU  13  -7.858   1.351  -0.476
   98    HA   GLU  13           HA       GLU  13  -8.408  -0.863   0.147
   99   1HB   GLU  13          2HB       GLU  13  -6.206  -0.796  -1.720
  100   2HB   GLU  13          1HB       GLU  13  -6.051  -2.199  -0.661
  101   1HG   GLU  13          2HG       GLU  13  -8.731  -2.245  -1.211
  102   2HG   GLU  13          1HG       GLU  13  -8.077  -1.618  -2.726
  103    H    LEU  14           H        LEU  14  -7.709   0.269   2.445
  104    HA   LEU  14           HA       LEU  14  -5.410  -0.441   3.834
  105   1HB   LEU  14          2HB       LEU  14  -8.211   0.107   4.565
  106   2HB   LEU  14          1HB       LEU  14  -7.339  -0.878   5.741
  107    HG   LEU  14           HG       LEU  14  -6.257   1.711   4.600
  108   1HD1  LEU  14          1HD1      LEU  14  -8.439   1.580   6.218
  109   2HD1  LEU  14          2HD1      LEU  14  -7.270   2.899   6.268
  110   3HD1  LEU  14          3HD1      LEU  14  -7.151   1.571   7.424
  111   1HD2  LEU  14          1HD2      LEU  14  -4.393   1.243   5.793
  112   2HD2  LEU  14          2HD2      LEU  14  -5.029  -0.393   5.970
  113   3HD2  LEU  14          3HD2      LEU  14  -5.337   0.812   7.221
  114    H    GLY  15           H        GLY  15  -5.258  -2.226   5.566
  115   1HA   GLY  15          2HA       GLY  15  -6.692  -4.709   5.073
  116   2HA   GLY  15          1HA       GLY  15  -5.043  -4.751   4.446
  117    HA   PRO  16           HA       PRO  16  -4.943  -4.404   9.254
  118   1HB   PRO  16          2HB       PRO  16  -7.146  -5.523  10.459
  119   2HB   PRO  16          1HB       PRO  16  -7.007  -3.797  10.078
  120   1HG   PRO  16          2HG       PRO  16  -8.621  -5.897   8.707
  121   2HG   PRO  16          1HG       PRO  16  -8.897  -4.150   8.796
  122   1HD   PRO  16          2HD       PRO  16  -7.813  -5.544   6.584
  123   2HD   PRO  16          1HD       PRO  16  -7.791  -3.783   6.823
  124    H    GLY  17           H        GLY  17  -3.533  -6.190   8.207
  125   1HA   GLY  17          2HA       GLY  17  -2.556  -8.271   8.911
  126   2HA   GLY  17          1HA       GLY  17  -4.111  -8.734   9.607
  127    HA   PRO  18           HA       PRO  18  -4.459  -9.502   4.888
  128   1HB   PRO  18          2HB       PRO  18  -2.156  -9.167   3.424
  129   2HB   PRO  18          1HB       PRO  18  -3.341  -7.877   3.691
  130   1HG   PRO  18          2HG       PRO  18  -0.655  -8.239   4.931
  131   2HG   PRO  18          1HG       PRO  18  -1.574  -6.749   4.663
  132   1HD   PRO  18          2HD       PRO  18  -1.333  -8.128   7.125
  133   2HD   PRO  18          1HD       PRO  18  -2.498  -6.838   6.759
  134    H    SER  19           H        SER  19  -0.959 -10.149   5.056
  135    HA   SER  19           HA       SER  19  -1.609 -13.069   5.102
  136   1HB   SER  19          2HB       SER  19   1.102 -12.560   4.304
  137   2HB   SER  19          1HB       SER  19  -0.197 -13.291   3.366
  138    HG   SER  19           HG       SER  19  -0.880 -11.178   2.827
  139    H    GLY  20           H        GLY  20  -0.098 -10.491   6.791
  140   1HA   GLY  20          2HA       GLY  20   0.824 -12.409   8.849
  141   2HA   GLY  20          1HA       GLY  20   2.035 -11.311   8.184
  142    H    ASP  21           H        ASP  21   1.815 -10.903  10.743
  143    HA   ASP  21           HA       ASP  21   1.315  -9.290  12.372
  144   1HB   ASP  21          2HB       ASP  21   0.071  -7.655  10.156
  145   2HB   ASP  21          1HB       ASP  21   0.854  -7.081  11.628
  146    H    MET  22           H        MET  22  -0.482  -8.633  13.674
  147    HA   MET  22           HA       MET  22  -3.206  -8.736  12.779
  148   1HB   MET  22          2HB       MET  22  -3.669 -10.843  14.323
  149   2HB   MET  22          1HB       MET  22  -3.220 -11.050  12.631
  150   1HG   MET  22          2HG       MET  22  -1.292 -12.078  13.188
  151   2HG   MET  22          1HG       MET  22  -0.864 -10.795  14.317
  152   1HE   MET  22          1HE       MET  22  -3.892 -14.034  14.954
  153   2HE   MET  22          2HE       MET  22  -2.365 -14.715  14.398
  154   3HE   MET  22          3HE       MET  22  -3.146 -13.442  13.462
  155    H    ALA  23           H        ALA  23  -1.589  -9.881  15.768
  156    HA   ALA  23           HA       ALA  23  -2.081  -7.434  17.204
  157   1HB   ALA  23          1HB       ALA  23  -4.112  -9.640  17.377
  158   2HB   ALA  23          2HB       ALA  23  -4.366  -7.896  17.333
  159   3HB   ALA  23          3HB       ALA  23  -3.772  -8.663  18.805
  160    H    ALA  24           H        ALA  24   0.234  -8.275  17.419
  161    HA   ALA  24           HA       ALA  24   0.385 -10.063  19.811
  162   1HB   ALA  24          1HB       ALA  24   1.151 -11.096  17.570
  163   2HB   ALA  24          2HB       ALA  24   2.270 -11.197  18.930
  164   3HB   ALA  24          3HB       ALA  24   2.517  -9.984  17.674
  165    H    LYS  25           H        LYS  25   1.074  -8.796  21.462
  166    HA   LYS  25           HA       LYS  25   2.402  -7.279  22.664
  167   1HB   LYS  25          2HB       LYS  25   4.268  -8.512  21.508
  168   2HB   LYS  25          1HB       LYS  25   4.194  -7.310  20.219
  169   1HG   LYS  25          2HG       LYS  25   4.272  -5.927  22.723
  170   2HG   LYS  25          1HG       LYS  25   5.569  -7.124  22.711
  171   1HD   LYS  25          2HD       LYS  25   5.203  -5.567  20.208
  172   2HD   LYS  25          1HD       LYS  25   5.830  -4.675  21.594
  173   1HE   LYS  25          2HE       LYS  25   7.477  -6.648  21.873
  174   2HE   LYS  25          1HE       LYS  25   7.014  -7.093  20.230
  175   1HZ   LYS  25          1HZ       LYS  25   7.753  -4.308  20.754
  176   2HZ   LYS  25          2HZ       LYS  25   7.975  -5.245  19.354
  177   3HZ   LYS  25          3HZ       LYS  25   8.996  -5.461  20.694
  178    H    MET  26           H        MET  26   0.627  -5.733  22.358
  179    HA   MET  26           HA       MET  26   1.543  -3.347  20.896
  180   1HB   MET  26          2HB       MET  26   0.242  -4.497  19.176
  181   2HB   MET  26          1HB       MET  26  -1.109  -4.689  20.293
  182   1HG   MET  26          2HG       MET  26  -1.882  -2.660  19.714
  183   2HG   MET  26          1HG       MET  26  -0.376  -1.927  20.266
  184   1HE   MET  26          1HE       MET  26  -0.778  -3.963  16.207
  185   2HE   MET  26          2HE       MET  26  -2.271  -3.394  16.950
  186   3HE   MET  26          3HE       MET  26  -1.248  -4.543  17.809
  187    H    SER  27           H        SER  27  -1.054  -4.834  22.807
  188    HA   SER  27           HA       SER  27  -0.911  -3.017  24.958
  189   1HB   SER  27          2HB       SER  27  -2.893  -1.579  24.510
  190   2HB   SER  27          1HB       SER  27  -1.592  -1.285  23.361
  191    HG   SER  27           HG       SER  27  -3.986  -2.748  23.013
  192    H    LYS  28           H        LYS  28  -2.896  -3.204  26.386
  193    HA   LYS  28           HA       LYS  28  -4.546  -5.592  25.700
  194   1HB   LYS  28          2HB       LYS  28  -2.464  -5.556  27.609
  195   2HB   LYS  28          1HB       LYS  28  -3.969  -5.519  28.528
  196   1HG   LYS  28          2HG       LYS  28  -3.999  -7.764  28.206
  197   2HG   LYS  28          1HG       LYS  28  -4.542  -7.368  26.575
  198   1HD   LYS  28          2HD       LYS  28  -2.585  -8.023  25.652
  199   2HD   LYS  28          1HD       LYS  28  -1.636  -7.176  26.874
  200   1HE   LYS  28          2HE       LYS  28  -2.405  -9.107  28.455
  201   2HE   LYS  28          1HE       LYS  28  -2.754  -9.969  26.955
  202   1HZ   LYS  28          1HZ       LYS  28  -0.255  -9.487  28.189
  203   2HZ   LYS  28          2HZ       LYS  28  -0.266  -8.812  26.630
  204   3HZ   LYS  28          3HZ       LYS  28  -0.612 -10.462  26.847
  205    H    LYS  29           H        LYS  29  -6.622  -4.907  25.751
  206    HA   LYS  29           HA       LYS  29  -7.499  -3.229  28.044
  207   1HB   LYS  29          2HB       LYS  29  -8.774  -1.749  26.554
  208   2HB   LYS  29          1HB       LYS  29  -7.059  -1.691  26.143
  209   1HG   LYS  29          2HG       LYS  29  -7.453  -3.355  24.343
  210   2HG   LYS  29          1HG       LYS  29  -9.173  -3.342  24.727
  211   1HD   LYS  29          2HD       LYS  29  -9.103  -0.818  24.337
  212   2HD   LYS  29          1HD       LYS  29  -7.500  -1.069  23.644
  213   1HE   LYS  29          2HE       LYS  29  -8.395  -2.552  21.952
  214   2HE   LYS  29          1HE       LYS  29  -9.990  -2.520  22.707
  215   1HZ   LYS  29          1HZ       LYS  29 -10.422  -0.450  21.933
  216   2HZ   LYS  29          2HZ       LYS  29  -9.359  -0.946  20.705
  217   3HZ   LYS  29          3HZ       LYS  29  -8.800   0.042  21.969
  218    H    LYS  30           H        LYS  30  -9.942  -3.240  28.204
  219    HA   LYS  30           HA       LYS  30 -10.972  -5.885  27.274
  220   1HB   LYS  30          2HB       LYS  30 -11.969  -4.141  29.548
  221   2HB   LYS  30          1HB       LYS  30 -12.525  -5.771  29.158
  222   1HG   LYS  30          2HG       LYS  30  -9.615  -5.611  29.453
  223   2HG   LYS  30          1HG       LYS  30 -10.476  -5.148  30.921
  224   1HD   LYS  30          2HD       LYS  30 -11.862  -7.390  29.990
  225   2HD   LYS  30          1HD       LYS  30 -10.163  -7.785  29.727
  226   1HE   LYS  30          2HE       LYS  30  -9.626  -7.392  32.035
  227   2HE   LYS  30          1HE       LYS  30 -11.212  -6.684  32.344
  228   1HZ   LYS  30          1HZ       LYS  30 -12.233  -8.809  31.903
  229   2HZ   LYS  30          2HZ       LYS  30 -11.054  -8.985  33.114
  230   3HZ   LYS  30          3HZ       LYS  30 -10.731  -9.499  31.526
  231    H    ALA  31           H        ALA  31 -11.172  -4.247  25.240
  232    HA   ALA  31           HA       ALA  31 -13.619  -2.620  25.361
  233   1HB   ALA  31          1HB       ALA  31 -11.664  -3.278  23.143
  234   2HB   ALA  31          2HB       ALA  31 -11.862  -1.740  23.984
  235   3HB   ALA  31          3HB       ALA  31 -13.116  -2.311  22.884
  236    H    GLY  32           H        GLY  32 -15.504  -3.077  24.058
  237   1HA   GLY  32          2HA       GLY  32 -16.884  -4.495  22.692
  238   2HA   GLY  32          1HA       GLY  32 -15.687  -5.780  22.861
  239    H    ARG  33           H        ARG  33 -18.590  -5.935  23.356
  240    HA   ARG  33           HA       ARG  33 -18.726  -6.257  26.302
  241   1HB   ARG  33          2HB       ARG  33 -21.157  -6.835  25.772
  242   2HB   ARG  33          1HB       ARG  33 -20.663  -5.185  25.392
  243   1HG   ARG  33          2HG       ARG  33 -20.679  -5.558  23.103
  244   2HG   ARG  33          1HG       ARG  33 -20.372  -7.287  23.277
  245   1HD   ARG  33          2HD       ARG  33 -22.579  -7.760  23.332
  246   2HD   ARG  33          1HD       ARG  33 -22.886  -6.504  24.530
  247    HE   ARG  33           HE       ARG  33 -23.162  -6.220  21.622
  248   1HH1  ARG  33          1HH1      ARG  33 -22.108  -4.473  24.353
  249   2HH1  ARG  33          2HH1      ARG  33 -23.054  -3.065  24.005
  250   1HH2  ARG  33          1HH2      ARG  33 -24.685  -4.502  21.304
  251   2HH2  ARG  33          2HH2      ARG  33 -24.514  -3.081  22.278
  252    H    GLY  34           H        GLY  34 -19.371  -8.315  27.227
  253   1HA   GLY  34          2HA       GLY  34 -18.465 -10.613  25.563
  254   2HA   GLY  34          1HA       GLY  34 -18.524 -10.597  27.325